*HEADER    ISOMERASE                               07-JUN-00   1F40              
*TITLE     SOLUTION STRUCTURE OF FKBP12 COMPLEXED WITH GPI-1046, A               
*TITLE    2 NEUROTROPHIC LIGAND                                                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FK506 BINDING PROTEIN (FKBP12);                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 OTHER_DETAILS: PROTEIN COORDINATES WERE TAKEN FROM THE               
*COMPND   6 CRYSTAL STRUCTURE BY HOLT ET AL. (1993, PDB ACCESSION CODE           
*COMPND   7 1FKG).                                                               
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGAN: BRAIN;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PARS-3                                    
*KEYWDS    ISOMERASE                                                             
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    C.SICH, S.IMPROTA, D.J.COWLEY, C.GUENET, J.P.MERLY,                   
*AUTHOR   2 M.TEUFEL, V.SAUDEK                                                   
*REVDAT   1   08-NOV-00 1F40    0                                                
assign (resi   56  and name HG2*)  
((resi  108  and name H18) OR (resi  108  and name H20))       4.00    4.00    0.50   
assign (resi   56  and name HG2*)  (resi  108  and name H141)  4.00    4.00    0.50   
assign (resi   55  and name HG1*)  (resi  108  and name H141)  4.00    4.00    0.50   
assign (resi   55  and name HG1*)  (resi  108  and name H31)   4.00    4.00    0.50   
assign (resi   55  and name HG1*)  (resi  108  and name H2)    4.00    4.00    0.50   
assign (resi   55  and name HG1*)  (resi  108  and name H42)   4.00    4.00    0.50   
assign (resi   91  and name HD1*)  (resi  108  and name H11*)  4.00    4.00    0.50   
assign (resi   90  and name HD1*)  (resi  108  and name H11*)  4.00    4.00    0.50   
assign (resi   90  and name HG2*)  (resi  108  and name H11*)  4.00    4.00    0.50   
assign (resi   56  and name HG2*)  (resi  108  and name H142)  3.00    3.00    0.50
assign (resi   59  and name HZ2)  (resi  108  and name H41)    4.00    4.00    0.50 
assign (resi  108  and name H15*)  
((resi   56  and name HG2*) OR  (resi   55  and name HG1*))    4.00    4.00    0.50   
assign ((resi   87  and name HD2) OR  (resi   82  and name HE*))
(resi  108  and name H11*)       4.00    4.00    0.50 
assign (resi   87  and name HD2)
((resi  108  and name H12*) OR (resi  108  and name H13*))     4.00    4.00    0.50 
assign (resi  108  and name H32)
((resi  46  and name HE*) OR (resi  46  and name HZ))     4.00    4.00    0.50 
assign (resi  108  and name H22)  (resi   55  and name HA)     5.00    5.00    0.50 
assign ((resi   87  and name HD2) OR  (resi   82  and name HE*))
((resi  108  and name H18) OR (resi  108  and name H20))       5.00    5.00    0.50 
assign (resi  108  and name H22)  (resi   56  and name HG2*)   5.00    5.00    0.50 
assign ((resi  108  and name H12*) OR (resi  108  and name H13*))  
       ((resi  108  and name H18) OR  (resi  108  and name H20))    5.00    5.00    0.50    
assign (resi  108  and name H162)  (resi  108  and name H142)    5.00    5.00    0.50    
assign (resi  108  and name H142)  (resi  108  and name H161)    5.00    5.00    0.50    
assign (resi  108  and name H2)  ((resi  108  and name H12*) OR (resi  108  and name H13*))    5.00    5.00    0.50    
assign (resi  108  and name H142)  ((resi  108  and name H18) OR  (resi  108  and name H20))    5.00    5.00    0.50    
assign (resi  108  and name H52)  (resi  108  and name H11*)    5.00    5.00    0.50    
assign (resi  108  and name H51)  (resi  108  and name H11*)    5.00    5.00    0.50    
assign (resi  108  and name H2)  (resi  108  and name H42)    4.00    4.00    0.50   
assign (resi  108  and name H51)  (resi  108  and name H31)    4.00    4.00    0.50   
assign (resi  108  and name H52)  (resi  108  and name H31)    4.00    4.00    0.50   
assign (resi  108  and name H11*)  ((resi  108  and name H12*) OR (resi  108  and name H13*))    4.00    4.00    0.50   
assign ((resi  108  and name H18) OR  (resi  108  and name H20))  (resi  108  and name H161)    4.00    4.00    0.50   
assign (resi  108  and name H22)  (resi  108  and name H15*)    4.00    4.00    0.50   
assign (resi  108  and name H141)  (resi  108  and name H162)    4.00    4.00    0.50   
assign (resi  108  and name H32)  (resi  108  and name H51)    4.00    4.00    0.50   
assign (resi  108  and name H141)  ((resi  108  and name H18) OR  (resi  108  and name H20))    4.00    4.00    0.50   
assign (resi  108  and name H15*)  ((resi  108  and name H18) OR  (resi  108  and name H20))    4.00    4.00    0.50   
assign (resi  108  and name H141)  (resi  108  and name H22)    4.00    4.00    0.50   
assign (resi  108  and name H162)  (resi  108  and name H22)    4.00    4.00    0.50   
assign ((resi  108  and name H18) OR  (resi  108  and name H20))  (resi  108  and name H142)    4.00    4.00    0.50   
assign (resi  108  and name H22)  (resi  108  and name H142)    4.00    4.00    0.50   
assign (resi  108  and name H15*)  ((resi  108  and name H12*) OR (resi  108  and name H13*))    4.00    4.00    0.50   
assign ((resi  108  and name H12*) OR (resi  108  and name H13*))  (resi  108  and name H141)    4.00    4.00    0.50   
assign ((resi  108  and name H12*) OR (resi  108  and name H13*))  (resi  108  and name H142)    4.00    4.00    0.50   
assign (resi  108  and name H102)  (resi  108  and name H11*)    4.00    4.00    0.50   
assign (resi  108  and name H11*)  (resi  108  and name H101)    4.00    4.00    0.50   
assign (resi  108  and name H51)  (resi  108  and name H2)    3.00    3.00    0.50    
assign (resi  108  and name H52)  (resi  108  and name H32)    3.00    3.00    0.50    
assign (resi  108  and name H41)  (resi  108  and name H32)    3.00    3.00    0.50    
assign (resi  108  and name H51)  (resi  108  and name H42)    3.00    3.00    0.50    
assign (resi  108  and name H52)  (resi  108  and name H41)    3.00    3.00    0.50    
assign (resi  108  and name H2)  (resi  108  and name H41)    3.00    3.00    0.50    
assign (resi  108  and name H31)  (resi  108  and name H41)    3.00    3.00    0.50    
assign (resi  108  and name H42)  (resi  108  and name H31)    3.00    3.00    0.50    
assign ((resi  108  and name H18) OR  (resi  108  and name H20))  (resi  108  and name H162)    3.00    3.00    0.50    
assign (resi  108  and name H22)  (resi  108  and name H161)    3.00    3.00    0.50    
assign (resi  108  and name H141)  (resi  108  and name H161)    3.00    3.00    0.50    
assign (resi  108  and name H142)  (resi  108  and name H15*)    3.00    3.00    0.50    
assign (resi  108  and name H141)  (resi  108  and name H15*)    3.00    3.00    0.50    
assign (resi  108  and name H51)  ((resi  108  and name H12*) OR (resi  108  and name H13*))    3.00    3.00    0.50    
assign (resi  108  and name H52)  ((resi  108  and name H12*) OR (resi  108  and name H13*))    3.00    3.00    0.50    
assign (resi  108  and name H20)  (resi  108  and name H21)    3.00    3.00    0.50    
assign ((resi  108  and name H12*) OR (resi  108  and name H13*))  (resi  108  and name H102)    3.00    3.00    0.50    
assign (resi  108  and name H32)  (resi  108  and name H2)    3.00    3.00    0.50    
assign (resi  108  and name H31)  (resi  108  and name H32)    2.30    2.30    0.50    
assign (resi  108  and name H52)  (resi  108  and name H42)    2.30    2.30    0.50    
assign (resi  108  and name H32)  (resi  108  and name H42)    2.30    2.30    0.50    
assign (resi  108  and name H51)  (resi  108  and name H41)    2.30    2.30    0.50    
assign (resi  108  and name H42)  (resi  108  and name H41)    2.30    2.30    0.50    
assign (resi  108  and name H31)  (resi  108  and name H2)    2.30    2.30    0.50    
assign (resi  108  and name H141)  (resi  108  and name H142)    2.30    2.30    0.50    
assign (resi  108  and name H15*)  (resi  108  and name H162)    2.30    2.30    0.50    
assign (resi  108  and name H15*)  (resi  108  and name H161)    2.30    2.30    0.50    
assign (resi  108  and name H21)  (resi  108  and name H22)    2.30    2.30    0.50    
assign (resi  108  and name H101)  (resi  108  and name H102)    2.30    2.30    0.50    
assign ((resi  108  and name H12*) OR (resi  108  and name H13*))  (resi  108  and name H101)    2.30    2.30    0.50    


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLY   1          1H        GLY   1 -10.184  -5.719 -15.429
    2   2H    GLY   1          2H        GLY   1  -9.174  -4.435 -15.868
    3   3H    GLY   1          3H        GLY   1  -9.873  -4.487 -14.313
    4   1HA   GLY   1          1HA       GLY   1  -8.596  -6.397 -13.736
    5   2HA   GLY   1          2HA       GLY   1  -7.913  -6.427 -15.370
    6    H    VAL   2           H        VAL   2  -5.836  -6.109 -14.257
    7    HA   VAL   2           HA       VAL   2  -5.182  -3.271 -13.801
    8    HB   VAL   2           HB       VAL   2  -5.014  -4.369 -11.645
    9   1HG1  VAL   2          1HG1      VAL   2  -5.039  -6.651 -11.975
   10   2HG1  VAL   2          2HG1      VAL   2  -3.356  -6.388 -11.518
   11   3HG1  VAL   2          3HG1      VAL   2  -3.786  -6.592 -13.216
   12   1HG2  VAL   2          1HG2      VAL   2  -2.738  -3.984 -11.113
   13   2HG2  VAL   2          2HG2      VAL   2  -2.994  -2.998 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.185  -4.560 -12.685
   15    H    GLN   3           H        GLN   3  -3.402  -2.742 -15.041
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.697 -16.957
   17   1HB   GLN   3          2HB       GLN   3  -3.649  -3.062 -17.956
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.782 -16.984
   19   1HG   GLN   3          2HG       GLN   3  -0.839  -2.076 -18.217
   20   2HG   GLN   3          1HG       GLN   3  -1.636  -3.298 -19.223
   21   1HE2  GLN   3          1HE2      GLN   3  -0.894  -0.070 -19.217
   22   2HE2  GLN   3          2HE2      GLN   3  -2.174   0.477 -20.244
   23    H    VAL   4           H        VAL   4   0.027  -4.829 -16.596
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.551
   25    HB   VAL   4           HB       VAL   4   1.947  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.454  -5.606 -13.276
   27   2HG1  VAL   4          2HG1      VAL   4   3.339  -3.909 -13.739
   28   3HG1  VAL   4          3HG1      VAL   4   4.019  -5.084 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.752 -13.785
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.128 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.450  -5.691 -12.607
   32    H    GLU   5           H        GLU   5   2.589  -1.532 -15.722
   33    HA   GLU   5           HA       GLU   5   3.858  -2.503 -18.204
   34   1HB   GLU   5          2HB       GLU   5   3.406   0.409 -17.569
   35   2HB   GLU   5          1HB       GLU   5   3.766  -0.336 -19.133
   36   1HG   GLU   5          2HG       GLU   5   1.576  -0.578 -19.581
   37   2HG   GLU   5          1HG       GLU   5   1.316  -1.439 -18.055
   38    H    THR   6           H        THR   6   6.172  -2.560 -17.862
   39    HA   THR   6           HA       THR   6   7.249  -1.667 -15.326
   40    HB   THR   6           HB       THR   6   8.547  -2.885 -17.814
   41    HG1  THR   6           HG1      THR   6   7.714  -4.259 -15.467
   42   1HG2  THR   6          1HG2      THR   6  10.110  -3.768 -15.964
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.269 -15.171
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.223 -16.774
   45    H    ILE   7           H        ILE   7   8.484  -0.100 -14.755
   46    HA   ILE   7           HA       ILE   7   9.325   1.984 -16.650
   47    HB   ILE   7           HB       ILE   7   9.174   1.956 -13.592
   48   1HG1  ILE   7          2HG1      ILE   7   7.572   3.425 -15.704
   49   2HG1  ILE   7          1HG1      ILE   7   7.037   1.948 -14.884
   50   1HG2  ILE   7          1HG2      ILE   7  10.902   3.494 -13.979
   51   2HG2  ILE   7          2HG2      ILE   7   9.451   4.491 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.147   4.115 -15.446
   53   1HD1  ILE   7          1HD1      ILE   7   6.104   4.220 -14.095
   54   2HD1  ILE   7          2HD1      ILE   7   7.674   4.426 -13.318
   55   3HD1  ILE   7          3HD1      ILE   7   6.645   3.062 -12.878
   56    H    SER   8           H        SER   8  10.603  -0.023 -13.869
   57    HA   SER   8           HA       SER   8  13.150  -0.214 -15.311
   58   1HB   SER   8          2HB       SER   8  12.963   0.239 -12.319
   59   2HB   SER   8          1HB       SER   8  14.443   0.042 -13.267
   60    HG   SER   8           HG       SER   8  13.495   1.892 -14.558
   61    HA   PRO   9           HA       PRO   9  12.195  -4.487 -14.335
   62   1HB   PRO   9          2HB       PRO   9  15.067  -4.994 -14.686
   63   2HB   PRO   9          1HB       PRO   9  13.700  -5.632 -15.586
   64   1HG   PRO   9          2HG       PRO   9  15.267  -3.814 -16.725
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.706 -16.935
   66   1HD   PRO   9          1HD       PRO   9  15.270  -2.167 -14.991
   67   2HD   PRO   9          2HD       PRO   9  14.046  -1.541 -16.074
   68    H    GLY  10           H        GLY  10  12.403  -6.054 -12.856
   69   1HA   GLY  10          2HA       GLY  10  13.703  -5.350 -10.324
   70   2HA   GLY  10          1HA       GLY  10  12.397  -6.526 -10.541
   71    H    ASP  11           H        ASP  11  13.970  -8.174  -9.354
   72    HA   ASP  11           HA       ASP  11  16.402  -8.726 -10.873
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.365  -9.170
   74   2HB   ASP  11          1HB       ASP  11  16.351  -8.884  -8.382
   75    H    GLY  12           H        GLY  12  13.237  -9.676 -11.216
   76   1HA   GLY  12          2HA       GLY  12  12.273 -11.204 -12.648
   77   2HA   GLY  12          1HA       GLY  12  13.901 -11.646 -13.185
   78    H    ARG  13           H        ARG  13  13.568 -12.073  -9.752
   79    HA   ARG  13           HA       ARG  13  12.731 -14.857 -10.203
   80   1HB   ARG  13          2HB       ARG  13  15.050 -14.302  -8.383
   81   2HB   ARG  13          1HB       ARG  13  14.617 -15.801  -9.216
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.962 -11.269
   83   2HG   ARG  13          1HG       ARG  13  15.850 -13.397 -10.515
   84   1HD   ARG  13          2HD       ARG  13  17.938 -14.357 -10.543
   85   2HD   ARG  13          1HD       ARG  13  17.368 -14.840  -8.938
   86    HE   ARG  13           HE       ARG  13  16.907 -17.033  -9.824
   87   1HH1  ARG  13          1HH1      ARG  13  18.197 -15.234 -12.843
   88   2HH1  ARG  13          2HH1      ARG  13  19.703 -15.785 -12.189
   89   1HH2  ARG  13          1HH2      ARG  13  17.672 -18.713 -11.202
   90   2HH2  ARG  13          2HH2      ARG  13  18.636 -18.327 -12.589
   91    H    THR  14           H        THR  14  12.901 -12.177  -7.904
   92    HA   THR  14           HA       THR  14  11.727 -13.893  -5.805
   93    HB   THR  14           HB       THR  14  12.787 -11.053  -5.376
   94    HG1  THR  14           HG1      THR  14  14.552 -12.027  -6.114
   95   1HG2  THR  14          1HG2      THR  14  12.295 -13.321  -3.518
   96   2HG2  THR  14          2HG2      THR  14  11.881 -11.615  -3.352
   97   3HG2  THR  14          3HG2      THR  14  13.560 -12.137  -3.191
   98    H    PHE  15           H        PHE  15   9.637 -13.946  -6.443
   99    HA   PHE  15           HA       PHE  15   8.161 -11.405  -6.742
  100   1HB   PHE  15          2HB       PHE  15   7.407 -14.236  -7.450
  101   2HB   PHE  15          1HB       PHE  15   6.391 -12.808  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.945 -11.192  -9.435
  103    HD2  PHE  15           HD2      PHE  15   9.293 -14.723  -8.926
  104    HE1  PHE  15           HE1      PHE  15   7.957 -10.858 -11.648
  105    HE2  PHE  15           HE2      PHE  15  10.270 -14.360 -11.157
  106    HZ   PHE  15           HZ       PHE  15   9.599 -12.443 -12.505
  107    HA   PRO  16           HA       PRO  16   6.582 -11.998  -2.682
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.529  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.841  -9.830  -2.629
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.092  -5.200
  111   2HG   PRO  16          1HG       PRO  16   5.229  -8.736  -4.651
  112   1HD   PRO  16          1HD       PRO  16   6.216 -10.464  -6.438
  113   2HD   PRO  16          2HD       PRO  16   7.246  -9.796  -5.189
  114    H    LYS  17           H        LYS  17   5.299 -13.161  -1.505
  115    HA   LYS  17           HA       LYS  17   3.410 -14.926  -2.910
  116   1HB   LYS  17          2HB       LYS  17   5.301 -15.564  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.167 -16.703  -1.347
  118   1HG   LYS  17          2HG       LYS  17   6.216 -15.321  -3.051
  119   2HG   LYS  17          1HG       LYS  17   6.666 -16.743  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.455 -18.131  -3.362
  121   2HD   LYS  17          1HD       LYS  17   4.099 -16.993  -3.456
  122   1HE   LYS  17          2HE       LYS  17   6.460 -16.407  -5.139
  123   2HE   LYS  17          1HE       LYS  17   5.470 -17.804  -5.592
  124   1HZ   LYS  17          1HZ       LYS  17   4.771 -15.767  -6.650
  125   2HZ   LYS  17          2HZ       LYS  17   4.465 -15.075  -5.138
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.423  -5.664
  127    H    ARG  18           H        ARG  18   1.603 -15.580  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.734   0.104
  129   1HB   ARG  18          2HB       ARG  18  -0.557 -15.877  -0.970
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.688   0.494
  131   1HG   ARG  18          2HG       ARG  18  -1.226 -14.882   1.779
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.487   0.237
  133   1HD   ARG  18          2HD       ARG  18  -3.315 -15.945   1.818
  134   2HD   ARG  18          1HD       ARG  18  -3.128 -16.548   0.164
  135    HE   ARG  18           HE       ARG  18  -1.064 -17.634   1.570
  136   1HH1  ARG  18          2HH1      ARG  18  -4.657 -18.505   1.491
  137   2HH1  ARG  18          1HH1      ARG  18  -4.458 -18.842   3.179
  138   1HH2  ARG  18          2HH2      ARG  18  -1.543 -19.659   3.427
  139   2HH2  ARG  18          1HH2      ARG  18  -1.805 -20.426   1.896
  140    H    GLY  19           H        GLY  19   0.549 -13.148   2.149
  141   1HA   GLY  19          2HA       GLY  19   0.935 -13.448   4.429
  142   2HA   GLY  19          1HA       GLY  19   1.904 -14.879   4.045
  143    H    GLN  20           H        GLN  20   3.267 -12.975   1.915
  144    HA   GLN  20           HA       GLN  20   5.253 -11.988   3.783
  145   1HB   GLN  20          2HB       GLN  20   5.101 -11.880   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.431 -11.204   1.722
  147   1HG   GLN  20          2HG       GLN  20   6.842 -13.491   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.124   1.569
  149   1HE2  GLN  20          1HE2      GLN  20   8.885 -13.777   1.914
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.642   0.259
  151    H    THR  21           H        THR  21   5.898  -9.934   4.063
  152    HA   THR  21           HA       THR  21   3.948  -7.849   3.443
  153    HB   THR  21           HB       THR  21   6.487  -7.829   5.134
  154    HG1  THR  21           HG1      THR  21   5.080  -8.527   6.605
  155   1HG2  THR  21          1HG2      THR  21   4.528  -5.599   4.683
  156   2HG2  THR  21          2HG2      THR  21   6.268  -5.594   4.396
  157   3HG2  THR  21          3HG2      THR  21   5.646  -5.683   6.043
  158    H    CYS  22           H        CYS  22   4.052  -6.679   1.689
  159    HA   CYS  22           HA       CYS  22   6.559  -6.385   0.226
  160   1HB   CYS  22          2HB       CYS  22   3.812  -5.362  -0.487
  161   2HB   CYS  22          1HB       CYS  22   5.233  -5.435  -1.545
  162    HG   CYS  22           HG       CYS  22   4.730  -7.766  -2.074
  163    H    VAL  23           H        VAL  23   7.677  -4.551   0.160
  164    HA   VAL  23           HA       VAL  23   6.771  -2.298   1.836
  165    HB   VAL  23           HB       VAL  23   9.633  -3.180   1.170
  166   1HG1  VAL  23          1HG1      VAL  23   8.493  -0.918   2.758
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.947   1.693
  168   3HG1  VAL  23          3HG1      VAL  23   9.997  -1.663   3.302
  169   1HG2  VAL  23          1HG2      VAL  23   7.797  -3.856   3.414
  170   2HG2  VAL  23          2HG2      VAL  23   9.510  -3.641   3.772
  171   3HG2  VAL  23          3HG2      VAL  23   9.000  -4.855   2.600
  172    H    VAL  24           H        VAL  24   6.138  -0.648   0.303
  173    HA   VAL  24           HA       VAL  24   7.580  -0.658  -2.263
  174    HB   VAL  24           HB       VAL  24   5.483  -0.200  -3.509
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.631  -1.778
  176   2HG1  VAL  24          2HG1      VAL  24   6.177  -2.583  -3.107
  177   3HG1  VAL  24          3HG1      VAL  24   4.459  -2.363  -3.429
  178   1HG2  VAL  24          1HG2      VAL  24   3.267  -0.454  -2.326
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.957  -1.798
  180   3HG2  VAL  24          3HG2      VAL  24   4.141  -0.490  -0.794
  181    H    HIS  25           H        HIS  25   7.790   1.373  -3.360
  182    HA   HIS  25           HA       HIS  25   6.700   3.595  -1.767
  183   1HB   HIS  25          2HB       HIS  25   9.116   3.368  -3.379
  184   2HB   HIS  25          1HB       HIS  25   8.118   4.724  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.081   5.443  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.970   4.835  -2.108
  187    HE1  HIS  25           HE1      HIS  25   8.512   6.539   0.827
  188    HE2  HIS  25           HE2      HIS  25  10.843   6.126   0.050
  189    H    TYR  26           H        TYR  26   5.065   5.000  -2.882
  190    HA   TYR  26           HA       TYR  26   4.445   4.246  -5.633
  191   1HB   TYR  26          2HB       TYR  26   2.140   3.707  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.742  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.747   5.509  -4.440
  194    HD2  TYR  26           HD2      TYR  26   2.895   3.060  -1.679
  195    HE1  TYR  26           HE1      TYR  26  -0.613   6.407  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.551   3.981   0.194
  197    HH   TYR  26           HH       TYR  26  -0.127   6.683   0.103
  198    H    THR  27           H        THR  27   3.221   5.734  -6.796
  199    HA   THR  27           HA       THR  27   2.335   8.164  -5.405
  200    HB   THR  27           HB       THR  27   3.482   8.077  -8.195
  201    HG1  THR  27           HG1      THR  27   4.356   8.923  -5.650
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.783  -8.527
  203   2HG2  THR  27          2HG2      THR  27   3.188  10.687  -7.508
  204   3HG2  THR  27          3HG2      THR  27   1.737   9.971  -6.806
  205    H    GLY  28           H        GLY  28   0.072   8.084  -5.749
  206   1HA   GLY  28          2HA       GLY  28  -1.089   6.460  -7.921
  207   2HA   GLY  28          1HA       GLY  28  -1.923   6.971  -6.445
  208    H    MET  29           H        MET  29  -2.117   7.366  -9.513
  209    HA   MET  29           HA       MET  29  -2.906  10.190  -9.488
  210   1HB   MET  29          2HB       MET  29  -1.481   8.727 -11.720
  211   2HB   MET  29          1HB       MET  29  -2.185  10.342 -11.857
  212   1HG   MET  29          2HG       MET  29  -0.599  11.288 -10.509
  213   2HG   MET  29          1HG       MET  29  -0.178   9.743  -9.751
  214   1HE   MET  29          1HE       MET  29   0.793   8.008 -10.620
  215   2HE   MET  29          2HE       MET  29   2.360   8.218 -11.404
  216   3HE   MET  29          3HE       MET  29   0.961   7.704 -12.348
  217    H    LEU  30           H        LEU  30  -4.550  10.704 -10.718
  218    HA   LEU  30           HA       LEU  30  -6.563   8.804 -11.484
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.615 -10.971
  220   2HB   LEU  30          1HB       LEU  30  -7.161  11.340 -12.384
  221    HG   LEU  30           HG       LEU  30  -8.959  10.997 -11.160
  222   1HD1  LEU  30          1HD1      LEU  30  -8.541   8.872 -10.285
  223   2HD1  LEU  30          2HD1      LEU  30  -8.873   9.872  -8.871
  224   3HD1  LEU  30          3HD1      LEU  30  -7.210   9.451  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.617  12.083  -8.842
  226   2HD2  LEU  30          2HD2      LEU  30  -8.464  13.011 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.019  12.446  -9.495
  228    H    GLU  31           H        GLU  31  -7.370   8.958 -13.976
  229    HA   GLU  31           HA       GLU  31  -5.215   8.503 -15.716
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.085 -16.064
  231   2HB   GLU  31          1HB       GLU  31  -7.056   8.987 -17.474
  232   1HG   GLU  31          2HG       GLU  31  -6.310   6.759 -16.614
  233   2HG   GLU  31          1HG       GLU  31  -7.627   6.865 -15.434
  234    H    ASP  32           H        ASP  32  -6.495  11.595 -14.899
  235    HA   ASP  32           HA       ASP  32  -5.306  12.763 -17.294
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.857 -16.414
  237   2HB   ASP  32          1HB       ASP  32  -7.439  13.611 -16.364
  238    H    GLY  33           H        GLY  33  -3.818  11.613 -14.623
  239   1HA   GLY  33          2HA       GLY  33  -1.526  11.886 -14.228
  240   2HA   GLY  33          1HA       GLY  33  -1.619  13.506 -14.936
  241    H    LYS  34           H        LYS  34  -4.145  13.640 -12.941
  242    HA   LYS  34           HA       LYS  34  -2.768  15.197 -11.019
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.189 -11.901
  244   2HB   LYS  34          1HB       LYS  34  -5.505  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.976  16.471  -9.967
  246   2HG   LYS  34          1HG       LYS  34  -5.697  16.691 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.721  14.717  -8.286
  248   2HD   LYS  34          1HD       LYS  34  -5.073  16.408  -7.890
  249   1HE   LYS  34          2HE       LYS  34  -7.007  14.532  -9.255
  250   2HE   LYS  34          1HE       LYS  34  -7.005  14.870  -7.517
  251   1HZ   LYS  34          1HZ       LYS  34  -8.075  16.370  -9.645
  252   2HZ   LYS  34          2HZ       LYS  34  -6.990  17.299  -8.736
  253   3HZ   LYS  34          3HZ       LYS  34  -8.313  16.534  -7.978
  254    H    LYS  35           H        LYS  35  -1.722  14.607  -9.322
  255    HA   LYS  35           HA       LYS  35  -1.546  11.908  -8.413
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.566  -8.491
  257   2HB   LYS  35          1HB       LYS  35  -0.488  14.442  -7.182
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.541  -5.701
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.724  -7.014
  260   1HD   LYS  35          2HD       LYS  35   2.379  12.751  -5.539
  261   2HD   LYS  35          1HD       LYS  35   2.365  13.634  -7.074
  262   1HE   LYS  35          2HE       LYS  35   0.922  15.362  -6.034
  263   2HE   LYS  35          1HE       LYS  35   1.033  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.281  14.955  -4.340
  265   2HZ   LYS  35          2HZ       LYS  35   2.541  16.412  -4.770
  266   3HZ   LYS  35          3HZ       LYS  35   3.382  15.499  -5.938
  267    H    PHE  36           H        PHE  36  -2.816  11.064  -6.759
  268    HA   PHE  36           HA       PHE  36  -4.244  13.051  -5.102
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.141  -4.493
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.610  -6.201
  271    HD1  PHE  36           HD1      PHE  36  -4.653   8.995  -3.835
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.541   6.621  -4.509
  274    HE2  PHE  36           HE2      PHE  36  -5.280   7.712  -8.565
  275    HZ   PHE  36           HZ       PHE  36  -4.858   5.985  -6.864
  276    H    ASP  37           H        ASP  37  -1.760  10.658  -4.990
  277    HA   ASP  37           HA       ASP  37  -1.055  11.468  -2.360
  278   1HB   ASP  37          2HB       ASP  37  -2.944   9.815  -1.833
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.556  -2.454
  280    H    SER  38           H        SER  38   0.978  10.467  -1.659
  281    HA   SER  38           HA       SER  38   2.321   8.514  -3.298
  282   1HB   SER  38          2HB       SER  38   2.764  10.582  -4.605
  283   2HB   SER  38          1HB       SER  38   3.450  11.334  -3.158
  284    HG   SER  38           HG       SER  38   5.034  10.352  -4.566
  285    H    SER  39           H        SER  39   3.581   7.306  -1.913
  286    HA   SER  39           HA       SER  39   4.091   8.272   0.753
  287   1HB   SER  39          2HB       SER  39   5.451   6.188   0.992
  288   2HB   SER  39          1HB       SER  39   3.790   5.894   0.458
  289    HG   SER  39           HG       SER  39   4.881   4.730  -0.966
  290    H    ARG  40           H        ARG  40   5.672   8.414  -2.311
  291    HA   ARG  40           HA       ARG  40   8.346   8.699  -1.494
  292   1HB   ARG  40          2HB       ARG  40   6.897   9.774  -3.937
  293   2HB   ARG  40          1HB       ARG  40   8.645   9.874  -3.705
  294   1HG   ARG  40          2HG       ARG  40   8.669   7.372  -3.552
  295   2HG   ARG  40          1HG       ARG  40   6.968   7.398  -4.047
  296   1HD   ARG  40          2HD       ARG  40   7.655   8.459  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.346   8.284  -5.687
  298    HE   ARG  40           HE       ARG  40   9.209   5.986  -6.102
  299   1HH1  ARG  40          1HH1      ARG  40   5.580   6.787  -6.202
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.968  -7.893
  301   1HH2  ARG  40          1HH2      ARG  40   7.872   3.982  -6.857
  302   2HH2  ARG  40          2HH2      ARG  40   6.914   4.487  -8.208
  303    H    ASP  41           H        ASP  41   5.606  11.042  -1.764
  304    HA   ASP  41           HA       ASP  41   7.158  13.334  -1.091
  305   1HB   ASP  41          2HB       ASP  41   4.187  12.794  -0.679
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.377  -0.522
  307    H    ARG  42           H        ARG  42   5.682  10.787   0.920
  308    HA   ARG  42           HA       ARG  42   6.301  12.310   3.320
  309   1HB   ARG  42          2HB       ARG  42   5.439   9.439   3.144
  310   2HB   ARG  42          1HB       ARG  42   5.372  10.509   4.552
  311   1HG   ARG  42          2HG       ARG  42   3.750  11.916   3.343
  312   2HG   ARG  42          1HG       ARG  42   3.757  10.733   2.025
  313   1HD   ARG  42          2HD       ARG  42   3.174  10.027   4.870
  314   2HD   ARG  42          1HD       ARG  42   1.919  10.548   3.735
  315    HE   ARG  42           HE       ARG  42   3.115   7.958   3.945
  316   1HH1  ARG  42          1HH1      ARG  42   0.345   9.704   2.080
  317   2HH1  ARG  42          2HH1      ARG  42   1.578   9.540   0.876
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.329   2.839
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.788   1.327
  320    H    ASN  43           H        ASN  43   7.998  10.295   1.243
  321    HA   ASN  43           HA       ASN  43   9.990   9.199   1.289
  322   1HB   ASN  43          2HB       ASN  43  10.556  11.534   2.023
  323   2HB   ASN  43          1HB       ASN  43  10.442  10.969   3.695
  324   1HD2  ASN  43          1HD2      ASN  43  12.041   9.103   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.588   9.743   1.390
  326    H    LYS  44           H        LYS  44   7.798   7.929   2.741
  327    HA   LYS  44           HA       LYS  44   9.467   6.182   4.409
  328   1HB   LYS  44          2HB       LYS  44   8.224   7.817   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.711   7.205   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.013   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.664   5.598   6.829
  332   1HD   LYS  44          2HD       LYS  44   7.583   7.120   8.278
  333   2HD   LYS  44          1HD       LYS  44   6.034   6.935   7.435
  334   1HE   LYS  44          2HE       LYS  44   7.385   4.697   8.961
  335   2HE   LYS  44          1HE       LYS  44   6.178   5.778   9.676
  336   1HZ   LYS  44          1HZ       LYS  44   5.865   3.723   7.644
  337   2HZ   LYS  44          2HZ       LYS  44   4.809   5.044   7.655
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.034   9.023
  339    HA   PRO  45           HA       PRO  45   7.453   3.618   1.207
  340   1HB   PRO  45          2HB       PRO  45   8.336   1.317   2.815
  341   2HB   PRO  45          1HB       PRO  45   8.652   1.688   1.128
  342   1HG   PRO  45          2HG       PRO  45  10.599   1.989   2.946
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.161   1.649
  344   1HD   PRO  45          1HD       PRO  45   9.467   3.382   4.523
  345   2HD   PRO  45          2HD       PRO  45  10.321   4.577   3.569
  346    H    PHE  46           H        PHE  46   5.603   2.322   1.037
  347    HA   PHE  46           HA       PHE  46   3.981   2.332   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.005   3.313   1.481
  349   2HB   PHE  46          1HB       PHE  46   3.339   1.839   0.558
  350    HD1  PHE  46           HD1      PHE  46   1.392   3.118   3.441
  351    HD2  PHE  46           HD2      PHE  46   1.765   0.211   0.359
  352    HE1  PHE  46           HE1      PHE  46  -0.840   2.247   3.983
  353    HE2  PHE  46           HE2      PHE  46  -0.462  -0.654   0.917
  354    HZ   PHE  46           HZ       PHE  46  -1.778   0.357   2.731
  355    H    LYS  47           H        LYS  47   3.424   0.256   4.456
  356    HA   LYS  47           HA       LYS  47   4.541  -2.088   3.050
  357   1HB   LYS  47          2HB       LYS  47   3.967  -1.642   5.984
  358   2HB   LYS  47          1HB       LYS  47   4.455  -3.194   5.293
  359   1HG   LYS  47          2HG       LYS  47   6.483  -2.131   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.001  -0.632   5.255
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.684   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.493  -3.262   6.665
  363   1HE   LYS  47          2HE       LYS  47   8.468  -2.421   5.552
  364   2HE   LYS  47          1HE       LYS  47   8.132  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.000   8.400
  366   2HZ   LYS  47          2HZ       LYS  47   9.621  -1.385   7.635
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.046   7.527
  368    H    PHE  48           H        PHE  48   3.031  -3.771   2.431
  369    HA   PHE  48           HA       PHE  48   0.643  -3.986   4.111
  370   1HB   PHE  48          2HB       PHE  48  -0.872  -4.236   2.306
  371   2HB   PHE  48          1HB       PHE  48   0.050  -2.758   1.980
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.773   0.222
  373    HD2  PHE  48           HD2      PHE  48  -0.909  -6.023   0.770
  374    HE1  PHE  48           HE1      PHE  48   2.258  -3.559  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.439  -6.810  -1.533
  376    HZ   PHE  48           HZ       PHE  48   1.146  -5.557  -2.944
  377    H    MET  49           H        MET  49  -0.030  -6.291   4.275
  378    HA   MET  49           HA       MET  49   1.872  -8.239   3.221
  379   1HB   MET  49          2HB       MET  49   1.322  -8.654   5.477
  380   2HB   MET  49          1HB       MET  49  -0.401  -8.377   5.187
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.502   4.181
  382   2HG   MET  49          1HG       MET  49   1.093 -10.765   4.147
  383   1HE   MET  49          1HE       MET  49   1.595 -10.934   8.132
  384   2HE   MET  49          2HE       MET  49   1.276  -9.410   7.306
  385   3HE   MET  49          3HE       MET  49   2.404 -10.574   6.607
  386    H    LEU  50           H        LEU  50   1.555  -9.321   1.511
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.100  -0.214
  388   1HB   LEU  50          2HB       LEU  50   1.838 -10.577  -0.103
  389   2HB   LEU  50          1HB       LEU  50   0.515 -11.617  -0.635
  390    HG   LEU  50           HG       LEU  50   1.997  -9.556  -2.080
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.295  -2.468
  392   2HD1  LEU  50          2HD1      LEU  50   2.461 -11.927  -2.291
  393   3HD1  LEU  50          3HD1      LEU  50   1.596 -11.431  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.265  -9.495  -3.780
  395   2HD2  LEU  50          2HD2      LEU  50  -0.225  -8.668  -2.302
  396   3HD2  LEU  50          3HD2      LEU  50  -0.850 -10.277  -2.661
  397    H    GLY  51           H        GLY  51  -2.500 -10.135  -0.243
  398   1HA   GLY  51          2HA       GLY  51  -3.966 -11.914  -0.223
  399   2HA   GLY  51          1HA       GLY  51  -2.816 -12.829   0.766
  400    H    LYS  52           H        LYS  52  -3.037  -9.956   2.331
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.123   4.260
  402   1HB   LYS  52          2HB       LYS  52  -2.632  -9.864   4.490
  403   2HB   LYS  52          1HB       LYS  52  -3.668  -8.435   4.367
  404   1HG   LYS  52          2HG       LYS  52  -4.947  -9.342   6.362
  405   2HG   LYS  52          1HG       LYS  52  -3.627 -10.506   6.556
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.610   6.085
  407   2HD   LYS  52          1HD       LYS  52  -3.414  -7.508   6.197
  408   1HE   LYS  52          2HE       LYS  52  -3.790  -8.459   8.458
  409   2HE   LYS  52          1HE       LYS  52  -2.180  -9.179   8.301
  410   1HZ   LYS  52          1HZ       LYS  52  -2.522  -6.809   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.381   7.620
  412   3HZ   LYS  52          3HZ       LYS  52  -1.187  -7.186   8.286
  413    H    GLN  53           H        GLN  53  -5.463  -9.220   1.593
  414    HA   GLN  53           HA       GLN  53  -7.282  -8.072   0.877
  415   1HB   GLN  53          2HB       GLN  53  -8.463  -9.202   3.402
  416   2HB   GLN  53          1HB       GLN  53  -9.382  -8.292   2.194
  417   1HG   GLN  53          2HG       GLN  53  -9.298  -9.999   0.666
  418   2HG   GLN  53          1HG       GLN  53  -7.926 -10.784   1.471
  419   1HE2  GLN  53          1HE2      GLN  53  -9.753 -12.935   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.730   3.276
  421    H    GLU  54           H        GLU  54  -5.348  -6.568   2.309
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.585   3.518
  423   1HB   GLU  54          2HB       GLU  54  -5.239  -3.759   4.725
  424   2HB   GLU  54          1HB       GLU  54  -5.554  -5.463   5.078
  425   1HG   GLU  54          2HG       GLU  54  -3.732  -6.107   3.602
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.398   3.248
  427    H    VAL  55           H        VAL  55  -5.458  -5.033   0.730
  428    HA   VAL  55           HA       VAL  55  -5.542  -2.135   0.239
  429    HB   VAL  55           HB       VAL  55  -3.882  -2.656  -1.663
  430   1HG1  VAL  55          1HG1      VAL  55  -3.276  -2.881   1.282
  431   2HG1  VAL  55          2HG1      VAL  55  -3.214  -1.440   0.268
  432   3HG1  VAL  55          3HG1      VAL  55  -2.005  -2.710   0.073
  433   1HG2  VAL  55          1HG2      VAL  55  -3.254  -5.155  -0.162
  434   2HG2  VAL  55          2HG2      VAL  55  -2.604  -4.583  -1.698
  435   3HG2  VAL  55          3HG2      VAL  55  -4.279  -5.124  -1.596
  436    H    ILE  56           H        ILE  56  -5.906  -1.832  -2.310
  437    HA   ILE  56           HA       ILE  56  -8.394  -3.119  -2.876
  438    HB   ILE  56           HB       ILE  56  -8.229  -1.807  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.913  -0.390  -3.802
  440   2HG1  ILE  56          1HG1      ILE  56  -5.702  -1.648  -5.033
  441   1HG2  ILE  56          1HG2      ILE  56  -9.529  -0.597  -3.670
  442   2HG2  ILE  56          2HG2      ILE  56  -8.132   0.474  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.378  -0.755  -2.342
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.249  -6.672
  445   2HD1  ILE  56          2HD1      ILE  56  -5.492   0.605  -5.993
  446   3HD1  ILE  56          3HD1      ILE  56  -7.123   0.997  -5.448
  447    H    ARG  57           H        ARG  57  -8.930  -4.373  -4.685
  448    HA   ARG  57           HA       ARG  57  -7.301  -6.654  -4.957
  449   1HB   ARG  57          2HB       ARG  57  -9.778  -6.632  -5.311
  450   2HB   ARG  57          1HB       ARG  57  -9.543  -5.686  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.334  -7.514  -7.791
  452   2HG   ARG  57          1HG       ARG  57  -8.505  -8.459  -6.301
  453   1HD   ARG  57          2HD       ARG  57 -10.926  -8.588  -6.656
  454   2HD   ARG  57          1HD       ARG  57 -10.767  -7.626  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.770  -8.135
  456   1HH1  ARG  57          1HH1      ARG  57 -12.265  -9.326  -9.729
  457   2HH1  ARG  57          2HH1      ARG  57 -12.630 -10.669  -8.700
  458   1HH2  ARG  57          1HH2      ARG  57  -9.482 -11.967  -9.049
  459   2HH2  ARG  57          2HH2      ARG  57 -10.210 -11.505 -10.551
  460    H    GLY  58           H        GLY  58  -7.319  -3.873  -7.249
  461   1HA   GLY  58          2HA       GLY  58  -5.786  -5.258  -9.176
  462   2HA   GLY  58          1HA       GLY  58  -5.912  -3.500  -9.004
  463    H    TRP  59           H        TRP  59  -4.853  -3.702  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.018  -3.685  -6.666
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.134  -4.344
  466   2HB   TRP  59          1HB       TRP  59  -2.167  -3.716  -3.949
  467    HD1  TRP  59           HD1      TRP  59  -3.604  -1.156  -6.511
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.903  -6.378
  469    HE3  TRP  59           HE3      TRP  59  -0.322  -2.655  -2.814
  470    HZ2  TRP  59           HZ2      TRP  59   0.090   1.800  -4.976
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.154
  472    HH2  TRP  59           HH2      TRP  59   1.657   1.074  -3.215
  473    H    GLU  60           H        GLU  60  -3.997  -5.884  -4.554
  474    HA   GLU  60           HA       GLU  60  -2.181  -7.808  -3.914
  475   1HB   GLU  60          2HB       GLU  60  -4.937  -8.445  -4.978
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.489  -3.962
  477   1HG   GLU  60          2HG       GLU  60  -4.905  -6.875  -2.951
  478   2HG   GLU  60          1HG       GLU  60  -5.968  -8.292  -2.983
  479    H    GLU  61           H        GLU  61  -3.992  -7.516  -6.944
  480    HA   GLU  61           HA       GLU  61  -2.771  -9.828  -8.164
  481   1HB   GLU  61          2HB       GLU  61  -4.418  -7.607  -9.393
  482   2HB   GLU  61          1HB       GLU  61  -4.041  -9.166 -10.140
  483   1HG   GLU  61          2HG       GLU  61  -5.246  -9.498  -7.529
  484   2HG   GLU  61          1HG       GLU  61  -6.276  -8.538  -8.605
  485    H    GLY  62           H        GLY  62  -2.125  -6.341  -8.334
  486   1HA   GLY  62          2HA       GLY  62  -0.508  -6.787 -10.673
  487   2HA   GLY  62          1HA       GLY  62  -0.757  -5.249  -9.833
  488    H    VAL  63           H        VAL  63   0.133  -5.861  -7.305
  489    HA   VAL  63           HA       VAL  63   2.943  -5.682  -7.764
  490    HB   VAL  63           HB       VAL  63   1.302  -5.995  -5.198
  491   1HG1  VAL  63          1HG1      VAL  63   3.647  -6.697  -4.934
  492   2HG1  VAL  63          2HG1      VAL  63   3.349  -5.180  -4.082
  493   3HG1  VAL  63          3HG1      VAL  63   4.186  -5.171  -5.633
  494   1HG2  VAL  63          1HG2      VAL  63   0.933  -3.779  -6.427
  495   2HG2  VAL  63          2HG2      VAL  63   2.678  -3.532  -6.449
  496   3HG2  VAL  63          3HG2      VAL  63   1.806  -3.529  -4.916
  497    H    ALA  64           H        ALA  64   0.821  -8.473  -7.070
  498    HA   ALA  64           HA       ALA  64   2.871 -10.243  -6.295
  499   1HB   ALA  64          1HB       ALA  64   0.455 -10.983  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.406 -10.689  -6.178
  501   3HB   ALA  64          3HB       ALA  64   1.385 -12.007  -6.820
  502    H    GLN  65           H        GLN  65   2.109  -8.870  -9.375
  503    HA   GLN  65           HA       GLN  65   3.584 -10.842 -10.888
  504   1HB   GLN  65          2HB       GLN  65   2.248  -8.222 -11.564
  505   2HB   GLN  65          1HB       GLN  65   3.243  -9.099 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.822 -11.070 -12.541
  507   2HG   GLN  65          1HG       GLN  65   0.884 -10.309 -11.244
  508   1HE2  GLN  65          1HE2      GLN  65  -1.178  -9.487 -12.158
  509   2HE2  GLN  65          2HE2      GLN  65  -0.903  -8.129 -13.190
  510    H    MET  66           H        MET  66   4.752  -8.571  -8.816
  511    HA   MET  66           HA       MET  66   6.777  -7.619 -10.721
  512   1HB   MET  66          2HB       MET  66   5.985  -6.535  -8.025
  513   2HB   MET  66          1HB       MET  66   7.237  -5.863  -9.079
  514   1HG   MET  66          2HG       MET  66   5.598  -5.381 -10.782
  515   2HG   MET  66          1HG       MET  66   4.327  -6.153  -9.815
  516   1HE   MET  66          1HE       MET  66   7.230  -3.851  -8.686
  517   2HE   MET  66          2HE       MET  66   6.481  -2.253  -8.657
  518   3HE   MET  66          3HE       MET  66   6.730  -3.084 -10.192
  519    H    SER  67           H        SER  67   8.935  -7.975 -10.280
  520    HA   SER  67           HA       SER  67   9.649  -9.757  -8.078
  521   1HB   SER  67          2HB       SER  67  11.858  -9.704  -9.291
  522   2HB   SER  67          1HB       SER  67  10.495 -10.434 -10.151
  523    HG   SER  67           HG       SER  67  10.483  -8.800 -11.554
  524    H    VAL  68           H        VAL  68  11.482  -9.147  -6.637
  525    HA   VAL  68           HA       VAL  68  11.308  -6.545  -5.628
  526    HB   VAL  68           HB       VAL  68  13.513  -8.620  -5.346
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.416  -3.309
  528   2HG1  VAL  68          2HG1      VAL  68  12.989  -6.166  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.360  -6.391  -4.731
  530   1HG2  VAL  68          1HG2      VAL  68  11.724  -9.651  -4.480
  531   2HG2  VAL  68          2HG2      VAL  68  10.882  -8.142  -4.130
  532   3HG2  VAL  68          3HG2      VAL  68  12.173  -8.698  -3.065
  533    H    GLY  69           H        GLY  69  12.138  -4.763  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.884  -3.300  -6.746
  535   2HA   GLY  69          1HA       GLY  69  14.458  -4.529  -7.883
  536    H    GLN  70           H        GLN  70  11.269  -4.687  -8.435
  537    HA   GLN  70           HA       GLN  70  11.690  -3.131 -10.840
  538   1HB   GLN  70          2HB       GLN  70  10.814  -5.489 -10.677
  539   2HB   GLN  70          1HB       GLN  70   9.325  -4.777 -10.035
  540   1HG   GLN  70          2HG       GLN  70   9.150  -3.444 -12.105
  541   2HG   GLN  70          1HG       GLN  70  10.537  -4.344 -12.741
  542   1HE2  GLN  70          2HE2      GLN  70   9.493  -7.239 -12.034
  543   2HE2  GLN  70          1HE2      GLN  70   7.918  -6.874 -11.426
  544    H    ARG  71           H        ARG  71  10.582  -1.587 -11.625
  545    HA   ARG  71           HA       ARG  71   8.696  -0.178  -9.844
  546   1HB   ARG  71          2HB       ARG  71  10.803   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.687   1.054 -11.765
  548   1HG   ARG  71          2HG       ARG  71   8.898   2.569 -11.794
  549   2HG   ARG  71          1HG       ARG  71   8.397   2.160 -10.146
  550   1HD   ARG  71          2HD       ARG  71  10.283   3.311  -9.214
  551   2HD   ARG  71          1HD       ARG  71  10.989   3.554 -10.820
  552    HE   ARG  71           HE       ARG  71   8.425   4.696 -10.780
  553   1HH1  ARG  71          2HH1      ARG  71  11.613   5.179  -9.290
  554   2HH1  ARG  71          1HH1      ARG  71  11.463   6.904  -9.284
  555   1HH2  ARG  71          1HH2      ARG  71   8.120   6.875 -10.464
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.986
  557    H    ALA  72           H        ALA  72   6.801  -0.069 -10.813
  558    HA   ALA  72           HA       ALA  72   6.469  -0.149 -13.715
  559   1HB   ALA  72          1HB       ALA  72   5.012  -2.006 -13.696
  560   2HB   ALA  72          2HB       ALA  72   4.894  -1.996 -11.937
  561   3HB   ALA  72          3HB       ALA  72   6.391  -2.503 -12.717
  562    H    LYS  73           H        LYS  73   4.461   0.426 -14.507
  563    HA   LYS  73           HA       LYS  73   2.808   2.084 -12.737
  564   1HB   LYS  73          2HB       LYS  73   3.832   3.036 -14.744
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.822 -15.724
  566   1HG   LYS  73          2HG       LYS  73   0.828   2.876 -14.911
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.217 -14.336
  568   1HD   LYS  73          2HD       LYS  73   2.965   4.301 -16.496
  569   2HD   LYS  73          1HD       LYS  73   1.971   2.953 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.017   4.448 -16.678
  571   2HE   LYS  73          1HE       LYS  73   1.148   5.770 -16.499
  572   1HZ   LYS  73          1HZ       LYS  73   0.808   4.007 -18.847
  573   2HZ   LYS  73          2HZ       LYS  73   2.039   5.156 -18.682
  574   3HZ   LYS  73          3HZ       LYS  73   0.408   5.649 -18.751
  575    H    LEU  74           H        LEU  74   0.909   1.251 -12.075
  576    HA   LEU  74           HA       LEU  74  -0.135  -1.173 -13.369
  577   1HB   LEU  74          2HB       LEU  74   0.213  -0.093 -10.656
  578   2HB   LEU  74          1HB       LEU  74  -1.340  -0.882 -10.938
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.001 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.990  -3.482 -11.266
  581   2HD1  LEU  74          2HD1      LEU  74   2.323  -1.758 -11.425
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.587 -12.650
  583   1HD2  LEU  74          1HD2      LEU  74  -0.467  -1.889  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.230  -1.448  -9.036
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.146  -8.938
  586    H    THR  75           H        THR  75  -1.870  -0.573 -14.790
  587    HA   THR  75           HA       THR  75  -3.497   1.772 -14.023
  588    HB   THR  75           HB       THR  75  -3.434   0.123 -16.596
  589    HG1  THR  75           HG1      THR  75  -1.654   1.266 -16.760
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.967 -17.627
  591   2HG2  THR  75          2HG2      THR  75  -4.845   2.694 -16.038
  592   3HG2  THR  75          3HG2      THR  75  -5.575   1.134 -16.412
  593    H    ILE  76           H        ILE  76  -5.455   1.333 -12.987
  594    HA   ILE  76           HA       ILE  76  -6.291  -1.484 -12.781
  595    HB   ILE  76           HB       ILE  76  -6.388   0.673 -10.637
  596   1HG1  ILE  76          2HG1      ILE  76  -4.508  -1.673 -10.945
  597   2HG1  ILE  76          1HG1      ILE  76  -4.085   0.027 -11.221
  598   1HG2  ILE  76          1HG2      ILE  76  -7.210  -2.170 -10.634
  599   2HG2  ILE  76          2HG2      ILE  76  -8.130  -0.726 -10.214
  600   3HG2  ILE  76          3HG2      ILE  76  -6.834  -1.283  -9.157
  601   1HD1  ILE  76          1HD1      ILE  76  -4.414  -1.467  -8.691
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.221  -8.707
  603   3HD1  ILE  76          3HD1      ILE  76  -3.267  -0.200  -9.126
  604    H    SER  77           H        SER  77  -8.340  -1.763 -13.534
  605    HA   SER  77           HA       SER  77 -10.075   0.348 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.734  -1.397 -14.643
  607   2HB   SER  77          1HB       SER  77 -10.163  -1.886 -15.294
  608    HG   SER  77           HG       SER  77 -11.683  -3.015 -13.261
  609    HA   PRO  78           HA       PRO  78 -12.060   1.321 -10.424
  610   1HB   PRO  78          2HB       PRO  78 -14.776   1.357 -11.227
  611   2HB   PRO  78          1HB       PRO  78 -13.688   2.734 -11.185
  612   1HG   PRO  78          2HG       PRO  78 -14.507   1.056 -13.514
  613   2HG   PRO  78          1HG       PRO  78 -14.012   2.740 -13.487
  614   1HD   PRO  78          1HD       PRO  78 -12.360   0.788 -14.397
  615   2HD   PRO  78          2HD       PRO  78 -11.740   2.212 -13.585
  616    H    ASP  79           H        ASP  79 -13.479  -1.462 -12.055
  617    HA   ASP  79           HA       ASP  79 -14.744  -2.336  -9.643
  618   1HB   ASP  79          2HB       ASP  79 -15.147  -4.411 -10.855
  619   2HB   ASP  79          1HB       ASP  79 -15.489  -3.031 -11.910
  620    H    TYR  80           H        TYR  80 -11.545  -2.401 -10.612
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.457  -8.686
  622   1HB   TYR  80          2HB       TYR  80  -9.560  -3.181 -11.069
  623   2HB   TYR  80          1HB       TYR  80  -8.480  -3.757  -9.788
  624    HD1  TYR  80           HD1      TYR  80 -11.503  -4.892 -11.640
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.877
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.200 -12.484
  627    HE2  TYR  80           HE2      TYR  80  -7.919  -8.145 -10.692
  628    HH   TYR  80           HH       TYR  80  -8.975  -9.434 -12.229
  629    H    ALA  81           H        ALA  81 -11.562  -1.443  -8.396
  630    HA   ALA  81           HA       ALA  81  -9.391  -0.750  -6.537
  631   1HB   ALA  81          1HB       ALA  81  -9.044   0.365  -8.764
  632   2HB   ALA  81          2HB       ALA  81  -9.310   1.510  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.616   1.140  -8.573
  634    H    TYR  82           H        TYR  82 -11.705   1.776  -7.022
  635    HA   TYR  82           HA       TYR  82 -13.144   0.958  -4.576
  636   1HB   TYR  82          2HB       TYR  82 -12.502   3.643  -5.852
  637   2HB   TYR  82          1HB       TYR  82 -13.463   3.448  -4.376
  638    HD1  TYR  82           HD1      TYR  82 -12.315   2.135  -2.427
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.941  -5.711
  640    HE1  TYR  82           HE1      TYR  82 -10.207   2.034  -1.126
  641    HE2  TYR  82           HE2      TYR  82  -8.141   3.837  -4.421
  642    HH   TYR  82           HH       TYR  82  -7.556   3.779  -1.855
  643    H    GLY  83           H        GLY  83 -13.805   0.861  -7.755
  644   1HA   GLY  83          2HA       GLY  83 -15.708   0.432  -8.897
  645   2HA   GLY  83          1HA       GLY  83 -16.439   0.099  -7.320
  646    H    ALA  84           H        ALA  84 -18.269   0.982  -7.434
  647    HA   ALA  84           HA       ALA  84 -18.707   3.584  -8.635
  648   1HB   ALA  84          1HB       ALA  84 -20.323   1.691  -8.790
  649   2HB   ALA  84          2HB       ALA  84 -21.024   3.180  -8.157
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.862  -7.058
  651    H    THR  85           H        THR  85 -18.019   2.428  -5.346
  652    HA   THR  85           HA       THR  85 -19.181   4.738  -4.102
  653    HB   THR  85           HB       THR  85 -16.855   3.115  -3.034
  654    HG1  THR  85           HG1      THR  85 -19.571   2.454  -2.689
  655   1HG2  THR  85          1HG2      THR  85 -19.157   4.616  -1.812
  656   2HG2  THR  85          2HG2      THR  85 -17.432   4.851  -1.533
  657   3HG2  THR  85          3HG2      THR  85 -18.236   3.408  -0.917
  658    H    GLY  86           H        GLY  86 -15.914   4.002  -5.320
  659   1HA   GLY  86          2HA       GLY  86 -14.100   5.462  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.215   6.806  -5.305
  661    H    HIS  87           H        HIS  87 -13.166   7.510  -3.885
  662    HA   HIS  87           HA       HIS  87 -13.464   6.202  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.190   6.025  -2.259
  664   2HB   HIS  87          1HB       HIS  87 -11.086   7.793  -2.210
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.798   0.416
  666    HD2  HIS  87           HD2      HIS  87 -10.710   4.669  -0.092
  667    HE1  HIS  87           HE1      HIS  87 -10.103   7.851   2.598
  668    HE2  HIS  87           HE2      HIS  87 -10.002   5.372   2.223
  669    HA   PRO  88           HA       PRO  88 -15.772  10.118  -0.978
  670   1HB   PRO  88          2HB       PRO  88 -15.862  10.506   1.733
  671   2HB   PRO  88          1HB       PRO  88 -16.875   9.331   0.912
  672   1HG   PRO  88          2HG       PRO  88 -14.225   8.865   2.306
  673   2HG   PRO  88          1HG       PRO  88 -15.723   7.964   2.496
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.988   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.540   6.972   0.307
  676    H    GLY  89           H        GLY  89 -15.166  11.873  -1.573
  677   1HA   GLY  89          2HA       GLY  89 -14.151  13.914  -1.651
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.213
  679    H    ILE  90           H        ILE  90 -12.041  11.022  -1.771
  680    HA   ILE  90           HA       ILE  90  -9.978  12.655  -3.119
  681    HB   ILE  90           HB       ILE  90  -9.843   9.884  -1.826
  682   1HG1  ILE  90          2HG1      ILE  90  -8.444  12.389  -0.968
  683   2HG1  ILE  90          1HG1      ILE  90 -10.099  12.029  -0.441
  684   1HG2  ILE  90          1HG2      ILE  90  -7.308  10.386  -1.932
  685   2HG2  ILE  90          2HG2      ILE  90  -7.713  11.627  -3.117
  686   3HG2  ILE  90          3HG2      ILE  90  -8.066   9.935  -3.460
  687   1HD1  ILE  90          1HD1      ILE  90  -9.335  10.709   1.163
  688   2HD1  ILE  90          2HD1      ILE  90  -7.693  11.180   0.726
  689   3HD1  ILE  90          3HD1      ILE  90  -8.424   9.750  -0.002
  690    H    ILE  91           H        ILE  91 -11.665   9.563  -3.637
  691    HA   ILE  91           HA       ILE  91 -10.634   9.709  -6.403
  692    HB   ILE  91           HB       ILE  91 -11.716   7.252  -4.978
  693   1HG1  ILE  91          2HG1      ILE  91  -9.603   7.976  -3.972
  694   2HG1  ILE  91          1HG1      ILE  91  -9.414   6.461  -4.872
  695   1HG2  ILE  91          1HG2      ILE  91 -10.552   6.112  -6.910
  696   2HG2  ILE  91          2HG2      ILE  91 -10.440   7.708  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.021   7.012  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.508   7.969  -5.199
  699   2HD1  ILE  91          2HD1      ILE  91  -8.593   9.197  -5.852
  700   3HD1  ILE  91          3HD1      ILE  91  -8.368   7.672  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.250  10.298  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.682   9.826  -9.876
  703   2HB   PRO  92          1HB       PRO  92 -15.345  11.254  -9.100
  704   1HG   PRO  92          2HG       PRO  92 -12.861  11.317 -10.115
  705   2HG   PRO  92          1HG       PRO  92 -13.210  12.132  -8.601
  706   1HD   PRO  92          1HD       PRO  92 -12.060   9.357  -8.999
  707   2HD   PRO  92          2HD       PRO  92 -11.420  10.652  -8.011
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.869
  709   1HB   PRO  93          2HB       PRO  93 -18.920   7.282  -9.560
  710   2HB   PRO  93          1HB       PRO  93 -19.088   6.343  -8.086
  711   1HG   PRO  93          2HG       PRO  93 -19.618   9.035  -8.233
  712   2HG   PRO  93          1HG       PRO  93 -19.150   8.220  -6.749
  713   1HD   PRO  93          1HD       PRO  93 -17.516   9.977  -8.525
  714   2HD   PRO  93          2HD       PRO  93 -17.370   9.713  -6.799
  715    H    HIS  94           H        HIS  94 -16.500   4.744  -9.377
  716    HA   HIS  94           HA       HIS  94 -15.944   3.694 -11.309
  717   1HB   HIS  94          2HB       HIS  94 -17.266   6.170 -12.562
  718   2HB   HIS  94          1HB       HIS  94 -16.932   4.652 -13.416
  719    HD1  HIS  94           HD1      HIS  94 -18.295   2.487 -12.155
  720    HD2  HIS  94           HD2      HIS  94 -19.606   6.359 -11.436
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.310 -11.164
  722    HE2  HIS  94           HE2      HIS  94 -21.353   4.657 -10.758
  723    H    ALA  95           H        ALA  95 -13.895   5.538 -10.143
  724    HA   ALA  95           HA       ALA  95 -12.524   6.635 -12.451
  725   1HB   ALA  95          1HB       ALA  95 -12.630   7.329  -9.872
  726   2HB   ALA  95          2HB       ALA  95 -11.237   7.693 -10.891
  727   3HB   ALA  95          3HB       ALA  95 -11.203   6.294  -9.820
  728    H    THR  96           H        THR  96 -10.925   5.698 -13.745
  729    HA   THR  96           HA       THR  96  -9.715   3.198 -13.009
  730    HB   THR  96           HB       THR  96  -9.159   5.171 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.420   3.811 -16.394
  732   1HG2  THR  96          1HG2      THR  96  -7.731   2.635 -14.646
  733   2HG2  THR  96          2HG2      THR  96  -7.064   4.253 -14.874
  734   3HG2  THR  96          3HG2      THR  96  -7.754   3.381 -16.245
  735    H    LEU  97           H        LEU  97  -7.695   3.076 -11.872
  736    HA   LEU  97           HA       LEU  97  -6.463   5.644 -11.104
  737   1HB   LEU  97          2HB       LEU  97  -6.523   2.946  -9.734
  738   2HB   LEU  97          1HB       LEU  97  -5.731   4.393  -9.102
  739    HG   LEU  97           HG       LEU  97  -8.695   3.976  -9.443
  740   1HD1  LEU  97          1HD1      LEU  97  -8.707   3.954  -7.053
  741   2HD1  LEU  97          2HD1      LEU  97  -6.989   4.351  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.510   2.781  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.505   6.246  -9.826
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.407  -8.821
  745   3HD2  LEU  97          3HD2      LEU  97  -8.645   6.198  -8.068
  746    H    VAL  98           H        VAL  98  -4.208   5.848 -11.142
  747    HA   VAL  98           HA       VAL  98  -2.849   3.761 -12.692
  748    HB   VAL  98           HB       VAL  98  -2.520   6.781 -12.883
  749   1HG1  VAL  98          1HG1      VAL  98  -1.027   4.461 -14.105
  750   2HG1  VAL  98          2HG1      VAL  98  -0.378   5.705 -13.035
  751   3HG1  VAL  98          3HG1      VAL  98  -0.882   6.123 -14.673
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.908 -15.157
  753   2HG2  VAL  98          2HG2      VAL  98  -3.415   6.653 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.468   5.572 -14.149
  755    H    PHE  99           H        PHE  99  -1.239   2.911 -11.258
  756    HA   PHE  99           HA       PHE  99  -0.234   4.766  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.720   1.816  -9.168
  758   2HB   PHE  99          1HB       PHE  99   0.436   2.563  -8.052
  759    HD1  PHE  99           HD1      PHE  99  -3.099   2.160  -8.947
  760    HD2  PHE  99           HD2      PHE  99  -0.266   3.912  -6.251
  761    HE1  PHE  99           HE1      PHE  99  -4.903   2.661  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.089   4.402  -4.662
  763    HZ   PHE  99           HZ       PHE  99  -4.397   3.777  -5.220
  764    H    ASP 100           H        ASP 100   1.947   5.076  -9.152
  765    HA   ASP 100           HA       ASP 100   3.709   3.599 -10.963
  766   1HB   ASP 100          2HB       ASP 100   3.846   5.986 -11.158
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.149  -9.411
  768    H    VAL 101           H        VAL 101   4.563   1.927  -9.767
  769    HA   VAL 101           HA       VAL 101   4.827   2.053  -6.828
  770    HB   VAL 101           HB       VAL 101   3.653  -0.203  -8.531
  771   1HG1  VAL 101          1HG1      VAL 101   3.148  -1.242  -6.291
  772   2HG1  VAL 101          2HG1      VAL 101   4.249  -0.061  -5.580
  773   3HG1  VAL 101          3HG1      VAL 101   4.852  -1.233  -6.752
  774   1HG2  VAL 101          1HG2      VAL 101   1.644   0.199  -7.113
  775   2HG2  VAL 101          2HG2      VAL 101   2.122   1.753  -7.796
  776   3HG2  VAL 101          3HG2      VAL 101   2.550   1.352  -6.133
  777    H    GLU 102           H        GLU 102   6.715   1.361  -6.030
  778    HA   GLU 102           HA       GLU 102   8.510  -0.105  -7.837
  779   1HB   GLU 102          2HB       GLU 102   9.367   2.100  -7.493
  780   2HB   GLU 102          1HB       GLU 102   9.085   1.987  -5.749
  781   1HG   GLU 102          2HG       GLU 102  10.831   0.480  -5.435
  782   2HG   GLU 102          1HG       GLU 102  10.875   0.033  -7.150
  783    H    LEU 103           H        LEU 103   8.834  -2.172  -7.006
  784    HA   LEU 103           HA       LEU 103   8.027  -2.669  -4.241
  785   1HB   LEU 103          2HB       LEU 103   7.226  -4.249  -5.863
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.467  -6.531
  787    HG   LEU 103           HG       LEU 103   9.547  -5.664  -4.533
  788   1HD1  LEU 103          1HD1      LEU 103   6.782  -4.963  -3.522
  789   2HD1  LEU 103          2HD1      LEU 103   8.336  -4.624  -2.760
  790   3HD1  LEU 103          3HD1      LEU 103   7.733  -6.280  -2.836
  791   1HD2  LEU 103          1HD2      LEU 103   7.981  -7.616  -4.731
  792   2HD2  LEU 103          2HD2      LEU 103   8.588  -7.006  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.951  -6.609  -5.747
  794    H    LEU 104           H        LEU 104   9.456  -2.278  -2.765
  795    HA   LEU 104           HA       LEU 104  12.289  -2.024  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.807  -1.446  -0.822
  797   2HB   LEU 104          1HB       LEU 104  12.476  -0.997  -1.181
  798    HG   LEU 104           HG       LEU 104  10.042   0.191  -2.506
  799   1HD1  LEU 104          1HD1      LEU 104  10.370   0.798  -0.054
  800   2HD1  LEU 104          2HD1      LEU 104  10.327   2.140  -1.199
  801   3HD1  LEU 104          3HD1      LEU 104  11.870   1.580  -0.556
  802   1HD2  LEU 104          1HD2      LEU 104  12.275   0.035  -3.736
  803   2HD2  LEU 104          2HD2      LEU 104  12.922   1.103  -2.492
  804   3HD2  LEU 104          3HD2      LEU 104  11.622   1.661  -3.543
  805    H    LYS 105           H        LYS 105  10.327  -4.008  -1.313
  806    HA   LYS 105           HA       LYS 105  12.566  -5.750  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.826  -3.635   0.611
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.082   1.447
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.014   2.349
  810   2HG   LYS 105          1HG       LYS 105  13.834  -5.708   1.415
  811   1HD   LYS 105          2HD       LYS 105  14.217  -3.640   2.556
  812   2HD   LYS 105          1HD       LYS 105  12.614  -3.695   3.310
  813   1HE   LYS 105          2HE       LYS 105  13.276  -5.922   4.301
  814   2HE   LYS 105          1HE       LYS 105  14.922  -5.603   3.734
  815   1HZ   LYS 105          1HZ       LYS 105  13.453  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.254  -3.309   4.908
  817   3HZ   LYS 105          3HZ       LYS 105  15.124  -4.567   5.661
  818    H    LEU 106           H        LEU 106  11.794  -7.703   0.371
  819    HA   LEU 106           HA       LEU 106   8.921  -7.756   1.010
  820   1HB   LEU 106          2HB       LEU 106  10.657 -10.085   0.182
  821   2HB   LEU 106          1HB       LEU 106   8.990 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.869  -8.834  -1.808
  823   1HD1  LEU 106          1HD1      LEU 106   8.414 -11.424  -1.351
  824   2HD1  LEU 106          2HD1      LEU 106  10.121 -11.285  -1.775
  825   3HD1  LEU 106          3HD1      LEU 106   8.883 -10.735  -2.904
  826   1HD2  LEU 106          1HD2      LEU 106   7.566  -8.573  -2.322
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.673
  828   3HD2  LEU 106          3HD2      LEU 106   7.073  -9.577  -0.960
  829    H    GLU 107           HN       GLU 107   8.526  -8.269   3.052
  830    HA   GLU 107           HA       GLU 107  10.716  -9.187   4.801
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.228   5.416
  832   2HB   GLU 107          1HB       GLU 107   9.697  -7.831   6.579
  833   1HG   GLU 107          2HG       GLU 107  11.468  -6.820   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.234  -6.151   4.164
  835    H2   GPI 108           H2       GPI 108  -4.005   1.630  -1.886
  836   1H5   GPI 108          1H5       GPI 108  -2.665   4.477  -1.402
  837   2H5   GPI 108          2H5       GPI 108  -2.659   4.513   0.369
  838   1H3   GPI 108          1H3       GPI 108  -1.964   0.641  -0.958
  839   2H3   GPI 108          2H3       GPI 108  -2.443   1.017   0.706
  840   1H4   GPI 108          1H4       GPI 108  -1.139   2.739  -1.404
  841   2H4   GPI 108          2H4       GPI 108  -0.985   2.897   0.372
  842   1H14  GPI 108          1H14      GPI 108  -6.780   1.308   1.296
  843   2H14  GPI 108          2H14      GPI 108  -7.013  -0.439   1.042
  844   1H15  GPI 108          1H15      GPI 108  -8.415   0.905  -1.061
  845   2H15  GPI 108          2H15      GPI 108  -8.840   1.731   0.456
  846   1H16  GPI 108          1H16      GPI 108  -8.803  -1.287   0.416
  847   2H16  GPI 108          2H16      GPI 108 -10.179  -0.443  -0.331
  848    H20  GPI 108           H20      GPI 108 -11.508   0.518   5.336
  849    H21  GPI 108           H21      GPI 108 -10.040  -1.458   4.947
  850    H22  GPI 108           H22      GPI 108  -9.067  -1.854   2.690
  851    H18  GPI 108           H18      GPI 108 -11.021   1.690   1.206
  852   1H12  GPI 108          1H12      GPI 108  -4.103   6.910   1.456
  853   2H12  GPI 108          2H12      GPI 108  -5.579   7.782   1.759
  854   3H12  GPI 108          3H12      GPI 108  -4.833   6.852   3.045
  855   1H13  GPI 108          1H13      GPI 108  -6.315   3.705   2.356
  856   2H13  GPI 108          2H13      GPI 108  -4.619   4.188   2.546
  857   3H13  GPI 108          3H13      GPI 108  -5.873   4.905   3.596
  858   1H10  GPI 108          1H10      GPI 108  -7.664   6.402   2.482
  859   2H10  GPI 108          2H10      GPI 108  -7.928   5.174   1.222
  860   1H11  GPI 108          1H11      GPI 108  -8.157   6.801  -0.334
  861   2H11  GPI 108          2H11      GPI 108  -8.033   7.992   0.930
  862   3H11  GPI 108          3H11      GPI 108  -6.595   7.471   0.074
  Start of MODEL    2
    1   1H    GLY   1          1H        GLY   1 -10.185  -5.720 -15.429
    2   2H    GLY   1          2H        GLY   1  -9.175  -4.436 -15.868
    3   3H    GLY   1          3H        GLY   1  -9.873  -4.485 -14.313
    4   1HA   GLY   1          1HA       GLY   1  -8.595  -6.397 -13.736
    5   2HA   GLY   1          2HA       GLY   1  -7.913  -6.427 -15.370
    6    H    VAL   2           H        VAL   2  -5.836  -6.109 -14.257
    7    HA   VAL   2           HA       VAL   2  -5.181  -3.272 -13.800
    8    HB   VAL   2           HB       VAL   2  -5.014  -4.369 -11.644
    9   1HG1  VAL   2          1HG1      VAL   2  -5.039  -6.651 -11.975
   10   2HG1  VAL   2          2HG1      VAL   2  -3.355  -6.388 -11.517
   11   3HG1  VAL   2          3HG1      VAL   2  -3.785  -6.592 -13.216
   12   1HG2  VAL   2          1HG2      VAL   2  -2.739  -3.984 -11.113
   13   2HG2  VAL   2          2HG2      VAL   2  -2.994  -2.998 -12.554
   14   3HG2  VAL   2          3HG2      VAL   2  -2.184  -4.561 -12.685
   15    H    GLN   3           H        GLN   3  -3.402  -2.741 -15.042
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.696 -16.956
   17   1HB   GLN   3          2HB       GLN   3  -3.650  -3.063 -17.957
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.782 -16.985
   19   1HG   GLN   3          2HG       GLN   3  -0.839  -2.076 -18.217
   20   2HG   GLN   3          1HG       GLN   3  -1.636  -3.299 -19.224
   21   1HE2  GLN   3          1HE2      GLN   3  -0.895  -0.070 -19.216
   22   2HE2  GLN   3          2HE2      GLN   3  -2.173   0.477 -20.243
   23    H    VAL   4           H        VAL   4   0.028  -4.828 -16.596
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.552
   25    HB   VAL   4           HB       VAL   4   1.946  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.455  -5.606 -13.276
   27   2HG1  VAL   4          2HG1      VAL   4   3.338  -3.910 -13.739
   28   3HG1  VAL   4          3HG1      VAL   4   4.020  -5.085 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.753 -13.785
   30   2HG2  VAL   4          2HG2      VAL   4   0.047  -5.129 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.451  -5.692 -12.607
   32    H    GLU   5           H        GLU   5   2.589  -1.532 -15.721
   33    HA   GLU   5           HA       GLU   5   3.858  -2.504 -18.204
   34   1HB   GLU   5          2HB       GLU   5   3.406   0.409 -17.570
   35   2HB   GLU   5          1HB       GLU   5   3.764  -0.336 -19.134
   36   1HG   GLU   5          2HG       GLU   5   1.575  -0.578 -19.581
   37   2HG   GLU   5          1HG       GLU   5   1.316  -1.438 -18.055
   38    H    THR   6           H        THR   6   6.173  -2.559 -17.863
   39    HA   THR   6           HA       THR   6   7.248  -1.666 -15.327
   40    HB   THR   6           HB       THR   6   8.547  -2.886 -17.813
   41    HG1  THR   6           HG1      THR   6   7.714  -4.258 -15.466
   42   1HG2  THR   6          1HG2      THR   6  10.111  -3.769 -15.964
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.268 -15.172
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.222 -16.772
   45    H    ILE   7           H        ILE   7   8.484  -0.098 -14.755
   46    HA   ILE   7           HA       ILE   7   9.325   1.984 -16.649
   47    HB   ILE   7           HB       ILE   7   9.174   1.956 -13.592
   48   1HG1  ILE   7          2HG1      ILE   7   7.573   3.425 -15.705
   49   2HG1  ILE   7          1HG1      ILE   7   7.036   1.947 -14.884
   50   1HG2  ILE   7          1HG2      ILE   7  10.902   3.493 -13.980
   51   2HG2  ILE   7          2HG2      ILE   7   9.451   4.491 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.148   4.116 -15.447
   53   1HD1  ILE   7          1HD1      ILE   7   6.103   4.220 -14.095
   54   2HD1  ILE   7          2HD1      ILE   7   7.674   4.427 -13.317
   55   3HD1  ILE   7          3HD1      ILE   7   6.645   3.063 -12.878
   56    H    SER   8           H        SER   8  10.601  -0.024 -13.868
   57    HA   SER   8           HA       SER   8  13.150  -0.214 -15.311
   58   1HB   SER   8          2HB       SER   8  12.963   0.239 -12.319
   59   2HB   SER   8          1HB       SER   8  14.443   0.042 -13.268
   60    HG   SER   8           HG       SER   8  13.495   1.892 -14.557
   61    HA   PRO   9           HA       PRO   9  12.195  -4.489 -14.335
   62   1HB   PRO   9          2HB       PRO   9  15.068  -4.994 -14.687
   63   2HB   PRO   9          1HB       PRO   9  13.701  -5.632 -15.585
   64   1HG   PRO   9          2HG       PRO   9  15.266  -3.813 -16.724
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.705 -16.934
   66   1HD   PRO   9          1HD       PRO   9  15.270  -2.169 -14.991
   67   2HD   PRO   9          2HD       PRO   9  14.046  -1.540 -16.073
   68    H    GLY  10           H        GLY  10  12.403  -6.055 -12.857
   69   1HA   GLY  10          2HA       GLY  10  13.701  -5.350 -10.324
   70   2HA   GLY  10          1HA       GLY  10  12.398  -6.526 -10.542
   71    H    ASP  11           H        ASP  11  13.970  -8.173  -9.355
   72    HA   ASP  11           HA       ASP  11  16.402  -8.727 -10.873
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.365  -9.172
   74   2HB   ASP  11          1HB       ASP  11  16.352  -8.884  -8.381
   75    H    GLY  12           H        GLY  12  13.236  -9.674 -11.217
   76   1HA   GLY  12          2HA       GLY  12  12.273 -11.204 -12.649
   77   2HA   GLY  12          1HA       GLY  12  13.901 -11.646 -13.186
   78    H    ARG  13           H        ARG  13  13.569 -12.073  -9.752
   79    HA   ARG  13           HA       ARG  13  12.730 -14.857 -10.203
   80   1HB   ARG  13          2HB       ARG  13  15.051 -14.302  -8.383
   81   2HB   ARG  13          1HB       ARG  13  14.616 -15.800  -9.217
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.963 -11.269
   83   2HG   ARG  13          1HG       ARG  13  15.850 -13.397 -10.515
   84   1HD   ARG  13          2HD       ARG  13  17.938 -14.356 -10.544
   85   2HD   ARG  13          1HD       ARG  13  17.368 -14.839  -8.939
   86    HE   ARG  13           HE       ARG  13  16.907 -17.032  -9.825
   87   1HH1  ARG  13          1HH1      ARG  13  18.198 -15.234 -12.843
   88   2HH1  ARG  13          2HH1      ARG  13  19.702 -15.785 -12.189
   89   1HH2  ARG  13          1HH2      ARG  13  17.673 -18.713 -11.202
   90   2HH2  ARG  13          2HH2      ARG  13  18.635 -18.328 -12.590
   91    H    THR  14           H        THR  14  12.901 -12.177  -7.903
   92    HA   THR  14           HA       THR  14  11.726 -13.893  -5.805
   93    HB   THR  14           HB       THR  14  12.787 -11.053  -5.376
   94    HG1  THR  14           HG1      THR  14  14.551 -12.027  -6.114
   95   1HG2  THR  14          1HG2      THR  14  12.296 -13.321  -3.518
   96   2HG2  THR  14          2HG2      THR  14  11.881 -11.615  -3.351
   97   3HG2  THR  14          3HG2      THR  14  13.560 -12.136  -3.191
   98    H    PHE  15           H        PHE  15   9.637 -13.946  -6.443
   99    HA   PHE  15           HA       PHE  15   8.161 -11.406  -6.741
  100   1HB   PHE  15          2HB       PHE  15   7.408 -14.236  -7.451
  101   2HB   PHE  15          1HB       PHE  15   6.392 -12.808  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.945 -11.193  -9.435
  103    HD2  PHE  15           HD2      PHE  15   9.293 -14.723  -8.926
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.858 -11.649
  105    HE2  PHE  15           HE2      PHE  15  10.270 -14.359 -11.158
  106    HZ   PHE  15           HZ       PHE  15   9.599 -12.443 -12.505
  107    HA   PRO  16           HA       PRO  16   6.582 -11.998  -2.682
  108   1HB   PRO  16          2HB       PRO  16   4.250 -10.530  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.841  -9.830  -2.630
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.093  -5.200
  111   2HG   PRO  16          1HG       PRO  16   5.229  -8.736  -4.652
  112   1HD   PRO  16          1HD       PRO  16   6.217 -10.464  -6.438
  113   2HD   PRO  16          2HD       PRO  16   7.245  -9.796  -5.188
  114    H    LYS  17           H        LYS  17   5.299 -13.161  -1.505
  115    HA   LYS  17           HA       LYS  17   3.409 -14.927  -2.910
  116   1HB   LYS  17          2HB       LYS  17   5.299 -15.564  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.167 -16.703  -1.348
  118   1HG   LYS  17          2HG       LYS  17   6.218 -15.322  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.666 -16.742  -2.094
  120   1HD   LYS  17          2HD       LYS  17   5.455 -18.131  -3.362
  121   2HD   LYS  17          1HD       LYS  17   4.099 -16.993  -3.456
  122   1HE   LYS  17          2HE       LYS  17   6.460 -16.407  -5.140
  123   2HE   LYS  17          1HE       LYS  17   5.469 -17.803  -5.592
  124   1HZ   LYS  17          1HZ       LYS  17   4.771 -15.767  -6.650
  125   2HZ   LYS  17          2HZ       LYS  17   4.465 -15.075  -5.138
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.424  -5.664
  127    H    ARG  18           H        ARG  18   1.603 -15.579  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.733   0.104
  129   1HB   ARG  18          2HB       ARG  18  -0.556 -15.877  -0.969
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.687   0.494
  131   1HG   ARG  18          2HG       ARG  18  -1.228 -14.883   1.779
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.488   0.237
  133   1HD   ARG  18          2HD       ARG  18  -3.316 -15.945   1.818
  134   2HD   ARG  18          1HD       ARG  18  -3.129 -16.548   0.164
  135    HE   ARG  18           HE       ARG  18  -1.063 -17.633   1.569
  136   1HH1  ARG  18          2HH1      ARG  18  -4.657 -18.505   1.492
  137   2HH1  ARG  18          1HH1      ARG  18  -4.459 -18.843   3.178
  138   1HH2  ARG  18          2HH2      ARG  18  -1.543 -19.659   3.427
  139   2HH2  ARG  18          1HH2      ARG  18  -1.804 -20.427   1.896
  140    H    GLY  19           H        GLY  19   0.548 -13.148   2.148
  141   1HA   GLY  19          2HA       GLY  19   0.936 -13.448   4.428
  142   2HA   GLY  19          1HA       GLY  19   1.905 -14.879   4.044
  143    H    GLN  20           H        GLN  20   3.267 -12.975   1.914
  144    HA   GLN  20           HA       GLN  20   5.253 -11.989   3.784
  145   1HB   GLN  20          2HB       GLN  20   5.102 -11.879   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.431 -11.205   1.721
  147   1HG   GLN  20          2HG       GLN  20   6.843 -13.491   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.123   1.569
  149   1HE2  GLN  20          1HE2      GLN  20   8.884 -13.776   1.914
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.643   0.257
  151    H    THR  21           H        THR  21   5.899  -9.933   4.064
  152    HA   THR  21           HA       THR  21   3.949  -7.848   3.444
  153    HB   THR  21           HB       THR  21   6.487  -7.829   5.134
  154    HG1  THR  21           HG1      THR  21   5.080  -8.526   6.605
  155   1HG2  THR  21          1HG2      THR  21   4.528  -5.599   4.683
  156   2HG2  THR  21          2HG2      THR  21   6.269  -5.594   4.396
  157   3HG2  THR  21          3HG2      THR  21   5.646  -5.683   6.043
  158    H    CYS  22           H        CYS  22   4.052  -6.679   1.689
  159    HA   CYS  22           HA       CYS  22   6.559  -6.385   0.225
  160   1HB   CYS  22          2HB       CYS  22   3.813  -5.362  -0.486
  161   2HB   CYS  22          1HB       CYS  22   5.234  -5.434  -1.545
  162    HG   CYS  22           HG       CYS  22   4.730  -7.765  -2.075
  163    H    VAL  23           H        VAL  23   7.677  -4.551   0.162
  164    HA   VAL  23           HA       VAL  23   6.772  -2.298   1.836
  165    HB   VAL  23           HB       VAL  23   9.632  -3.181   1.170
  166   1HG1  VAL  23          1HG1      VAL  23   8.494  -0.919   2.757
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.947   1.693
  168   3HG1  VAL  23          3HG1      VAL  23   9.996  -1.663   3.302
  169   1HG2  VAL  23          1HG2      VAL  23   7.796  -3.856   3.414
  170   2HG2  VAL  23          2HG2      VAL  23   9.509  -3.641   3.772
  171   3HG2  VAL  23          3HG2      VAL  23   9.000  -4.855   2.599
  172    H    VAL  24           H        VAL  24   6.137  -0.648   0.303
  173    HA   VAL  24           HA       VAL  24   7.581  -0.658  -2.263
  174    HB   VAL  24           HB       VAL  24   5.484  -0.200  -3.508
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.631  -1.778
  176   2HG1  VAL  24          2HG1      VAL  24   6.178  -2.584  -3.106
  177   3HG1  VAL  24          3HG1      VAL  24   4.458  -2.363  -3.429
  178   1HG2  VAL  24          1HG2      VAL  24   3.269  -0.454  -2.326
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.958  -1.799
  180   3HG2  VAL  24          3HG2      VAL  24   4.141  -0.491  -0.793
  181    H    HIS  25           H        HIS  25   7.789   1.373  -3.359
  182    HA   HIS  25           HA       HIS  25   6.699   3.596  -1.767
  183   1HB   HIS  25          2HB       HIS  25   9.117   3.370  -3.380
  184   2HB   HIS  25          1HB       HIS  25   8.117   4.723  -3.930
  185    HD1  HIS  25           HD1      HIS  25   7.080   5.443  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.970   4.836  -2.108
  187    HE1  HIS  25           HE1      HIS  25   8.511   6.539   0.826
  188    HE2  HIS  25           HE2      HIS  25  10.844   6.125   0.050
  189    H    TYR  26           H        TYR  26   5.064   5.001  -2.882
  190    HA   TYR  26           HA       TYR  26   4.445   4.246  -5.634
  191   1HB   TYR  26          2HB       TYR  26   2.140   3.707  -5.199
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.742  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.748   5.510  -4.440
  194    HD2  TYR  26           HD2      TYR  26   2.894   3.061  -1.680
  195    HE1  TYR  26           HE1      TYR  26  -0.612   6.408  -2.593
  196    HE2  TYR  26           HE2      TYR  26   1.551   3.981   0.194
  197    HH   TYR  26           HH       TYR  26  -0.126   6.682   0.102
  198    H    THR  27           H        THR  27   3.221   5.733  -6.796
  199    HA   THR  27           HA       THR  27   2.334   8.163  -5.406
  200    HB   THR  27           HB       THR  27   3.482   8.076  -8.194
  201    HG1  THR  27           HG1      THR  27   4.356   8.923  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.782  -8.528
  203   2HG2  THR  27          2HG2      THR  27   3.188  10.687  -7.507
  204   3HG2  THR  27          3HG2      THR  27   1.738   9.971  -6.805
  205    H    GLY  28           H        GLY  28   0.073   8.085  -5.749
  206   1HA   GLY  28          2HA       GLY  28  -1.089   6.460  -7.921
  207   2HA   GLY  28          1HA       GLY  28  -1.922   6.973  -6.446
  208    H    MET  29           H        MET  29  -2.116   7.366  -9.514
  209    HA   MET  29           HA       MET  29  -2.907  10.190  -9.488
  210   1HB   MET  29          2HB       MET  29  -1.480   8.727 -11.719
  211   2HB   MET  29          1HB       MET  29  -2.185  10.343 -11.858
  212   1HG   MET  29          2HG       MET  29  -0.600  11.289 -10.509
  213   2HG   MET  29          1HG       MET  29  -0.178   9.743  -9.752
  214   1HE   MET  29          1HE       MET  29   0.794   8.008 -10.621
  215   2HE   MET  29          2HE       MET  29   2.360   8.218 -11.403
  216   3HE   MET  29          3HE       MET  29   0.962   7.704 -12.349
  217    H    LEU  30           H        LEU  30  -4.550  10.704 -10.717
  218    HA   LEU  30           HA       LEU  30  -6.563   8.805 -11.484
  219   1HB   LEU  30          2HB       LEU  30  -6.138  11.614 -10.972
  220   2HB   LEU  30          1HB       LEU  30  -7.161  11.339 -12.385
  221    HG   LEU  30           HG       LEU  30  -8.959  10.997 -11.160
  222   1HD1  LEU  30          1HD1      LEU  30  -8.541   8.872 -10.286
  223   2HD1  LEU  30          2HD1      LEU  30  -8.873   9.873  -8.871
  224   3HD1  LEU  30          3HD1      LEU  30  -7.211   9.450  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.617  12.084  -8.843
  226   2HD2  LEU  30          2HD2      LEU  30  -8.464  13.011 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.019  12.446  -9.494
  228    H    GLU  31           H        GLU  31  -7.370   8.959 -13.977
  229    HA   GLU  31           HA       GLU  31  -5.216   8.504 -15.715
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.085 -16.065
  231   2HB   GLU  31          1HB       GLU  31  -7.056   8.987 -17.473
  232   1HG   GLU  31          2HG       GLU  31  -6.309   6.759 -16.613
  233   2HG   GLU  31          1HG       GLU  31  -7.627   6.865 -15.435
  234    H    ASP  32           H        ASP  32  -6.495  11.595 -14.898
  235    HA   ASP  32           HA       ASP  32  -5.307  12.763 -17.295
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.857 -16.414
  237   2HB   ASP  32          1HB       ASP  32  -7.438  13.611 -16.364
  238    H    GLY  33           H        GLY  33  -3.818  11.613 -14.624
  239   1HA   GLY  33          2HA       GLY  33  -1.526  11.885 -14.229
  240   2HA   GLY  33          1HA       GLY  33  -1.618  13.506 -14.937
  241    H    LYS  34           H        LYS  34  -4.144  13.639 -12.940
  242    HA   LYS  34           HA       LYS  34  -2.768  15.196 -11.019
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.189 -11.901
  244   2HB   LYS  34          1HB       LYS  34  -5.506  14.052 -10.569
  245   1HG   LYS  34          2HG       LYS  34  -3.975  16.470  -9.966
  246   2HG   LYS  34          1HG       LYS  34  -5.697  16.691 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.721  14.717  -8.287
  248   2HD   LYS  34          1HD       LYS  34  -5.072  16.407  -7.890
  249   1HE   LYS  34          2HE       LYS  34  -7.008  14.532  -9.255
  250   2HE   LYS  34          1HE       LYS  34  -7.005  14.871  -7.517
  251   1HZ   LYS  34          1HZ       LYS  34  -8.075  16.371  -9.645
  252   2HZ   LYS  34          2HZ       LYS  34  -6.990  17.299  -8.737
  253   3HZ   LYS  34          3HZ       LYS  34  -8.313  16.535  -7.978
  254    H    LYS  35           H        LYS  35  -1.723  14.606  -9.322
  255    HA   LYS  35           HA       LYS  35  -1.547  11.907  -8.413
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.566  -8.492
  257   2HB   LYS  35          1HB       LYS  35  -0.489  14.442  -7.182
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.540  -5.702
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.724  -7.013
  260   1HD   LYS  35          2HD       LYS  35   2.378  12.751  -5.540
  261   2HD   LYS  35          1HD       LYS  35   2.365  13.635  -7.074
  262   1HE   LYS  35          2HE       LYS  35   0.922  15.361  -6.034
  263   2HE   LYS  35          1HE       LYS  35   1.033  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.280  14.954  -4.339
  265   2HZ   LYS  35          2HZ       LYS  35   2.541  16.413  -4.771
  266   3HZ   LYS  35          3HZ       LYS  35   3.381  15.498  -5.938
  267    H    PHE  36           H        PHE  36  -2.815  11.064  -6.760
  268    HA   PHE  36           HA       PHE  36  -4.245  13.051  -5.102
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.141  -4.493
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.610  -6.201
  271    HD1  PHE  36           HD1      PHE  36  -4.652   8.996  -3.835
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.542   6.622  -4.509
  274    HE2  PHE  36           HE2      PHE  36  -5.278   7.711  -8.564
  275    HZ   PHE  36           HZ       PHE  36  -4.859   5.985  -6.865
  276    H    ASP  37           H        ASP  37  -1.760  10.658  -4.990
  277    HA   ASP  37           HA       ASP  37  -1.055  11.468  -2.360
  278   1HB   ASP  37          2HB       ASP  37  -2.942   9.814  -1.834
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.555  -2.454
  280    H    SER  38           H        SER  38   0.977  10.468  -1.659
  281    HA   SER  38           HA       SER  38   2.320   8.515  -3.297
  282   1HB   SER  38          2HB       SER  38   2.764  10.582  -4.607
  283   2HB   SER  38          1HB       SER  38   3.448  11.333  -3.157
  284    HG   SER  38           HG       SER  38   5.033  10.353  -4.565
  285    H    SER  39           H        SER  39   3.580   7.305  -1.914
  286    HA   SER  39           HA       SER  39   4.091   8.271   0.753
  287   1HB   SER  39          2HB       SER  39   5.452   6.188   0.992
  288   2HB   SER  39          1HB       SER  39   3.791   5.895   0.458
  289    HG   SER  39           HG       SER  39   4.880   4.729  -0.965
  290    H    ARG  40           H        ARG  40   5.671   8.413  -2.311
  291    HA   ARG  40           HA       ARG  40   8.347   8.699  -1.495
  292   1HB   ARG  40          2HB       ARG  40   6.895   9.775  -3.938
  293   2HB   ARG  40          1HB       ARG  40   8.646   9.874  -3.706
  294   1HG   ARG  40          2HG       ARG  40   8.669   7.373  -3.552
  295   2HG   ARG  40          1HG       ARG  40   6.967   7.398  -4.047
  296   1HD   ARG  40          2HD       ARG  40   7.655   8.458  -6.184
  297   2HD   ARG  40          1HD       ARG  40   9.346   8.286  -5.688
  298    HE   ARG  40           HE       ARG  40   9.210   5.985  -6.102
  299   1HH1  ARG  40          1HH1      ARG  40   5.580   6.786  -6.202
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.968  -7.893
  301   1HH2  ARG  40          1HH2      ARG  40   7.873   3.982  -6.856
  302   2HH2  ARG  40          2HH2      ARG  40   6.914   4.487  -8.208
  303    H    ASP  41           H        ASP  41   5.606  11.043  -1.764
  304    HA   ASP  41           HA       ASP  41   7.158  13.334  -1.090
  305   1HB   ASP  41          2HB       ASP  41   4.188  12.793  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.378  -0.522
  307    H    ARG  42           H        ARG  42   5.682  10.788   0.920
  308    HA   ARG  42           HA       ARG  42   6.301  12.310   3.320
  309   1HB   ARG  42          2HB       ARG  42   5.439   9.440   3.145
  310   2HB   ARG  42          1HB       ARG  42   5.372  10.509   4.551
  311   1HG   ARG  42          2HG       ARG  42   3.750  11.916   3.342
  312   2HG   ARG  42          1HG       ARG  42   3.758  10.733   2.026
  313   1HD   ARG  42          2HD       ARG  42   3.173  10.028   4.870
  314   2HD   ARG  42          1HD       ARG  42   1.919  10.548   3.735
  315    HE   ARG  42           HE       ARG  42   3.115   7.958   3.944
  316   1HH1  ARG  42          1HH1      ARG  42   0.344   9.705   2.081
  317   2HH1  ARG  42          2HH1      ARG  42   1.577   9.540   0.876
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.329   2.838
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.788   1.327
  320    H    ASN  43           H        ASN  43   7.997  10.294   1.243
  321    HA   ASN  43           HA       ASN  43   9.991   9.199   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.557  11.533   2.022
  323   2HB   ASN  43          1HB       ASN  43  10.442  10.968   3.696
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.105   0.960
  325   2HD2  ASN  43          2HD2      ASN  43  13.587   9.744   1.391
  326    H    LYS  44           H        LYS  44   7.798   7.928   2.742
  327    HA   LYS  44           HA       LYS  44   9.467   6.181   4.409
  328   1HB   LYS  44          2HB       LYS  44   8.224   7.817   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.711   7.206   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.013   6.172
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.598   6.829
  332   1HD   LYS  44          2HD       LYS  44   7.582   7.120   8.278
  333   2HD   LYS  44          1HD       LYS  44   6.035   6.934   7.436
  334   1HE   LYS  44          2HE       LYS  44   7.386   4.697   8.962
  335   2HE   LYS  44          1HE       LYS  44   6.179   5.779   9.677
  336   1HZ   LYS  44          1HZ       LYS  44   5.866   3.724   7.644
  337   2HZ   LYS  44          2HZ       LYS  44   4.809   5.044   7.655
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.034   9.022
  339    HA   PRO  45           HA       PRO  45   7.454   3.619   1.208
  340   1HB   PRO  45          2HB       PRO  45   8.336   1.317   2.815
  341   2HB   PRO  45          1HB       PRO  45   8.653   1.689   1.129
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.990   2.945
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.160   1.649
  344   1HD   PRO  45          1HD       PRO  45   9.468   3.382   4.524
  345   2HD   PRO  45          2HD       PRO  45  10.321   4.576   3.570
  346    H    PHE  46           H        PHE  46   5.603   2.324   1.037
  347    HA   PHE  46           HA       PHE  46   3.983   2.331   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.005   3.314   1.482
  349   2HB   PHE  46          1HB       PHE  46   3.340   1.840   0.559
  350    HD1  PHE  46           HD1      PHE  46   1.392   3.118   3.440
  351    HD2  PHE  46           HD2      PHE  46   1.766   0.212   0.359
  352    HE1  PHE  46           HE1      PHE  46  -0.841   2.246   3.983
  353    HE2  PHE  46           HE2      PHE  46  -0.462  -0.655   0.916
  354    HZ   PHE  46           HZ       PHE  46  -1.779   0.358   2.732
  355    H    LYS  47           H        LYS  47   3.423   0.255   4.457
  356    HA   LYS  47           HA       LYS  47   4.541  -2.089   3.051
  357   1HB   LYS  47          2HB       LYS  47   3.966  -1.642   5.984
  358   2HB   LYS  47          1HB       LYS  47   4.455  -3.195   5.294
  359   1HG   LYS  47          2HG       LYS  47   6.483  -2.130   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.002  -0.633   5.255
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.684   7.414
  362   2HD   LYS  47          1HD       LYS  47   6.493  -3.262   6.666
  363   1HE   LYS  47          2HE       LYS  47   8.467  -2.423   5.552
  364   2HE   LYS  47          1HE       LYS  47   8.132  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.000   8.400
  366   2HZ   LYS  47          2HZ       LYS  47   9.622  -1.385   7.634
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.046   7.526
  368    H    PHE  48           H        PHE  48   3.032  -3.771   2.432
  369    HA   PHE  48           HA       PHE  48   0.643  -3.987   4.112
  370   1HB   PHE  48          2HB       PHE  48  -0.872  -4.237   2.307
  371   2HB   PHE  48          1HB       PHE  48   0.051  -2.758   1.979
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.774   0.222
  373    HD2  PHE  48           HD2      PHE  48  -0.909  -6.024   0.771
  374    HE1  PHE  48           HE1      PHE  48   2.258  -3.558  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.439  -6.811  -1.533
  376    HZ   PHE  48           HZ       PHE  48   1.147  -5.556  -2.945
  377    H    MET  49           H        MET  49  -0.030  -6.290   4.275
  378    HA   MET  49           HA       MET  49   1.873  -8.238   3.220
  379   1HB   MET  49          2HB       MET  49   1.321  -8.653   5.477
  380   2HB   MET  49          1HB       MET  49  -0.401  -8.377   5.187
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.502   4.182
  382   2HG   MET  49          1HG       MET  49   1.092 -10.766   4.146
  383   1HE   MET  49          1HE       MET  49   1.596 -10.935   8.133
  384   2HE   MET  49          2HE       MET  49   1.276  -9.410   7.306
  385   3HE   MET  49          3HE       MET  49   2.403 -10.574   6.607
  386    H    LEU  50           H        LEU  50   1.555  -9.321   1.509
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.100  -0.214
  388   1HB   LEU  50          2HB       LEU  50   1.838 -10.578  -0.104
  389   2HB   LEU  50          1HB       LEU  50   0.514 -11.616  -0.635
  390    HG   LEU  50           HG       LEU  50   1.996  -9.556  -2.080
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.297  -2.467
  392   2HD1  LEU  50          2HD1      LEU  50   2.461 -11.927  -2.292
  393   3HD1  LEU  50          3HD1      LEU  50   1.597 -11.431  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.265  -9.495  -3.780
  395   2HD2  LEU  50          2HD2      LEU  50  -0.224  -8.668  -2.301
  396   3HD2  LEU  50          3HD2      LEU  50  -0.849 -10.277  -2.660
  397    H    GLY  51           H        GLY  51  -2.500 -10.135  -0.243
  398   1HA   GLY  51          2HA       GLY  51  -3.967 -11.915  -0.222
  399   2HA   GLY  51          1HA       GLY  51  -2.816 -12.829   0.766
  400    H    LYS  52           H        LYS  52  -3.036  -9.956   2.331
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.123   4.260
  402   1HB   LYS  52          2HB       LYS  52  -2.633  -9.864   4.490
  403   2HB   LYS  52          1HB       LYS  52  -3.669  -8.436   4.367
  404   1HG   LYS  52          2HG       LYS  52  -4.948  -9.342   6.363
  405   2HG   LYS  52          1HG       LYS  52  -3.626 -10.506   6.556
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.611   6.085
  407   2HD   LYS  52          1HD       LYS  52  -3.413  -7.508   6.195
  408   1HE   LYS  52          2HE       LYS  52  -3.790  -8.459   8.459
  409   2HE   LYS  52          1HE       LYS  52  -2.181  -9.179   8.303
  410   1HZ   LYS  52          1HZ       LYS  52  -2.521  -6.808   9.254
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.380   7.620
  412   3HZ   LYS  52          3HZ       LYS  52  -1.188  -7.185   8.285
  413    H    GLN  53           H        GLN  53  -5.463  -9.221   1.594
  414    HA   GLN  53           HA       GLN  53  -7.281  -8.071   0.877
  415   1HB   GLN  53          2HB       GLN  53  -8.463  -9.202   3.402
  416   2HB   GLN  53          1HB       GLN  53  -9.383  -8.293   2.194
  417   1HG   GLN  53          2HG       GLN  53  -9.297  -9.999   0.666
  418   2HG   GLN  53          1HG       GLN  53  -7.927 -10.784   1.470
  419   1HE2  GLN  53          1HE2      GLN  53  -9.752 -12.934   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.077 -12.731   3.276
  421    H    GLU  54           H        GLU  54  -5.347  -6.569   2.308
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.584   3.519
  423   1HB   GLU  54          2HB       GLU  54  -5.240  -3.759   4.725
  424   2HB   GLU  54          1HB       GLU  54  -5.554  -5.463   5.078
  425   1HG   GLU  54          2HG       GLU  54  -3.731  -6.106   3.601
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.399   3.248
  427    H    VAL  55           H        VAL  55  -5.458  -5.033   0.730
  428    HA   VAL  55           HA       VAL  55  -5.543  -2.136   0.239
  429    HB   VAL  55           HB       VAL  55  -3.882  -2.656  -1.664
  430   1HG1  VAL  55          1HG1      VAL  55  -3.277  -2.881   1.283
  431   2HG1  VAL  55          2HG1      VAL  55  -3.215  -1.439   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.006  -2.710   0.072
  433   1HG2  VAL  55          1HG2      VAL  55  -3.254  -5.155  -0.162
  434   2HG2  VAL  55          2HG2      VAL  55  -2.604  -4.582  -1.698
  435   3HG2  VAL  55          3HG2      VAL  55  -4.279  -5.125  -1.596
  436    H    ILE  56           H        ILE  56  -5.906  -1.830  -2.309
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.119  -2.876
  438    HB   ILE  56           HB       ILE  56  -8.229  -1.808  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.912  -0.390  -3.803
  440   2HG1  ILE  56          1HG1      ILE  56  -5.702  -1.648  -5.034
  441   1HG2  ILE  56          1HG2      ILE  56  -9.528  -0.597  -3.668
  442   2HG2  ILE  56          2HG2      ILE  56  -8.131   0.476  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.378  -0.755  -2.342
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.250  -6.671
  445   2HD1  ILE  56          2HD1      ILE  56  -5.492   0.606  -5.992
  446   3HD1  ILE  56          3HD1      ILE  56  -7.124   0.996  -5.448
  447    H    ARG  57           H        ARG  57  -8.929  -4.372  -4.684
  448    HA   ARG  57           HA       ARG  57  -7.301  -6.655  -4.956
  449   1HB   ARG  57          2HB       ARG  57  -9.778  -6.631  -5.312
  450   2HB   ARG  57          1HB       ARG  57  -9.544  -5.686  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.333  -7.514  -7.790
  452   2HG   ARG  57          1HG       ARG  57  -8.506  -8.460  -6.302
  453   1HD   ARG  57          2HD       ARG  57 -10.927  -8.587  -6.657
  454   2HD   ARG  57          1HD       ARG  57 -10.768  -7.626  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.771  -8.133
  456   1HH1  ARG  57          1HH1      ARG  57 -12.266  -9.326  -9.730
  457   2HH1  ARG  57          2HH1      ARG  57 -12.631 -10.668  -8.700
  458   1HH2  ARG  57          1HH2      ARG  57  -9.482 -11.968  -9.049
  459   2HH2  ARG  57          2HH2      ARG  57 -10.210 -11.505 -10.551
  460    H    GLY  58           H        GLY  58  -7.318  -3.874  -7.249
  461   1HA   GLY  58          2HA       GLY  58  -5.786  -5.257  -9.176
  462   2HA   GLY  58          1HA       GLY  58  -5.913  -3.500  -9.003
  463    H    TRP  59           H        TRP  59  -4.853  -3.702  -6.136
  464    HA   TRP  59           HA       TRP  59  -2.019  -3.685  -6.666
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.134  -4.344
  466   2HB   TRP  59          1HB       TRP  59  -2.168  -3.716  -3.949
  467    HD1  TRP  59           HD1      TRP  59  -3.605  -1.157  -6.511
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.902  -6.378
  469    HE3  TRP  59           HE3      TRP  59  -0.323  -2.654  -2.814
  470    HZ2  TRP  59           HZ2      TRP  59   0.089   1.799  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.154
  472    HH2  TRP  59           HH2      TRP  59   1.658   1.073  -3.215
  473    H    GLU  60           H        GLU  60  -3.999  -5.884  -4.553
  474    HA   GLU  60           HA       GLU  60  -2.182  -7.809  -3.914
  475   1HB   GLU  60          2HB       GLU  60  -4.937  -8.446  -4.978
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.488  -3.961
  477   1HG   GLU  60          2HG       GLU  60  -4.905  -6.876  -2.951
  478   2HG   GLU  60          1HG       GLU  60  -5.969  -8.291  -2.984
  479    H    GLU  61           H        GLU  61  -3.994  -7.516  -6.943
  480    HA   GLU  61           HA       GLU  61  -2.772  -9.827  -8.164
  481   1HB   GLU  61          2HB       GLU  61  -4.418  -7.607  -9.394
  482   2HB   GLU  61          1HB       GLU  61  -4.041  -9.165 -10.139
  483   1HG   GLU  61          2HG       GLU  61  -5.246  -9.498  -7.528
  484   2HG   GLU  61          1HG       GLU  61  -6.275  -8.537  -8.606
  485    H    GLY  62           H        GLY  62  -2.126  -6.341  -8.334
  486   1HA   GLY  62          2HA       GLY  62  -0.508  -6.786 -10.673
  487   2HA   GLY  62          1HA       GLY  62  -0.758  -5.248  -9.833
  488    H    VAL  63           H        VAL  63   0.134  -5.861  -7.305
  489    HA   VAL  63           HA       VAL  63   2.942  -5.682  -7.764
  490    HB   VAL  63           HB       VAL  63   1.302  -5.995  -5.198
  491   1HG1  VAL  63          1HG1      VAL  63   3.647  -6.696  -4.933
  492   2HG1  VAL  63          2HG1      VAL  63   3.350  -5.180  -4.082
  493   3HG1  VAL  63          3HG1      VAL  63   4.186  -5.171  -5.634
  494   1HG2  VAL  63          1HG2      VAL  63   0.932  -3.779  -6.427
  495   2HG2  VAL  63          2HG2      VAL  63   2.678  -3.533  -6.449
  496   3HG2  VAL  63          3HG2      VAL  63   1.807  -3.530  -4.916
  497    H    ALA  64           H        ALA  64   0.822  -8.472  -7.070
  498    HA   ALA  64           HA       ALA  64   2.871 -10.243  -6.295
  499   1HB   ALA  64          1HB       ALA  64   0.455 -10.983  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.405 -10.688  -6.178
  501   3HB   ALA  64          3HB       ALA  64   1.385 -12.006  -6.820
  502    H    GLN  65           H        GLN  65   2.108  -8.870  -9.376
  503    HA   GLN  65           HA       GLN  65   3.585 -10.842 -10.888
  504   1HB   GLN  65          2HB       GLN  65   2.248  -8.224 -11.563
  505   2HB   GLN  65          1HB       GLN  65   3.243  -9.100 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.821 -11.071 -12.541
  507   2HG   GLN  65          1HG       GLN  65   0.884 -10.309 -11.243
  508   1HE2  GLN  65          1HE2      GLN  65  -1.179  -9.486 -12.158
  509   2HE2  GLN  65          2HE2      GLN  65  -0.903  -8.128 -13.192
  510    H    MET  66           H        MET  66   4.752  -8.571  -8.816
  511    HA   MET  66           HA       MET  66   6.777  -7.620 -10.721
  512   1HB   MET  66          2HB       MET  66   5.986  -6.535  -8.024
  513   2HB   MET  66          1HB       MET  66   7.236  -5.864  -9.078
  514   1HG   MET  66          2HG       MET  66   5.597  -5.381 -10.782
  515   2HG   MET  66          1HG       MET  66   4.329  -6.153  -9.816
  516   1HE   MET  66          1HE       MET  66   7.231  -3.851  -8.686
  517   2HE   MET  66          2HE       MET  66   6.481  -2.254  -8.657
  518   3HE   MET  66          3HE       MET  66   6.732  -3.083 -10.192
  519    H    SER  67           H        SER  67   8.935  -7.974 -10.279
  520    HA   SER  67           HA       SER  67   9.649  -9.757  -8.078
  521   1HB   SER  67          2HB       SER  67  11.858  -9.704  -9.291
  522   2HB   SER  67          1HB       SER  67  10.496 -10.434 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.799 -11.555
  524    H    VAL  68           H        VAL  68  11.483  -9.146  -6.637
  525    HA   VAL  68           HA       VAL  68  11.309  -6.545  -5.629
  526    HB   VAL  68           HB       VAL  68  13.513  -8.622  -5.346
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.417  -3.308
  528   2HG1  VAL  68          2HG1      VAL  68  12.989  -6.167  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.359  -6.390  -4.732
  530   1HG2  VAL  68          1HG2      VAL  68  11.725  -9.651  -4.480
  531   2HG2  VAL  68          2HG2      VAL  68  10.883  -8.143  -4.130
  532   3HG2  VAL  68          3HG2      VAL  68  12.172  -8.698  -3.065
  533    H    GLY  69           H        GLY  69  12.138  -4.762  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.883  -3.301  -6.747
  535   2HA   GLY  69          1HA       GLY  69  14.459  -4.530  -7.883
  536    H    GLN  70           H        GLN  70  11.269  -4.686  -8.434
  537    HA   GLN  70           HA       GLN  70  11.690  -3.130 -10.840
  538   1HB   GLN  70          2HB       GLN  70  10.813  -5.488 -10.676
  539   2HB   GLN  70          1HB       GLN  70   9.326  -4.776 -10.035
  540   1HG   GLN  70          2HG       GLN  70   9.149  -3.444 -12.106
  541   2HG   GLN  70          1HG       GLN  70  10.537  -4.345 -12.742
  542   1HE2  GLN  70          2HE2      GLN  70   9.493  -7.238 -12.034
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.874 -11.428
  544    H    ARG  71           H        ARG  71  10.582  -1.587 -11.624
  545    HA   ARG  71           HA       ARG  71   8.696  -0.179  -9.845
  546   1HB   ARG  71          2HB       ARG  71  10.803   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.688   1.055 -11.765
  548   1HG   ARG  71          2HG       ARG  71   8.898   2.568 -11.794
  549   2HG   ARG  71          1HG       ARG  71   8.397   2.160 -10.145
  550   1HD   ARG  71          2HD       ARG  71  10.284   3.311  -9.214
  551   2HD   ARG  71          1HD       ARG  71  10.989   3.553 -10.820
  552    HE   ARG  71           HE       ARG  71   8.426   4.696 -10.780
  553   1HH1  ARG  71          2HH1      ARG  71  11.613   5.179  -9.289
  554   2HH1  ARG  71          1HH1      ARG  71  11.464   6.904  -9.285
  555   1HH2  ARG  71          1HH2      ARG  71   8.121   6.876 -10.464
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.986
  557    H    ALA  72           H        ALA  72   6.800  -0.068 -10.813
  558    HA   ALA  72           HA       ALA  72   6.470  -0.150 -13.714
  559   1HB   ALA  72          1HB       ALA  72   5.011  -2.006 -13.695
  560   2HB   ALA  72          2HB       ALA  72   4.894  -1.996 -11.936
  561   3HB   ALA  72          3HB       ALA  72   6.392  -2.503 -12.718
  562    H    LYS  73           H        LYS  73   4.462   0.425 -14.507
  563    HA   LYS  73           HA       LYS  73   2.807   2.084 -12.736
  564   1HB   LYS  73          2HB       LYS  73   3.832   3.035 -14.746
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.822 -15.723
  566   1HG   LYS  73          2HG       LYS  73   0.828   2.876 -14.910
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.217 -14.335
  568   1HD   LYS  73          2HD       LYS  73   2.966   4.300 -16.495
  569   2HD   LYS  73          1HD       LYS  73   1.971   2.953 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.016   4.448 -16.678
  571   2HE   LYS  73          1HE       LYS  73   1.147   5.769 -16.499
  572   1HZ   LYS  73          1HZ       LYS  73   0.808   4.007 -18.846
  573   2HZ   LYS  73          2HZ       LYS  73   2.038   5.156 -18.682
  574   3HZ   LYS  73          3HZ       LYS  73   0.410   5.648 -18.751
  575    H    LEU  74           H        LEU  74   0.909   1.251 -12.074
  576    HA   LEU  74           HA       LEU  74  -0.135  -1.173 -13.369
  577   1HB   LEU  74          2HB       LEU  74   0.213  -0.094 -10.655
  578   2HB   LEU  74          1HB       LEU  74  -1.341  -0.882 -10.938
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.000 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.989  -3.481 -11.265
  581   2HD1  LEU  74          2HD1      LEU  74   2.323  -1.758 -11.424
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.587 -12.651
  583   1HD2  LEU  74          1HD2      LEU  74  -0.468  -1.888  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.230  -1.449  -9.035
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.145  -8.938
  586    H    THR  75           H        THR  75  -1.871  -0.574 -14.790
  587    HA   THR  75           HA       THR  75  -3.497   1.772 -14.023
  588    HB   THR  75           HB       THR  75  -3.435   0.122 -16.596
  589    HG1  THR  75           HG1      THR  75  -1.653   1.267 -16.761
  590   1HG2  THR  75          1HG2      THR  75  -4.609   1.968 -17.627
  591   2HG2  THR  75          2HG2      THR  75  -4.844   2.695 -16.038
  592   3HG2  THR  75          3HG2      THR  75  -5.575   1.133 -16.412
  593    H    ILE  76           H        ILE  76  -5.455   1.333 -12.988
  594    HA   ILE  76           HA       ILE  76  -6.291  -1.483 -12.781
  595    HB   ILE  76           HB       ILE  76  -6.389   0.674 -10.636
  596   1HG1  ILE  76          2HG1      ILE  76  -4.507  -1.672 -10.945
  597   2HG1  ILE  76          1HG1      ILE  76  -4.084   0.026 -11.221
  598   1HG2  ILE  76          1HG2      ILE  76  -7.210  -2.171 -10.633
  599   2HG2  ILE  76          2HG2      ILE  76  -8.130  -0.727 -10.214
  600   3HG2  ILE  76          3HG2      ILE  76  -6.834  -1.283  -9.157
  601   1HD1  ILE  76          1HD1      ILE  76  -4.413  -1.467  -8.691
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.221  -8.707
  603   3HD1  ILE  76          3HD1      ILE  76  -3.266  -0.200  -9.127
  604    H    SER  77           H        SER  77  -8.341  -1.762 -13.534
  605    HA   SER  77           HA       SER  77 -10.075   0.347 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.733  -1.397 -14.643
  607   2HB   SER  77          1HB       SER  77 -10.163  -1.886 -15.294
  608    HG   SER  77           HG       SER  77 -11.683  -3.015 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.060   1.321 -10.425
  610   1HB   PRO  78          2HB       PRO  78 -14.777   1.356 -11.227
  611   2HB   PRO  78          1HB       PRO  78 -13.689   2.734 -11.185
  612   1HG   PRO  78          2HG       PRO  78 -14.508   1.056 -13.515
  613   2HG   PRO  78          1HG       PRO  78 -14.013   2.740 -13.489
  614   1HD   PRO  78          1HD       PRO  78 -12.360   0.789 -14.398
  615   2HD   PRO  78          2HD       PRO  78 -11.741   2.212 -13.584
  616    H    ASP  79           H        ASP  79 -13.479  -1.462 -12.054
  617    HA   ASP  79           HA       ASP  79 -14.745  -2.335  -9.644
  618   1HB   ASP  79          2HB       ASP  79 -15.147  -4.410 -10.855
  619   2HB   ASP  79          1HB       ASP  79 -15.489  -3.031 -11.909
  620    H    TYR  80           H        TYR  80 -11.546  -2.402 -10.611
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.456  -8.685
  622   1HB   TYR  80          2HB       TYR  80  -9.560  -3.181 -11.069
  623   2HB   TYR  80          1HB       TYR  80  -8.480  -3.757  -9.787
  624    HD1  TYR  80           HD1      TYR  80 -11.502  -4.892 -11.641
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.878
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.201 -12.483
  627    HE2  TYR  80           HE2      TYR  80  -7.920  -8.146 -10.692
  628    HH   TYR  80           HH       TYR  80  -8.976  -9.435 -12.229
  629    H    ALA  81           H        ALA  81 -11.562  -1.442  -8.396
  630    HA   ALA  81           HA       ALA  81  -9.392  -0.750  -6.538
  631   1HB   ALA  81          1HB       ALA  81  -9.043   0.365  -8.763
  632   2HB   ALA  81          2HB       ALA  81  -9.310   1.510  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.616   1.142  -8.574
  634    H    TYR  82           H        TYR  82 -11.706   1.776  -7.022
  635    HA   TYR  82           HA       TYR  82 -13.145   0.957  -4.576
  636   1HB   TYR  82          2HB       TYR  82 -12.503   3.642  -5.851
  637   2HB   TYR  82          1HB       TYR  82 -13.463   3.449  -4.376
  638    HD1  TYR  82           HD1      TYR  82 -12.315   2.134  -2.427
  639    HD2  TYR  82           HD2      TYR  82 -10.245   3.941  -5.711
  640    HE1  TYR  82           HE1      TYR  82 -10.207   2.035  -1.124
  641    HE2  TYR  82           HE2      TYR  82  -8.141   3.838  -4.422
  642    HH   TYR  82           HH       TYR  82  -7.556   3.778  -1.855
  643    H    GLY  83           H        GLY  83 -13.805   0.860  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.708   0.431  -8.897
  645   2HA   GLY  83          1HA       GLY  83 -16.439   0.098  -7.319
  646    H    ALA  84           H        ALA  84 -18.269   0.982  -7.434
  647    HA   ALA  84           HA       ALA  84 -18.707   3.583  -8.634
  648   1HB   ALA  84          1HB       ALA  84 -20.323   1.691  -8.790
  649   2HB   ALA  84          2HB       ALA  84 -21.024   3.180  -8.157
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.863  -7.058
  651    H    THR  85           H        THR  85 -18.020   2.428  -5.347
  652    HA   THR  85           HA       THR  85 -19.182   4.738  -4.103
  653    HB   THR  85           HB       THR  85 -16.855   3.115  -3.033
  654    HG1  THR  85           HG1      THR  85 -19.570   2.454  -2.690
  655   1HG2  THR  85          1HG2      THR  85 -19.158   4.617  -1.811
  656   2HG2  THR  85          2HG2      THR  85 -17.432   4.851  -1.533
  657   3HG2  THR  85          3HG2      THR  85 -18.237   3.409  -0.917
  658    H    GLY  86           H        GLY  86 -15.913   4.002  -5.319
  659   1HA   GLY  86          2HA       GLY  86 -14.100   5.462  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.216   6.806  -5.306
  661    H    HIS  87           H        HIS  87 -13.166   7.510  -3.886
  662    HA   HIS  87           HA       HIS  87 -13.465   6.202  -1.252
  663   1HB   HIS  87          2HB       HIS  87 -11.190   6.025  -2.258
  664   2HB   HIS  87          1HB       HIS  87 -11.087   7.792  -2.212
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.797   0.417
  666    HD2  HIS  87           HD2      HIS  87 -10.710   4.670  -0.092
  667    HE1  HIS  87           HE1      HIS  87 -10.104   7.850   2.598
  668    HE2  HIS  87           HE2      HIS  87 -10.002   5.371   2.223
  669    HA   PRO  88           HA       PRO  88 -15.772  10.118  -0.978
  670   1HB   PRO  88          2HB       PRO  88 -15.861  10.505   1.733
  671   2HB   PRO  88          1HB       PRO  88 -16.875   9.331   0.911
  672   1HG   PRO  88          2HG       PRO  88 -14.226   8.865   2.307
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.496
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.987   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.540   6.972   0.308
  676    H    GLY  89           H        GLY  89 -15.167  11.872  -1.572
  677   1HA   GLY  89          2HA       GLY  89 -14.151  13.913  -1.651
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.214
  679    H    ILE  90           H        ILE  90 -12.042  11.021  -1.770
  680    HA   ILE  90           HA       ILE  90  -9.979  12.655  -3.119
  681    HB   ILE  90           HB       ILE  90  -9.842   9.884  -1.826
  682   1HG1  ILE  90          2HG1      ILE  90  -8.445  12.390  -0.969
  683   2HG1  ILE  90          1HG1      ILE  90 -10.098  12.030  -0.441
  684   1HG2  ILE  90          1HG2      ILE  90  -7.309  10.385  -1.932
  685   2HG2  ILE  90          2HG2      ILE  90  -7.713  11.627  -3.117
  686   3HG2  ILE  90          3HG2      ILE  90  -8.066   9.933  -3.459
  687   1HD1  ILE  90          1HD1      ILE  90  -9.336  10.708   1.164
  688   2HD1  ILE  90          2HD1      ILE  90  -7.695  11.181   0.725
  689   3HD1  ILE  90          3HD1      ILE  90  -8.425   9.749  -0.003
  690    H    ILE  91           H        ILE  91 -11.665   9.562  -3.636
  691    HA   ILE  91           HA       ILE  91 -10.633   9.708  -6.404
  692    HB   ILE  91           HB       ILE  91 -11.717   7.252  -4.978
  693   1HG1  ILE  91          2HG1      ILE  91  -9.604   7.975  -3.973
  694   2HG1  ILE  91          1HG1      ILE  91  -9.413   6.461  -4.873
  695   1HG2  ILE  91          1HG2      ILE  91 -10.552   6.112  -6.910
  696   2HG2  ILE  91          2HG2      ILE  91 -10.441   7.707  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.021   7.011  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.508   7.969  -5.199
  699   2HD1  ILE  91          2HD1      ILE  91  -8.594   9.197  -5.853
  700   3HD1  ILE  91          3HD1      ILE  91  -8.368   7.672  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.250  10.299  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.682   9.827  -9.876
  703   2HB   PRO  92          1HB       PRO  92 -15.346  11.254  -9.101
  704   1HG   PRO  92          2HG       PRO  92 -12.862  11.317 -10.115
  705   2HG   PRO  92          1HG       PRO  92 -13.211  12.132  -8.600
  706   1HD   PRO  92          1HD       PRO  92 -12.060   9.356  -8.999
  707   2HD   PRO  92          2HD       PRO  92 -11.421  10.653  -8.012
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.868
  709   1HB   PRO  93          2HB       PRO  93 -18.919   7.281  -9.559
  710   2HB   PRO  93          1HB       PRO  93 -19.088   6.343  -8.086
  711   1HG   PRO  93          2HG       PRO  93 -19.619   9.036  -8.232
  712   2HG   PRO  93          1HG       PRO  93 -19.151   8.220  -6.750
  713   1HD   PRO  93          1HD       PRO  93 -17.515   9.977  -8.525
  714   2HD   PRO  93          2HD       PRO  93 -17.370   9.713  -6.799
  715    H    HIS  94           H        HIS  94 -16.501   4.744  -9.377
  716    HA   HIS  94           HA       HIS  94 -15.944   3.693 -11.308
  717   1HB   HIS  94          2HB       HIS  94 -17.266   6.169 -12.563
  718   2HB   HIS  94          1HB       HIS  94 -16.933   4.652 -13.416
  719    HD1  HIS  94           HD1      HIS  94 -18.294   2.487 -12.154
  720    HD2  HIS  94           HD2      HIS  94 -19.607   6.359 -11.435
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.309 -11.165
  722    HE2  HIS  94           HE2      HIS  94 -21.351   4.658 -10.759
  723    H    ALA  95           H        ALA  95 -13.894   5.538 -10.142
  724    HA   ALA  95           HA       ALA  95 -12.523   6.636 -12.450
  725   1HB   ALA  95          1HB       ALA  95 -12.629   7.329  -9.872
  726   2HB   ALA  95          2HB       ALA  95 -11.237   7.692 -10.891
  727   3HB   ALA  95          3HB       ALA  95 -11.203   6.293  -9.819
  728    H    THR  96           H        THR  96 -10.924   5.698 -13.744
  729    HA   THR  96           HA       THR  96  -9.715   3.198 -13.009
  730    HB   THR  96           HB       THR  96  -9.160   5.171 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.420   3.811 -16.394
  732   1HG2  THR  96          1HG2      THR  96  -7.730   2.635 -14.647
  733   2HG2  THR  96          2HG2      THR  96  -7.065   4.251 -14.874
  734   3HG2  THR  96          3HG2      THR  96  -7.754   3.381 -16.243
  735    H    LEU  97           H        LEU  97  -7.696   3.077 -11.872
  736    HA   LEU  97           HA       LEU  97  -6.463   5.645 -11.104
  737   1HB   LEU  97          2HB       LEU  97  -6.523   2.946  -9.734
  738   2HB   LEU  97          1HB       LEU  97  -5.732   4.393  -9.101
  739    HG   LEU  97           HG       LEU  97  -8.696   3.975  -9.443
  740   1HD1  LEU  97          1HD1      LEU  97  -8.707   3.955  -7.052
  741   2HD1  LEU  97          2HD1      LEU  97  -6.988   4.351  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.511   2.780  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.505   6.246  -9.826
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.407  -8.821
  745   3HD2  LEU  97          3HD2      LEU  97  -8.645   6.200  -8.069
  746    H    VAL  98           H        VAL  98  -4.208   5.849 -11.142
  747    HA   VAL  98           HA       VAL  98  -2.849   3.761 -12.691
  748    HB   VAL  98           HB       VAL  98  -2.519   6.781 -12.882
  749   1HG1  VAL  98          1HG1      VAL  98  -1.027   4.461 -14.104
  750   2HG1  VAL  98          2HG1      VAL  98  -0.379   5.705 -13.035
  751   3HG1  VAL  98          3HG1      VAL  98  -0.882   6.123 -14.673
  752   1HG2  VAL  98          1HG2      VAL  98  -3.183   4.908 -15.157
  753   2HG2  VAL  98          2HG2      VAL  98  -3.416   6.654 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.468   5.572 -14.149
  755    H    PHE  99           H        PHE  99  -1.240   2.911 -11.258
  756    HA   PHE  99           HA       PHE  99  -0.234   4.766  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.719   1.815  -9.168
  758   2HB   PHE  99          1HB       PHE  99   0.435   2.563  -8.052
  759    HD1  PHE  99           HD1      PHE  99  -3.099   2.161  -8.946
  760    HD2  PHE  99           HD2      PHE  99  -0.266   3.912  -6.251
  761    HE1  PHE  99           HE1      PHE  99  -4.903   2.659  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.089   4.403  -4.662
  763    HZ   PHE  99           HZ       PHE  99  -4.396   3.778  -5.220
  764    H    ASP 100           H        ASP 100   1.948   5.076  -9.152
  765    HA   ASP 100           HA       ASP 100   3.709   3.599 -10.963
  766   1HB   ASP 100          2HB       ASP 100   3.846   5.986 -11.157
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.149  -9.411
  768    H    VAL 101           H        VAL 101   4.563   1.927  -9.767
  769    HA   VAL 101           HA       VAL 101   4.827   2.054  -6.829
  770    HB   VAL 101           HB       VAL 101   3.653  -0.201  -8.531
  771   1HG1  VAL 101          1HG1      VAL 101   3.149  -1.242  -6.291
  772   2HG1  VAL 101          2HG1      VAL 101   4.248  -0.060  -5.580
  773   3HG1  VAL 101          3HG1      VAL 101   4.851  -1.234  -6.751
  774   1HG2  VAL 101          1HG2      VAL 101   1.644   0.198  -7.112
  775   2HG2  VAL 101          2HG2      VAL 101   2.123   1.753  -7.796
  776   3HG2  VAL 101          3HG2      VAL 101   2.550   1.352  -6.133
  777    H    GLU 102           H        GLU 102   6.713   1.361  -6.031
  778    HA   GLU 102           HA       GLU 102   8.510  -0.106  -7.837
  779   1HB   GLU 102          2HB       GLU 102   9.366   2.099  -7.493
  780   2HB   GLU 102          1HB       GLU 102   9.085   1.987  -5.750
  781   1HG   GLU 102          2HG       GLU 102  10.832   0.480  -5.436
  782   2HG   GLU 102          1HG       GLU 102  10.875   0.033  -7.150
  783    H    LEU 103           H        LEU 103   8.833  -2.173  -7.006
  784    HA   LEU 103           HA       LEU 103   8.027  -2.669  -4.241
  785   1HB   LEU 103          2HB       LEU 103   7.226  -4.250  -5.863
  786   2HB   LEU 103          1HB       LEU 103   8.847  -4.467  -6.531
  787    HG   LEU 103           HG       LEU 103   9.548  -5.664  -4.531
  788   1HD1  LEU 103          1HD1      LEU 103   6.782  -4.963  -3.523
  789   2HD1  LEU 103          2HD1      LEU 103   8.336  -4.625  -2.760
  790   3HD1  LEU 103          3HD1      LEU 103   7.733  -6.279  -2.836
  791   1HD2  LEU 103          1HD2      LEU 103   7.982  -7.616  -4.730
  792   2HD2  LEU 103          2HD2      LEU 103   8.588  -7.006  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.951  -6.610  -5.747
  794    H    LEU 104           H        LEU 104   9.456  -2.278  -2.766
  795    HA   LEU 104           HA       LEU 104  12.289  -2.023  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.807  -1.446  -0.821
  797   2HB   LEU 104          1HB       LEU 104  12.476  -0.998  -1.181
  798    HG   LEU 104           HG       LEU 104  10.040   0.191  -2.505
  799   1HD1  LEU 104          1HD1      LEU 104  10.369   0.800  -0.055
  800   2HD1  LEU 104          2HD1      LEU 104  10.327   2.140  -1.201
  801   3HD1  LEU 104          3HD1      LEU 104  11.869   1.580  -0.555
  802   1HD2  LEU 104          1HD2      LEU 104  12.274   0.035  -3.736
  803   2HD2  LEU 104          2HD2      LEU 104  12.923   1.103  -2.493
  804   3HD2  LEU 104          3HD2      LEU 104  11.621   1.662  -3.544
  805    H    LYS 105           H        LYS 105  10.328  -4.008  -1.312
  806    HA   LYS 105           HA       LYS 105  12.567  -5.750  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.824  -3.636   0.611
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.082   1.447
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.015   2.349
  810   2HG   LYS 105          1HG       LYS 105  13.833  -5.707   1.416
  811   1HD   LYS 105          2HD       LYS 105  14.216  -3.641   2.556
  812   2HD   LYS 105          1HD       LYS 105  12.615  -3.694   3.311
  813   1HE   LYS 105          2HE       LYS 105  13.276  -5.923   4.301
  814   2HE   LYS 105          1HE       LYS 105  14.922  -5.603   3.733
  815   1HZ   LYS 105          1HZ       LYS 105  13.453  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.253  -3.310   4.907
  817   3HZ   LYS 105          3HZ       LYS 105  15.123  -4.567   5.660
  818    H    LEU 106           H        LEU 106  11.794  -7.703   0.372
  819    HA   LEU 106           HA       LEU 106   8.922  -7.756   1.010
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.084   0.181
  821   2HB   LEU 106          1HB       LEU 106   8.990 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.869  -8.833  -1.808
  823   1HD1  LEU 106          1HD1      LEU 106   8.415 -11.423  -1.349
  824   2HD1  LEU 106          2HD1      LEU 106  10.120 -11.285  -1.775
  825   3HD1  LEU 106          3HD1      LEU 106   8.883 -10.735  -2.903
  826   1HD2  LEU 106          1HD2      LEU 106   7.567  -8.572  -2.323
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.673
  828   3HD2  LEU 106          3HD2      LEU 106   7.073  -9.577  -0.959
  829    H    GLU 107           HN       GLU 107   8.524  -8.270   3.052
  830    HA   GLU 107           HA       GLU 107  10.717  -9.187   4.800
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.228   5.416
  832   2HB   GLU 107          1HB       GLU 107   9.697  -7.831   6.580
  833   1HG   GLU 107          2HG       GLU 107  11.468  -6.822   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.233  -6.153   4.165
  835    H2   GPI 108           H2       GPI 108  -4.746   1.539  -1.149
  836   1H5   GPI 108          1H5       GPI 108  -3.290   4.147  -1.903
  837   2H5   GPI 108          2H5       GPI 108  -2.249   4.414  -0.492
  838   1H3   GPI 108          1H3       GPI 108  -2.596   0.349  -1.333
  839   2H3   GPI 108          2H3       GPI 108  -2.046   0.949   0.242
  840   1H4   GPI 108          1H4       GPI 108  -2.056   2.273  -2.473
  841   2H4   GPI 108          2H4       GPI 108  -0.933   2.594  -1.114
  842   1H14  GPI 108          1H14      GPI 108  -6.781   1.566   0.849
  843   2H14  GPI 108          2H14      GPI 108  -7.533  -0.040   0.726
  844   1H15  GPI 108          1H15      GPI 108  -7.325  -0.460   3.022
  845   2H15  GPI 108          2H15      GPI 108  -5.954   0.660   3.208
  846   1H16  GPI 108          1H16      GPI 108  -7.998   1.627   4.211
  847   2H16  GPI 108          2H16      GPI 108  -7.488   2.585   2.804
  848    H20  GPI 108           H20      GPI 108 -12.735   0.785   0.800
  849    H21  GPI 108           H21      GPI 108 -11.458  -1.138   1.739
  850    H22  GPI 108           H22      GPI 108  -9.239  -0.748   2.802
  851    H18  GPI 108           H18      GPI 108  -9.573   3.473   1.995
  852   1H12  GPI 108          1H12      GPI 108  -6.866   4.994   1.292
  853   2H12  GPI 108          2H12      GPI 108  -7.269   6.678   1.468
  854   3H12  GPI 108          3H12      GPI 108  -7.558   5.864  -0.058
  855   1H13  GPI 108          1H13      GPI 108  -4.712   7.014  -1.576
  856   2H13  GPI 108          2H13      GPI 108  -5.074   5.279  -1.515
  857   3H13  GPI 108          3H13      GPI 108  -6.407   6.464  -1.637
  858   1H10  GPI 108          1H10      GPI 108  -4.177   8.042   0.475
  859   2H10  GPI 108          2H10      GPI 108  -5.246   7.812   1.878
  860   1H11  GPI 108          1H11      GPI 108  -6.810   9.158   0.944
  861   2H11  GPI 108          2H11      GPI 108  -5.671   9.531  -0.319
  862   3H11  GPI 108          3H11      GPI 108  -6.816   8.221  -0.531
  Start of MODEL    3
    1   1H    GLY   1          1H        GLY   1 -10.185  -5.719 -15.429
    2   2H    GLY   1          2H        GLY   1  -9.175  -4.435 -15.867
    3   3H    GLY   1          3H        GLY   1  -9.874  -4.486 -14.314
    4   1HA   GLY   1          1HA       GLY   1  -8.595  -6.397 -13.737
    5   2HA   GLY   1          2HA       GLY   1  -7.913  -6.426 -15.371
    6    H    VAL   2           H        VAL   2  -5.836  -6.109 -14.257
    7    HA   VAL   2           HA       VAL   2  -5.182  -3.272 -13.800
    8    HB   VAL   2           HB       VAL   2  -5.015  -4.370 -11.645
    9   1HG1  VAL   2          1HG1      VAL   2  -5.040  -6.651 -11.975
   10   2HG1  VAL   2          2HG1      VAL   2  -3.356  -6.387 -11.517
   11   3HG1  VAL   2          3HG1      VAL   2  -3.785  -6.592 -13.216
   12   1HG2  VAL   2          1HG2      VAL   2  -2.739  -3.984 -11.112
   13   2HG2  VAL   2          2HG2      VAL   2  -2.994  -2.998 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.185  -4.560 -12.686
   15    H    GLN   3           H        GLN   3  -3.402  -2.741 -15.041
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.696 -16.955
   17   1HB   GLN   3          2HB       GLN   3  -3.650  -3.062 -17.956
   18   2HB   GLN   3          1HB       GLN   3  -2.909  -1.781 -16.985
   19   1HG   GLN   3          2HG       GLN   3  -0.838  -2.076 -18.216
   20   2HG   GLN   3          1HG       GLN   3  -1.636  -3.298 -19.223
   21   1HE2  GLN   3          1HE2      GLN   3  -0.895  -0.070 -19.217
   22   2HE2  GLN   3          2HE2      GLN   3  -2.173   0.477 -20.243
   23    H    VAL   4           H        VAL   4   0.028  -4.829 -16.595
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.552
   25    HB   VAL   4           HB       VAL   4   1.946  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.454  -5.607 -13.275
   27   2HG1  VAL   4          2HG1      VAL   4   3.337  -3.909 -13.738
   28   3HG1  VAL   4          3HG1      VAL   4   4.019  -5.085 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.753 -13.785
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.128 -13.514
   31   3HG2  VAL   4          3HG2      VAL   4   1.451  -5.691 -12.607
   32    H    GLU   5           H        GLU   5   2.590  -1.532 -15.721
   33    HA   GLU   5           HA       GLU   5   3.858  -2.505 -18.204
   34   1HB   GLU   5          2HB       GLU   5   3.406   0.409 -17.570
   35   2HB   GLU   5          1HB       GLU   5   3.765  -0.336 -19.133
   36   1HG   GLU   5          2HG       GLU   5   1.575  -0.579 -19.581
   37   2HG   GLU   5          1HG       GLU   5   1.316  -1.438 -18.055
   38    H    THR   6           H        THR   6   6.173  -2.560 -17.862
   39    HA   THR   6           HA       THR   6   7.248  -1.667 -15.327
   40    HB   THR   6           HB       THR   6   8.546  -2.886 -17.814
   41    HG1  THR   6           HG1      THR   6   7.714  -4.258 -15.467
   42   1HG2  THR   6          1HG2      THR   6  10.110  -3.769 -15.964
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.270 -15.171
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.222 -16.773
   45    H    ILE   7           H        ILE   7   8.484  -0.099 -14.755
   46    HA   ILE   7           HA       ILE   7   9.325   1.984 -16.650
   47    HB   ILE   7           HB       ILE   7   9.175   1.955 -13.592
   48   1HG1  ILE   7          2HG1      ILE   7   7.572   3.424 -15.705
   49   2HG1  ILE   7          1HG1      ILE   7   7.036   1.948 -14.883
   50   1HG2  ILE   7          1HG2      ILE   7  10.901   3.494 -13.979
   51   2HG2  ILE   7          2HG2      ILE   7   9.450   4.492 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.148   4.116 -15.448
   53   1HD1  ILE   7          1HD1      ILE   7   6.104   4.221 -14.094
   54   2HD1  ILE   7          2HD1      ILE   7   7.675   4.426 -13.318
   55   3HD1  ILE   7          3HD1      ILE   7   6.645   3.063 -12.878
   56    H    SER   8           H        SER   8  10.603  -0.023 -13.869
   57    HA   SER   8           HA       SER   8  13.149  -0.214 -15.312
   58   1HB   SER   8          2HB       SER   8  12.963   0.240 -12.318
   59   2HB   SER   8          1HB       SER   8  14.443   0.042 -13.267
   60    HG   SER   8           HG       SER   8  13.494   1.892 -14.558
   61    HA   PRO   9           HA       PRO   9  12.195  -4.488 -14.335
   62   1HB   PRO   9          2HB       PRO   9  15.068  -4.994 -14.687
   63   2HB   PRO   9          1HB       PRO   9  13.701  -5.632 -15.584
   64   1HG   PRO   9          2HG       PRO   9  15.266  -3.814 -16.725
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.706 -16.935
   66   1HD   PRO   9          1HD       PRO   9  15.271  -2.167 -14.991
   67   2HD   PRO   9          2HD       PRO   9  14.047  -1.540 -16.073
   68    H    GLY  10           H        GLY  10  12.403  -6.055 -12.857
   69   1HA   GLY  10          2HA       GLY  10  13.702  -5.349 -10.325
   70   2HA   GLY  10          1HA       GLY  10  12.397  -6.527 -10.541
   71    H    ASP  11           H        ASP  11  13.971  -8.174  -9.355
   72    HA   ASP  11           HA       ASP  11  16.402  -8.726 -10.873
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.366  -9.171
   74   2HB   ASP  11          1HB       ASP  11  16.352  -8.884  -8.381
   75    H    GLY  12           H        GLY  12  13.237  -9.675 -11.218
   76   1HA   GLY  12          2HA       GLY  12  12.273 -11.203 -12.648
   77   2HA   GLY  12          1HA       GLY  12  13.901 -11.645 -13.185
   78    H    ARG  13           H        ARG  13  13.567 -12.072  -9.751
   79    HA   ARG  13           HA       ARG  13  12.731 -14.856 -10.202
   80   1HB   ARG  13          2HB       ARG  13  15.051 -14.302  -8.384
   81   2HB   ARG  13          1HB       ARG  13  14.617 -15.801  -9.217
   82   1HG   ARG  13          2HG       ARG  13  15.508 -14.963 -11.270
   83   2HG   ARG  13          1HG       ARG  13  15.849 -13.396 -10.515
   84   1HD   ARG  13          2HD       ARG  13  17.937 -14.355 -10.544
   85   2HD   ARG  13          1HD       ARG  13  17.368 -14.840  -8.939
   86    HE   ARG  13           HE       ARG  13  16.907 -17.033  -9.825
   87   1HH1  ARG  13          1HH1      ARG  13  18.198 -15.233 -12.843
   88   2HH1  ARG  13          2HH1      ARG  13  19.702 -15.785 -12.189
   89   1HH2  ARG  13          1HH2      ARG  13  17.672 -18.714 -11.202
   90   2HH2  ARG  13          2HH2      ARG  13  18.635 -18.328 -12.588
   91    H    THR  14           H        THR  14  12.901 -12.177  -7.903
   92    HA   THR  14           HA       THR  14  11.726 -13.893  -5.805
   93    HB   THR  14           HB       THR  14  12.787 -11.053  -5.377
   94    HG1  THR  14           HG1      THR  14  14.552 -12.027  -6.114
   95   1HG2  THR  14          1HG2      THR  14  12.296 -13.321  -3.518
   96   2HG2  THR  14          2HG2      THR  14  11.881 -11.616  -3.351
   97   3HG2  THR  14          3HG2      THR  14  13.560 -12.135  -3.192
   98    H    PHE  15           H        PHE  15   9.637 -13.948  -6.443
   99    HA   PHE  15           HA       PHE  15   8.161 -11.406  -6.742
  100   1HB   PHE  15          2HB       PHE  15   7.407 -14.235  -7.451
  101   2HB   PHE  15          1HB       PHE  15   6.392 -12.807  -7.710
  102    HD1  PHE  15           HD1      PHE  15   6.945 -11.193  -9.435
  103    HD2  PHE  15           HD2      PHE  15   9.293 -14.723  -8.927
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.859 -11.648
  105    HE2  PHE  15           HE2      PHE  15  10.270 -14.359 -11.157
  106    HZ   PHE  15           HZ       PHE  15   9.599 -12.444 -12.505
  107    HA   PRO  16           HA       PRO  16   6.582 -11.998  -2.682
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.531  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.841  -9.829  -2.630
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.092  -5.201
  111   2HG   PRO  16          1HG       PRO  16   5.229  -8.737  -4.652
  112   1HD   PRO  16          1HD       PRO  16   6.217 -10.464  -6.439
  113   2HD   PRO  16          2HD       PRO  16   7.246  -9.796  -5.188
  114    H    LYS  17           H        LYS  17   5.300 -13.160  -1.505
  115    HA   LYS  17           HA       LYS  17   3.409 -14.927  -2.910
  116   1HB   LYS  17          2HB       LYS  17   5.300 -15.564  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.167 -16.702  -1.347
  118   1HG   LYS  17          2HG       LYS  17   6.217 -15.321  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.667 -16.743  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.454 -18.132  -3.362
  121   2HD   LYS  17          1HD       LYS  17   4.100 -16.993  -3.456
  122   1HE   LYS  17          2HE       LYS  17   6.459 -16.406  -5.140
  123   2HE   LYS  17          1HE       LYS  17   5.470 -17.804  -5.592
  124   1HZ   LYS  17          1HZ       LYS  17   4.771 -15.768  -6.651
  125   2HZ   LYS  17          2HZ       LYS  17   4.466 -15.076  -5.138
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.424  -5.664
  127    H    ARG  18           H        ARG  18   1.602 -15.580  -1.555
  128    HA   ARG  18           HA       ARG  18   0.411 -13.733   0.104
  129   1HB   ARG  18          2HB       ARG  18  -0.556 -15.877  -0.969
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.688   0.494
  131   1HG   ARG  18          2HG       ARG  18  -1.228 -14.883   1.779
  132   2HG   ARG  18          1HG       ARG  18  -2.005 -14.487   0.238
  133   1HD   ARG  18          2HD       ARG  18  -3.316 -15.945   1.818
  134   2HD   ARG  18          1HD       ARG  18  -3.129 -16.548   0.164
  135    HE   ARG  18           HE       ARG  18  -1.064 -17.634   1.570
  136   1HH1  ARG  18          2HH1      ARG  18  -4.657 -18.505   1.491
  137   2HH1  ARG  18          1HH1      ARG  18  -4.458 -18.842   3.179
  138   1HH2  ARG  18          2HH2      ARG  18  -1.542 -19.659   3.427
  139   2HH2  ARG  18          1HH2      ARG  18  -1.805 -20.426   1.896
  140    H    GLY  19           H        GLY  19   0.549 -13.148   2.149
  141   1HA   GLY  19          2HA       GLY  19   0.935 -13.447   4.428
  142   2HA   GLY  19          1HA       GLY  19   1.904 -14.878   4.044
  143    H    GLN  20           H        GLN  20   3.267 -12.975   1.914
  144    HA   GLN  20           HA       GLN  20   5.253 -11.988   3.784
  145   1HB   GLN  20          2HB       GLN  20   5.101 -11.878   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.430 -11.203   1.721
  147   1HG   GLN  20          2HG       GLN  20   6.843 -13.491   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.124   1.569
  149   1HE2  GLN  20          1HE2      GLN  20   8.885 -13.777   1.915
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.643   0.258
  151    H    THR  21           H        THR  21   5.899  -9.935   4.063
  152    HA   THR  21           HA       THR  21   3.948  -7.848   3.444
  153    HB   THR  21           HB       THR  21   6.488  -7.829   5.134
  154    HG1  THR  21           HG1      THR  21   5.081  -8.526   6.606
  155   1HG2  THR  21          1HG2      THR  21   4.527  -5.601   4.682
  156   2HG2  THR  21          2HG2      THR  21   6.269  -5.594   4.396
  157   3HG2  THR  21          3HG2      THR  21   5.646  -5.683   6.044
  158    H    CYS  22           H        CYS  22   4.053  -6.680   1.688
  159    HA   CYS  22           HA       CYS  22   6.559  -6.386   0.226
  160   1HB   CYS  22          2HB       CYS  22   3.813  -5.363  -0.486
  161   2HB   CYS  22          1HB       CYS  22   5.234  -5.434  -1.545
  162    HG   CYS  22           HG       CYS  22   4.730  -7.766  -2.075
  163    H    VAL  23           H        VAL  23   7.677  -4.552   0.161
  164    HA   VAL  23           HA       VAL  23   6.771  -2.298   1.836
  165    HB   VAL  23           HB       VAL  23   9.633  -3.181   1.169
  166   1HG1  VAL  23          1HG1      VAL  23   8.493  -0.920   2.758
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.948   1.693
  168   3HG1  VAL  23          3HG1      VAL  23   9.996  -1.663   3.302
  169   1HG2  VAL  23          1HG2      VAL  23   7.796  -3.857   3.415
  170   2HG2  VAL  23          2HG2      VAL  23   9.510  -3.641   3.772
  171   3HG2  VAL  23          3HG2      VAL  23   9.000  -4.855   2.600
  172    H    VAL  24           H        VAL  24   6.138  -0.648   0.302
  173    HA   VAL  24           HA       VAL  24   7.581  -0.658  -2.263
  174    HB   VAL  24           HB       VAL  24   5.483  -0.200  -3.508
  175   1HG1  VAL  24          1HG1      VAL  24   5.018  -2.631  -1.779
  176   2HG1  VAL  24          2HG1      VAL  24   6.177  -2.583  -3.107
  177   3HG1  VAL  24          3HG1      VAL  24   4.459  -2.363  -3.430
  178   1HG2  VAL  24          1HG2      VAL  24   3.268  -0.454  -2.325
  179   2HG2  VAL  24          2HG2      VAL  24   4.186   0.957  -1.799
  180   3HG2  VAL  24          3HG2      VAL  24   4.141  -0.490  -0.793
  181    H    HIS  25           H        HIS  25   7.790   1.374  -3.359
  182    HA   HIS  25           HA       HIS  25   6.700   3.595  -1.767
  183   1HB   HIS  25          2HB       HIS  25   9.117   3.368  -3.379
  184   2HB   HIS  25          1HB       HIS  25   8.118   4.723  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.081   5.442  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.969   4.836  -2.107
  187    HE1  HIS  25           HE1      HIS  25   8.511   6.539   0.826
  188    HE2  HIS  25           HE2      HIS  25  10.844   6.126   0.050
  189    H    TYR  26           H        TYR  26   5.065   5.001  -2.882
  190    HA   TYR  26           HA       TYR  26   4.445   4.247  -5.633
  191   1HB   TYR  26          2HB       TYR  26   2.140   3.706  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.743  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.747   5.509  -4.441
  194    HD2  TYR  26           HD2      TYR  26   2.893   3.060  -1.679
  195    HE1  TYR  26           HE1      TYR  26  -0.613   6.407  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.550   3.981   0.195
  197    HH   TYR  26           HH       TYR  26  -0.127   6.682   0.102
  198    H    THR  27           H        THR  27   3.220   5.733  -6.795
  199    HA   THR  27           HA       THR  27   2.334   8.163  -5.407
  200    HB   THR  27           HB       THR  27   3.482   8.078  -8.195
  201    HG1  THR  27           HG1      THR  27   4.356   8.923  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.782  -8.528
  203   2HG2  THR  27          2HG2      THR  27   3.189  10.687  -7.508
  204   3HG2  THR  27          3HG2      THR  27   1.737   9.972  -6.805
  205    H    GLY  28           H        GLY  28   0.073   8.085  -5.749
  206   1HA   GLY  28          2HA       GLY  28  -1.089   6.459  -7.920
  207   2HA   GLY  28          1HA       GLY  28  -1.923   6.972  -6.445
  208    H    MET  29           H        MET  29  -2.117   7.366  -9.513
  209    HA   MET  29           HA       MET  29  -2.905  10.190  -9.488
  210   1HB   MET  29          2HB       MET  29  -1.480   8.726 -11.720
  211   2HB   MET  29          1HB       MET  29  -2.185  10.343 -11.857
  212   1HG   MET  29          2HG       MET  29  -0.600  11.288 -10.510
  213   2HG   MET  29          1HG       MET  29  -0.178   9.744  -9.750
  214   1HE   MET  29          1HE       MET  29   0.794   8.008 -10.620
  215   2HE   MET  29          2HE       MET  29   2.360   8.218 -11.403
  216   3HE   MET  29          3HE       MET  29   0.961   7.703 -12.348
  217    H    LEU  30           H        LEU  30  -4.550  10.703 -10.719
  218    HA   LEU  30           HA       LEU  30  -6.562   8.805 -11.485
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.614 -10.971
  220   2HB   LEU  30          1HB       LEU  30  -7.160  11.340 -12.384
  221    HG   LEU  30           HG       LEU  30  -8.959  10.997 -11.160
  222   1HD1  LEU  30          1HD1      LEU  30  -8.540   8.872 -10.285
  223   2HD1  LEU  30          2HD1      LEU  30  -8.873   9.873  -8.870
  224   3HD1  LEU  30          3HD1      LEU  30  -7.211   9.451  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.616  12.084  -8.843
  226   2HD2  LEU  30          2HD2      LEU  30  -8.463  13.011 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.019  12.447  -9.496
  228    H    GLU  31           H        GLU  31  -7.370   8.959 -13.977
  229    HA   GLU  31           HA       GLU  31  -5.215   8.503 -15.715
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.086 -16.064
  231   2HB   GLU  31          1HB       GLU  31  -7.056   8.986 -17.474
  232   1HG   GLU  31          2HG       GLU  31  -6.309   6.760 -16.613
  233   2HG   GLU  31          1HG       GLU  31  -7.627   6.866 -15.434
  234    H    ASP  32           H        ASP  32  -6.495  11.596 -14.899
  235    HA   ASP  32           HA       ASP  32  -5.306  12.763 -17.295
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.858 -16.413
  237   2HB   ASP  32          1HB       ASP  32  -7.440  13.611 -16.365
  238    H    GLY  33           H        GLY  33  -3.818  11.613 -14.624
  239   1HA   GLY  33          2HA       GLY  33  -1.526  11.887 -14.228
  240   2HA   GLY  33          1HA       GLY  33  -1.619  13.505 -14.936
  241    H    LYS  34           H        LYS  34  -4.145  13.638 -12.941
  242    HA   LYS  34           HA       LYS  34  -2.768  15.197 -11.018
  243   1HB   LYS  34          2HB       LYS  34  -5.261  15.190 -11.901
  244   2HB   LYS  34          1HB       LYS  34  -5.506  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.976  16.472  -9.967
  246   2HG   LYS  34          1HG       LYS  34  -5.697  16.691 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.722  14.717  -8.287
  248   2HD   LYS  34          1HD       LYS  34  -5.074  16.407  -7.891
  249   1HE   LYS  34          2HE       LYS  34  -7.007  14.532  -9.256
  250   2HE   LYS  34          1HE       LYS  34  -7.006  14.871  -7.517
  251   1HZ   LYS  34          1HZ       LYS  34  -8.074  16.371  -9.644
  252   2HZ   LYS  34          2HZ       LYS  34  -6.991  17.298  -8.736
  253   3HZ   LYS  34          3HZ       LYS  34  -8.312  16.536  -7.978
  254    H    LYS  35           H        LYS  35  -1.722  14.606  -9.323
  255    HA   LYS  35           HA       LYS  35  -1.547  11.907  -8.413
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.565  -8.492
  257   2HB   LYS  35          1HB       LYS  35  -0.488  14.441  -7.183
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.540  -5.701
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.725  -7.014
  260   1HD   LYS  35          2HD       LYS  35   2.378  12.751  -5.539
  261   2HD   LYS  35          1HD       LYS  35   2.366  13.635  -7.074
  262   1HE   LYS  35          2HE       LYS  35   0.921  15.362  -6.034
  263   2HE   LYS  35          1HE       LYS  35   1.032  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.281  14.954  -4.340
  265   2HZ   LYS  35          2HZ       LYS  35   2.542  16.413  -4.770
  266   3HZ   LYS  35          3HZ       LYS  35   3.382  15.499  -5.937
  267    H    PHE  36           H        PHE  36  -2.815  11.064  -6.760
  268    HA   PHE  36           HA       PHE  36  -4.245  13.050  -5.102
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.141  -4.494
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.610  -6.200
  271    HD1  PHE  36           HD1      PHE  36  -4.654   8.995  -3.835
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.540   6.622  -4.510
  274    HE2  PHE  36           HE2      PHE  36  -5.279   7.712  -8.565
  275    HZ   PHE  36           HZ       PHE  36  -4.859   5.986  -6.865
  276    H    ASP  37           H        ASP  37  -1.760  10.658  -4.991
  277    HA   ASP  37           HA       ASP  37  -1.055  11.467  -2.360
  278   1HB   ASP  37          2HB       ASP  37  -2.943   9.815  -1.834
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.555  -2.455
  280    H    SER  38           H        SER  38   0.977  10.468  -1.658
  281    HA   SER  38           HA       SER  38   2.321   8.514  -3.297
  282   1HB   SER  38          2HB       SER  38   2.764  10.582  -4.605
  283   2HB   SER  38          1HB       SER  38   3.450  11.334  -3.158
  284    HG   SER  38           HG       SER  38   5.034  10.354  -4.565
  285    H    SER  39           H        SER  39   3.581   7.305  -1.913
  286    HA   SER  39           HA       SER  39   4.091   8.271   0.752
  287   1HB   SER  39          2HB       SER  39   5.451   6.188   0.992
  288   2HB   SER  39          1HB       SER  39   3.791   5.894   0.459
  289    HG   SER  39           HG       SER  39   4.881   4.729  -0.965
  290    H    ARG  40           H        ARG  40   5.671   8.414  -2.310
  291    HA   ARG  40           HA       ARG  40   8.347   8.698  -1.494
  292   1HB   ARG  40          2HB       ARG  40   6.896   9.775  -3.938
  293   2HB   ARG  40          1HB       ARG  40   8.646   9.873  -3.704
  294   1HG   ARG  40          2HG       ARG  40   8.670   7.373  -3.552
  295   2HG   ARG  40          1HG       ARG  40   6.967   7.398  -4.047
  296   1HD   ARG  40          2HD       ARG  40   7.654   8.458  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.345   8.285  -5.688
  298    HE   ARG  40           HE       ARG  40   9.210   5.986  -6.101
  299   1HH1  ARG  40          1HH1      ARG  40   5.579   6.786  -6.203
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.969  -7.892
  301   1HH2  ARG  40          1HH2      ARG  40   7.873   3.981  -6.856
  302   2HH2  ARG  40          2HH2      ARG  40   6.914   4.486  -8.209
  303    H    ASP  41           H        ASP  41   5.606  11.042  -1.764
  304    HA   ASP  41           HA       ASP  41   7.158  13.334  -1.091
  305   1HB   ASP  41          2HB       ASP  41   4.188  12.793  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.378  -0.522
  307    H    ARG  42           H        ARG  42   5.683  10.787   0.920
  308    HA   ARG  42           HA       ARG  42   6.300  12.310   3.321
  309   1HB   ARG  42          2HB       ARG  42   5.439   9.439   3.144
  310   2HB   ARG  42          1HB       ARG  42   5.372  10.509   4.551
  311   1HG   ARG  42          2HG       ARG  42   3.750  11.916   3.344
  312   2HG   ARG  42          1HG       ARG  42   3.758  10.732   2.025
  313   1HD   ARG  42          2HD       ARG  42   3.174  10.027   4.870
  314   2HD   ARG  42          1HD       ARG  42   1.919  10.548   3.736
  315    HE   ARG  42           HE       ARG  42   3.115   7.957   3.945
  316   1HH1  ARG  42          1HH1      ARG  42   0.344   9.704   2.080
  317   2HH1  ARG  42          2HH1      ARG  42   1.578   9.540   0.876
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.328   2.839
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.787   1.327
  320    H    ASN  43           H        ASN  43   7.997  10.295   1.243
  321    HA   ASN  43           HA       ASN  43   9.990   9.199   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.556  11.533   2.023
  323   2HB   ASN  43          1HB       ASN  43  10.441  10.968   3.696
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.104   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.588   9.743   1.390
  326    H    LYS  44           H        LYS  44   7.799   7.928   2.742
  327    HA   LYS  44           HA       LYS  44   9.469   6.181   4.410
  328   1HB   LYS  44          2HB       LYS  44   8.222   7.816   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.711   7.206   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.014   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.597   6.830
  332   1HD   LYS  44          2HD       LYS  44   7.583   7.120   8.279
  333   2HD   LYS  44          1HD       LYS  44   6.034   6.934   7.436
  334   1HE   LYS  44          2HE       LYS  44   7.384   4.698   8.960
  335   2HE   LYS  44          1HE       LYS  44   6.178   5.779   9.676
  336   1HZ   LYS  44          1HZ       LYS  44   5.865   3.724   7.646
  337   2HZ   LYS  44          2HZ       LYS  44   4.808   5.044   7.655
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.034   9.023
  339    HA   PRO  45           HA       PRO  45   7.453   3.619   1.209
  340   1HB   PRO  45          2HB       PRO  45   8.336   1.316   2.815
  341   2HB   PRO  45          1HB       PRO  45   8.652   1.689   1.129
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.990   2.946
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.161   1.649
  344   1HD   PRO  45          1HD       PRO  45   9.468   3.381   4.525
  345   2HD   PRO  45          2HD       PRO  45  10.320   4.576   3.571
  346    H    PHE  46           H        PHE  46   5.602   2.323   1.036
  347    HA   PHE  46           HA       PHE  46   3.982   2.333   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.005   3.314   1.482
  349   2HB   PHE  46          1HB       PHE  46   3.340   1.840   0.558
  350    HD1  PHE  46           HD1      PHE  46   1.391   3.118   3.440
  351    HD2  PHE  46           HD2      PHE  46   1.766   0.211   0.359
  352    HE1  PHE  46           HE1      PHE  46  -0.840   2.247   3.982
  353    HE2  PHE  46           HE2      PHE  46  -0.462  -0.655   0.917
  354    HZ   PHE  46           HZ       PHE  46  -1.779   0.359   2.731
  355    H    LYS  47           H        LYS  47   3.423   0.256   4.456
  356    HA   LYS  47           HA       LYS  47   4.541  -2.087   3.051
  357   1HB   LYS  47          2HB       LYS  47   3.966  -1.641   5.983
  358   2HB   LYS  47          1HB       LYS  47   4.454  -3.195   5.294
  359   1HG   LYS  47          2HG       LYS  47   6.484  -2.130   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.001  -0.633   5.254
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.684   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.493  -3.262   6.666
  363   1HE   LYS  47          2HE       LYS  47   8.467  -2.423   5.552
  364   2HE   LYS  47          1HE       LYS  47   8.132  -0.778   6.118
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.000   8.399
  366   2HZ   LYS  47          2HZ       LYS  47   9.622  -1.386   7.635
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.045   7.526
  368    H    PHE  48           H        PHE  48   3.031  -3.771   2.431
  369    HA   PHE  48           HA       PHE  48   0.643  -3.987   4.112
  370   1HB   PHE  48          2HB       PHE  48  -0.871  -4.237   2.307
  371   2HB   PHE  48          1HB       PHE  48   0.050  -2.758   1.980
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.774   0.222
  373    HD2  PHE  48           HD2      PHE  48  -0.909  -6.024   0.770
  374    HE1  PHE  48           HE1      PHE  48   2.258  -3.558  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.439  -6.811  -1.533
  376    HZ   PHE  48           HZ       PHE  48   1.147  -5.556  -2.945
  377    H    MET  49           H        MET  49  -0.030  -6.291   4.274
  378    HA   MET  49           HA       MET  49   1.873  -8.238   3.220
  379   1HB   MET  49          2HB       MET  49   1.322  -8.654   5.477
  380   2HB   MET  49          1HB       MET  49  -0.402  -8.376   5.187
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.502   4.181
  382   2HG   MET  49          1HG       MET  49   1.092 -10.766   4.146
  383   1HE   MET  49          1HE       MET  49   1.595 -10.935   8.133
  384   2HE   MET  49          2HE       MET  49   1.277  -9.410   7.306
  385   3HE   MET  49          3HE       MET  49   2.404 -10.574   6.606
  386    H    LEU  50           H        LEU  50   1.556  -9.321   1.511
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.101  -0.214
  388   1HB   LEU  50          2HB       LEU  50   1.838 -10.577  -0.103
  389   2HB   LEU  50          1HB       LEU  50   0.514 -11.617  -0.634
  390    HG   LEU  50           HG       LEU  50   1.996  -9.556  -2.080
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.296  -2.468
  392   2HD1  LEU  50          2HD1      LEU  50   2.460 -11.927  -2.291
  393   3HD1  LEU  50          3HD1      LEU  50   1.597 -11.432  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.265  -9.495  -3.781
  395   2HD2  LEU  50          2HD2      LEU  50  -0.225  -8.668  -2.302
  396   3HD2  LEU  50          3HD2      LEU  50  -0.850 -10.277  -2.661
  397    H    GLY  51           H        GLY  51  -2.500 -10.135  -0.244
  398   1HA   GLY  51          2HA       GLY  51  -3.966 -11.915  -0.223
  399   2HA   GLY  51          1HA       GLY  51  -2.816 -12.829   0.766
  400    H    LYS  52           H        LYS  52  -3.037  -9.957   2.331
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.123   4.259
  402   1HB   LYS  52          2HB       LYS  52  -2.633  -9.864   4.489
  403   2HB   LYS  52          1HB       LYS  52  -3.670  -8.436   4.366
  404   1HG   LYS  52          2HG       LYS  52  -4.948  -9.342   6.363
  405   2HG   LYS  52          1HG       LYS  52  -3.626 -10.506   6.555
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.610   6.083
  407   2HD   LYS  52          1HD       LYS  52  -3.413  -7.508   6.196
  408   1HE   LYS  52          2HE       LYS  52  -3.789  -8.459   8.459
  409   2HE   LYS  52          1HE       LYS  52  -2.180  -9.180   8.302
  410   1HZ   LYS  52          1HZ       LYS  52  -2.521  -6.810   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.380   7.620
  412   3HZ   LYS  52          3HZ       LYS  52  -1.188  -7.185   8.286
  413    H    GLN  53           H        GLN  53  -5.464  -9.222   1.593
  414    HA   GLN  53           HA       GLN  53  -7.281  -8.071   0.876
  415   1HB   GLN  53          2HB       GLN  53  -8.463  -9.203   3.401
  416   2HB   GLN  53          1HB       GLN  53  -9.382  -8.294   2.195
  417   1HG   GLN  53          2HG       GLN  53  -9.298  -9.999   0.667
  418   2HG   GLN  53          1HG       GLN  53  -7.927 -10.783   1.470
  419   1HE2  GLN  53          1HE2      GLN  53  -9.752 -12.934   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.730   3.277
  421    H    GLU  54           H        GLU  54  -5.348  -6.569   2.308
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.584   3.518
  423   1HB   GLU  54          2HB       GLU  54  -5.239  -3.760   4.725
  424   2HB   GLU  54          1HB       GLU  54  -5.554  -5.464   5.079
  425   1HG   GLU  54          2HG       GLU  54  -3.732  -6.107   3.601
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.399   3.248
  427    H    VAL  55           H        VAL  55  -5.459  -5.033   0.730
  428    HA   VAL  55           HA       VAL  55  -5.542  -2.134   0.238
  429    HB   VAL  55           HB       VAL  55  -3.881  -2.656  -1.664
  430   1HG1  VAL  55          1HG1      VAL  55  -3.276  -2.881   1.284
  431   2HG1  VAL  55          2HG1      VAL  55  -3.215  -1.441   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.005  -2.710   0.073
  433   1HG2  VAL  55          1HG2      VAL  55  -3.254  -5.154  -0.162
  434   2HG2  VAL  55          2HG2      VAL  55  -2.605  -4.582  -1.697
  435   3HG2  VAL  55          3HG2      VAL  55  -4.278  -5.125  -1.597
  436    H    ILE  56           H        ILE  56  -5.906  -1.831  -2.310
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.119  -2.876
  438    HB   ILE  56           HB       ILE  56  -8.230  -1.808  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.913  -0.390  -3.802
  440   2HG1  ILE  56          1HG1      ILE  56  -5.703  -1.647  -5.033
  441   1HG2  ILE  56          1HG2      ILE  56  -9.528  -0.598  -3.668
  442   2HG2  ILE  56          2HG2      ILE  56  -8.132   0.476  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.379  -0.754  -2.341
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.249  -6.671
  445   2HD1  ILE  56          2HD1      ILE  56  -5.492   0.605  -5.992
  446   3HD1  ILE  56          3HD1      ILE  56  -7.123   0.997  -5.448
  447    H    ARG  57           H        ARG  57  -8.930  -4.372  -4.685
  448    HA   ARG  57           HA       ARG  57  -7.301  -6.655  -4.957
  449   1HB   ARG  57          2HB       ARG  57  -9.778  -6.631  -5.311
  450   2HB   ARG  57          1HB       ARG  57  -9.544  -5.687  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.334  -7.515  -7.791
  452   2HG   ARG  57          1HG       ARG  57  -8.506  -8.459  -6.302
  453   1HD   ARG  57          2HD       ARG  57 -10.927  -8.588  -6.657
  454   2HD   ARG  57          1HD       ARG  57 -10.768  -7.626  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.770  -8.134
  456   1HH1  ARG  57          1HH1      ARG  57 -12.265  -9.326  -9.730
  457   2HH1  ARG  57          2HH1      ARG  57 -12.630 -10.669  -8.699
  458   1HH2  ARG  57          1HH2      ARG  57  -9.483 -11.967  -9.049
  459   2HH2  ARG  57          2HH2      ARG  57 -10.210 -11.505 -10.550
  460    H    GLY  58           H        GLY  58  -7.319  -3.873  -7.249
  461   1HA   GLY  58          2HA       GLY  58  -5.786  -5.257  -9.176
  462   2HA   GLY  58          1HA       GLY  58  -5.913  -3.499  -9.004
  463    H    TRP  59           H        TRP  59  -4.853  -3.702  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.019  -3.684  -6.667
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.133  -4.344
  466   2HB   TRP  59          1HB       TRP  59  -2.167  -3.715  -3.948
  467    HD1  TRP  59           HD1      TRP  59  -3.605  -1.156  -6.510
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.903  -6.378
  469    HE3  TRP  59           HE3      TRP  59  -0.322  -2.655  -2.813
  470    HZ2  TRP  59           HZ2      TRP  59   0.090   1.800  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.154
  472    HH2  TRP  59           HH2      TRP  59   1.658   1.074  -3.214
  473    H    GLU  60           H        GLU  60  -3.997  -5.885  -4.553
  474    HA   GLU  60           HA       GLU  60  -2.181  -7.808  -3.914
  475   1HB   GLU  60          2HB       GLU  60  -4.936  -8.446  -4.978
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.488  -3.962
  477   1HG   GLU  60          2HG       GLU  60  -4.904  -6.875  -2.951
  478   2HG   GLU  60          1HG       GLU  60  -5.969  -8.292  -2.983
  479    H    GLU  61           H        GLU  61  -3.992  -7.516  -6.944
  480    HA   GLU  61           HA       GLU  61  -2.771  -9.828  -8.163
  481   1HB   GLU  61          2HB       GLU  61  -4.419  -7.607  -9.393
  482   2HB   GLU  61          1HB       GLU  61  -4.041  -9.166 -10.139
  483   1HG   GLU  61          2HG       GLU  61  -5.247  -9.498  -7.528
  484   2HG   GLU  61          1HG       GLU  61  -6.276  -8.538  -8.605
  485    H    GLY  62           H        GLY  62  -2.125  -6.342  -8.334
  486   1HA   GLY  62          2HA       GLY  62  -0.508  -6.786 -10.674
  487   2HA   GLY  62          1HA       GLY  62  -0.757  -5.248  -9.833
  488    H    VAL  63           H        VAL  63   0.133  -5.860  -7.305
  489    HA   VAL  63           HA       VAL  63   2.942  -5.683  -7.764
  490    HB   VAL  63           HB       VAL  63   1.302  -5.995  -5.199
  491   1HG1  VAL  63          1HG1      VAL  63   3.648  -6.696  -4.933
  492   2HG1  VAL  63          2HG1      VAL  63   3.349  -5.181  -4.082
  493   3HG1  VAL  63          3HG1      VAL  63   4.186  -5.171  -5.633
  494   1HG2  VAL  63          1HG2      VAL  63   0.933  -3.779  -6.427
  495   2HG2  VAL  63          2HG2      VAL  63   2.678  -3.533  -6.449
  496   3HG2  VAL  63          3HG2      VAL  63   1.807  -3.529  -4.917
  497    H    ALA  64           H        ALA  64   0.821  -8.472  -7.070
  498    HA   ALA  64           HA       ALA  64   2.871 -10.242  -6.296
  499   1HB   ALA  64          1HB       ALA  64   0.455 -10.983  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.405 -10.689  -6.178
  501   3HB   ALA  64          3HB       ALA  64   1.385 -12.006  -6.820
  502    H    GLN  65           H        GLN  65   2.108  -8.870  -9.375
  503    HA   GLN  65           HA       GLN  65   3.585 -10.841 -10.888
  504   1HB   GLN  65          2HB       GLN  65   2.247  -8.222 -11.564
  505   2HB   GLN  65          1HB       GLN  65   3.243  -9.100 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.822 -11.071 -12.541
  507   2HG   GLN  65          1HG       GLN  65   0.883 -10.309 -11.244
  508   1HE2  GLN  65          1HE2      GLN  65  -1.178  -9.486 -12.159
  509   2HE2  GLN  65          2HE2      GLN  65  -0.903  -8.127 -13.191
  510    H    MET  66           H        MET  66   4.752  -8.571  -8.816
  511    HA   MET  66           HA       MET  66   6.777  -7.619 -10.720
  512   1HB   MET  66          2HB       MET  66   5.985  -6.534  -8.024
  513   2HB   MET  66          1HB       MET  66   7.237  -5.863  -9.079
  514   1HG   MET  66          2HG       MET  66   5.598  -5.381 -10.782
  515   2HG   MET  66          1HG       MET  66   4.328  -6.153  -9.815
  516   1HE   MET  66          1HE       MET  66   7.230  -3.851  -8.685
  517   2HE   MET  66          2HE       MET  66   6.481  -2.254  -8.657
  518   3HE   MET  66          3HE       MET  66   6.730  -3.083 -10.192
  519    H    SER  67           H        SER  67   8.935  -7.975 -10.280
  520    HA   SER  67           HA       SER  67   9.649  -9.757  -8.078
  521   1HB   SER  67          2HB       SER  67  11.858  -9.703  -9.291
  522   2HB   SER  67          1HB       SER  67  10.496 -10.434 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.798 -11.555
  524    H    VAL  68           H        VAL  68  11.482  -9.147  -6.637
  525    HA   VAL  68           HA       VAL  68  11.309  -6.546  -5.629
  526    HB   VAL  68           HB       VAL  68  13.512  -8.621  -5.345
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.417  -3.308
  528   2HG1  VAL  68          2HG1      VAL  68  12.990  -6.167  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.360  -6.390  -4.732
  530   1HG2  VAL  68          1HG2      VAL  68  11.724  -9.651  -4.480
  531   2HG2  VAL  68          2HG2      VAL  68  10.882  -8.142  -4.131
  532   3HG2  VAL  68          3HG2      VAL  68  12.174  -8.699  -3.065
  533    H    GLY  69           H        GLY  69  12.137  -4.763  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.884  -3.301  -6.746
  535   2HA   GLY  69          1HA       GLY  69  14.459  -4.530  -7.883
  536    H    GLN  70           H        GLN  70  11.269  -4.687  -8.434
  537    HA   GLN  70           HA       GLN  70  11.690  -3.131 -10.840
  538   1HB   GLN  70          2HB       GLN  70  10.813  -5.488 -10.677
  539   2HB   GLN  70          1HB       GLN  70   9.325  -4.777 -10.035
  540   1HG   GLN  70          2HG       GLN  70   9.149  -3.444 -12.105
  541   2HG   GLN  70          1HG       GLN  70  10.537  -4.345 -12.742
  542   1HE2  GLN  70          2HE2      GLN  70   9.494  -7.239 -12.034
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.874 -11.427
  544    H    ARG  71           H        ARG  71  10.582  -1.587 -11.625
  545    HA   ARG  71           HA       ARG  71   8.697  -0.179  -9.843
  546   1HB   ARG  71          2HB       ARG  71  10.804   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.688   1.054 -11.765
  548   1HG   ARG  71          2HG       ARG  71   8.898   2.570 -11.793
  549   2HG   ARG  71          1HG       ARG  71   8.396   2.159 -10.146
  550   1HD   ARG  71          2HD       ARG  71  10.283   3.311  -9.213
  551   2HD   ARG  71          1HD       ARG  71  10.989   3.554 -10.819
  552    HE   ARG  71           HE       ARG  71   8.426   4.695 -10.779
  553   1HH1  ARG  71          2HH1      ARG  71  11.613   5.179  -9.290
  554   2HH1  ARG  71          1HH1      ARG  71  11.463   6.905  -9.285
  555   1HH2  ARG  71          1HH2      ARG  71   8.121   6.877 -10.464
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.986
  557    H    ALA  72           H        ALA  72   6.800  -0.069 -10.813
  558    HA   ALA  72           HA       ALA  72   6.470  -0.150 -13.715
  559   1HB   ALA  72          1HB       ALA  72   5.012  -2.005 -13.696
  560   2HB   ALA  72          2HB       ALA  72   4.894  -1.996 -11.937
  561   3HB   ALA  72          3HB       ALA  72   6.392  -2.503 -12.716
  562    H    LYS  73           H        LYS  73   4.461   0.425 -14.506
  563    HA   LYS  73           HA       LYS  73   2.806   2.084 -12.737
  564   1HB   LYS  73          2HB       LYS  73   3.832   3.036 -14.745
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.822 -15.724
  566   1HG   LYS  73          2HG       LYS  73   0.828   2.876 -14.912
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.218 -14.335
  568   1HD   LYS  73          2HD       LYS  73   2.966   4.301 -16.496
  569   2HD   LYS  73          1HD       LYS  73   1.972   2.953 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.017   4.448 -16.677
  571   2HE   LYS  73          1HE       LYS  73   1.148   5.769 -16.498
  572   1HZ   LYS  73          1HZ       LYS  73   0.808   4.007 -18.847
  573   2HZ   LYS  73          2HZ       LYS  73   2.039   5.157 -18.682
  574   3HZ   LYS  73          3HZ       LYS  73   0.408   5.648 -18.751
  575    H    LEU  74           H        LEU  74   0.909   1.250 -12.074
  576    HA   LEU  74           HA       LEU  74  -0.136  -1.173 -13.368
  577   1HB   LEU  74          2HB       LEU  74   0.213  -0.093 -10.656
  578   2HB   LEU  74          1HB       LEU  74  -1.340  -0.881 -10.938
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.000 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.991  -3.482 -11.265
  581   2HD1  LEU  74          2HD1      LEU  74   2.322  -1.756 -11.424
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.587 -12.650
  583   1HD2  LEU  74          1HD2      LEU  74  -0.468  -1.889  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.230  -1.448  -9.036
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.145  -8.938
  586    H    THR  75           H        THR  75  -1.870  -0.574 -14.791
  587    HA   THR  75           HA       THR  75  -3.497   1.772 -14.022
  588    HB   THR  75           HB       THR  75  -3.435   0.122 -16.596
  589    HG1  THR  75           HG1      THR  75  -1.654   1.266 -16.761
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.968 -17.628
  591   2HG2  THR  75          2HG2      THR  75  -4.844   2.694 -16.038
  592   3HG2  THR  75          3HG2      THR  75  -5.576   1.134 -16.413
  593    H    ILE  76           H        ILE  76  -5.455   1.333 -12.988
  594    HA   ILE  76           HA       ILE  76  -6.290  -1.483 -12.781
  595    HB   ILE  76           HB       ILE  76  -6.388   0.673 -10.636
  596   1HG1  ILE  76          2HG1      ILE  76  -4.508  -1.673 -10.946
  597   2HG1  ILE  76          1HG1      ILE  76  -4.085   0.025 -11.221
  598   1HG2  ILE  76          1HG2      ILE  76  -7.209  -2.170 -10.634
  599   2HG2  ILE  76          2HG2      ILE  76  -8.129  -0.726 -10.214
  600   3HG2  ILE  76          3HG2      ILE  76  -6.833  -1.283  -9.157
  601   1HD1  ILE  76          1HD1      ILE  76  -4.414  -1.467  -8.691
  602   2HD1  ILE  76          2HD1      ILE  76  -4.926   0.221  -8.708
  603   3HD1  ILE  76          3HD1      ILE  76  -3.267  -0.200  -9.126
  604    H    SER  77           H        SER  77  -8.340  -1.762 -13.535
  605    HA   SER  77           HA       SER  77 -10.075   0.347 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.734  -1.396 -14.643
  607   2HB   SER  77          1HB       SER  77 -10.164  -1.886 -15.295
  608    HG   SER  77           HG       SER  77 -11.683  -3.016 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.060   1.321 -10.426
  610   1HB   PRO  78          2HB       PRO  78 -14.776   1.356 -11.226
  611   2HB   PRO  78          1HB       PRO  78 -13.687   2.734 -11.185
  612   1HG   PRO  78          2HG       PRO  78 -14.507   1.056 -13.514
  613   2HG   PRO  78          1HG       PRO  78 -14.012   2.741 -13.487
  614   1HD   PRO  78          1HD       PRO  78 -12.360   0.789 -14.398
  615   2HD   PRO  78          2HD       PRO  78 -11.741   2.212 -13.585
  616    H    ASP  79           H        ASP  79 -13.479  -1.462 -12.056
  617    HA   ASP  79           HA       ASP  79 -14.745  -2.334  -9.643
  618   1HB   ASP  79          2HB       ASP  79 -15.146  -4.411 -10.855
  619   2HB   ASP  79          1HB       ASP  79 -15.489  -3.031 -11.910
  620    H    TYR  80           H        TYR  80 -11.546  -2.401 -10.612
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.457  -8.686
  622   1HB   TYR  80          2HB       TYR  80  -9.560  -3.182 -11.069
  623   2HB   TYR  80          1HB       TYR  80  -8.479  -3.756  -9.787
  624    HD1  TYR  80           HD1      TYR  80 -11.502  -4.892 -11.641
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.877
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.200 -12.483
  627    HE2  TYR  80           HE2      TYR  80  -7.919  -8.145 -10.692
  628    HH   TYR  80           HH       TYR  80  -8.976  -9.435 -12.228
  629    H    ALA  81           H        ALA  81 -11.564  -1.443  -8.397
  630    HA   ALA  81           HA       ALA  81  -9.393  -0.749  -6.538
  631   1HB   ALA  81          1HB       ALA  81  -9.043   0.366  -8.763
  632   2HB   ALA  81          2HB       ALA  81  -9.309   1.510  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.616   1.141  -8.573
  634    H    TYR  82           H        TYR  82 -11.706   1.776  -7.023
  635    HA   TYR  82           HA       TYR  82 -13.144   0.958  -4.576
  636   1HB   TYR  82          2HB       TYR  82 -12.502   3.643  -5.852
  637   2HB   TYR  82          1HB       TYR  82 -13.464   3.448  -4.376
  638    HD1  TYR  82           HD1      TYR  82 -12.314   2.135  -2.428
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.941  -5.711
  640    HE1  TYR  82           HE1      TYR  82 -10.208   2.036  -1.126
  641    HE2  TYR  82           HE2      TYR  82  -8.142   3.838  -4.422
  642    HH   TYR  82           HH       TYR  82  -7.557   3.779  -1.856
  643    H    GLY  83           H        GLY  83 -13.805   0.861  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.707   0.433  -8.896
  645   2HA   GLY  83          1HA       GLY  83 -16.439   0.098  -7.320
  646    H    ALA  84           H        ALA  84 -18.268   0.983  -7.434
  647    HA   ALA  84           HA       ALA  84 -18.707   3.584  -8.634
  648   1HB   ALA  84          1HB       ALA  84 -20.323   1.691  -8.791
  649   2HB   ALA  84          2HB       ALA  84 -21.024   3.181  -8.157
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.863  -7.059
  651    H    THR  85           H        THR  85 -18.020   2.429  -5.346
  652    HA   THR  85           HA       THR  85 -19.182   4.739  -4.103
  653    HB   THR  85           HB       THR  85 -16.856   3.115  -3.032
  654    HG1  THR  85           HG1      THR  85 -19.571   2.453  -2.689
  655   1HG2  THR  85          1HG2      THR  85 -19.157   4.617  -1.811
  656   2HG2  THR  85          2HG2      THR  85 -17.432   4.850  -1.532
  657   3HG2  THR  85          3HG2      THR  85 -18.237   3.409  -0.916
  658    H    GLY  86           H        GLY  86 -15.913   4.003  -5.319
  659   1HA   GLY  86          2HA       GLY  86 -14.100   5.462  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.215   6.806  -5.305
  661    H    HIS  87           H        HIS  87 -13.166   7.510  -3.885
  662    HA   HIS  87           HA       HIS  87 -13.464   6.202  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.189   6.025  -2.259
  664   2HB   HIS  87          1HB       HIS  87 -11.086   7.793  -2.210
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.797   0.416
  666    HD2  HIS  87           HD2      HIS  87 -10.710   4.669  -0.091
  667    HE1  HIS  87           HE1      HIS  87 -10.104   7.851   2.597
  668    HE2  HIS  87           HE2      HIS  87 -10.001   5.372   2.223
  669    HA   PRO  88           HA       PRO  88 -15.772  10.118  -0.977
  670   1HB   PRO  88          2HB       PRO  88 -15.861  10.506   1.731
  671   2HB   PRO  88          1HB       PRO  88 -16.875   9.331   0.912
  672   1HG   PRO  88          2HG       PRO  88 -14.225   8.864   2.308
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.496
  674   1HD   PRO  88          1HD       PRO  88 -13.869   6.988   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.541   6.972   0.309
  676    H    GLY  89           H        GLY  89 -15.166  11.873  -1.572
  677   1HA   GLY  89          2HA       GLY  89 -14.151  13.914  -1.650
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.214
  679    H    ILE  90           H        ILE  90 -12.041  11.021  -1.770
  680    HA   ILE  90           HA       ILE  90  -9.978  12.655  -3.119
  681    HB   ILE  90           HB       ILE  90  -9.842   9.884  -1.827
  682   1HG1  ILE  90          2HG1      ILE  90  -8.444  12.389  -0.968
  683   2HG1  ILE  90          1HG1      ILE  90 -10.099  12.030  -0.441
  684   1HG2  ILE  90          1HG2      ILE  90  -7.309  10.386  -1.932
  685   2HG2  ILE  90          2HG2      ILE  90  -7.712  11.628  -3.117
  686   3HG2  ILE  90          3HG2      ILE  90  -8.067   9.934  -3.460
  687   1HD1  ILE  90          1HD1      ILE  90  -9.336  10.708   1.163
  688   2HD1  ILE  90          2HD1      ILE  90  -7.694  11.180   0.726
  689   3HD1  ILE  90          3HD1      ILE  90  -8.424   9.749  -0.002
  690    H    ILE  91           H        ILE  91 -11.666   9.563  -3.637
  691    HA   ILE  91           HA       ILE  91 -10.634   9.709  -6.403
  692    HB   ILE  91           HB       ILE  91 -11.716   7.252  -4.977
  693   1HG1  ILE  91          2HG1      ILE  91  -9.603   7.977  -3.972
  694   2HG1  ILE  91          1HG1      ILE  91  -9.414   6.461  -4.872
  695   1HG2  ILE  91          1HG2      ILE  91 -10.553   6.111  -6.911
  696   2HG2  ILE  91          2HG2      ILE  91 -10.440   7.708  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.020   7.012  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.509   7.969  -5.199
  699   2HD1  ILE  91          2HD1      ILE  91  -8.592   9.197  -5.853
  700   3HD1  ILE  91          3HD1      ILE  91  -8.369   7.672  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.251  10.299  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.682   9.827  -9.877
  703   2HB   PRO  92          1HB       PRO  92 -15.346  11.254  -9.100
  704   1HG   PRO  92          2HG       PRO  92 -12.862  11.317 -10.114
  705   2HG   PRO  92          1HG       PRO  92 -13.211  12.133  -8.600
  706   1HD   PRO  92          1HD       PRO  92 -12.059   9.356  -8.999
  707   2HD   PRO  92          2HD       PRO  92 -11.419  10.652  -8.011
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.868
  709   1HB   PRO  93          2HB       PRO  93 -18.921   7.282  -9.559
  710   2HB   PRO  93          1HB       PRO  93 -19.087   6.342  -8.087
  711   1HG   PRO  93          2HG       PRO  93 -19.618   9.036  -8.232
  712   2HG   PRO  93          1HG       PRO  93 -19.150   8.221  -6.749
  713   1HD   PRO  93          1HD       PRO  93 -17.516   9.977  -8.525
  714   2HD   PRO  93          2HD       PRO  93 -17.370   9.712  -6.800
  715    H    HIS  94           H        HIS  94 -16.500   4.744  -9.377
  716    HA   HIS  94           HA       HIS  94 -15.945   3.695 -11.308
  717   1HB   HIS  94          2HB       HIS  94 -17.267   6.169 -12.562
  718   2HB   HIS  94          1HB       HIS  94 -16.932   4.653 -13.416
  719    HD1  HIS  94           HD1      HIS  94 -18.295   2.487 -12.154
  720    HD2  HIS  94           HD2      HIS  94 -19.607   6.360 -11.436
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.310 -11.165
  722    HE2  HIS  94           HE2      HIS  94 -21.351   4.657 -10.759
  723    H    ALA  95           H        ALA  95 -13.895   5.538 -10.142
  724    HA   ALA  95           HA       ALA  95 -12.524   6.636 -12.450
  725   1HB   ALA  95          1HB       ALA  95 -12.630   7.329  -9.871
  726   2HB   ALA  95          2HB       ALA  95 -11.237   7.692 -10.891
  727   3HB   ALA  95          3HB       ALA  95 -11.203   6.294  -9.819
  728    H    THR  96           H        THR  96 -10.924   5.699 -13.746
  729    HA   THR  96           HA       THR  96  -9.714   3.198 -13.009
  730    HB   THR  96           HB       THR  96  -9.159   5.171 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.420   3.812 -16.393
  732   1HG2  THR  96          1HG2      THR  96  -7.731   2.634 -14.646
  733   2HG2  THR  96          2HG2      THR  96  -7.064   4.251 -14.873
  734   3HG2  THR  96          3HG2      THR  96  -7.753   3.381 -16.245
  735    H    LEU  97           H        LEU  97  -7.695   3.077 -11.872
  736    HA   LEU  97           HA       LEU  97  -6.463   5.644 -11.104
  737   1HB   LEU  97          2HB       LEU  97  -6.522   2.946  -9.733
  738   2HB   LEU  97          1HB       LEU  97  -5.731   4.393  -9.102
  739    HG   LEU  97           HG       LEU  97  -8.696   3.976  -9.443
  740   1HD1  LEU  97          1HD1      LEU  97  -8.707   3.955  -7.054
  741   2HD1  LEU  97          2HD1      LEU  97  -6.988   4.352  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.511   2.781  -7.603
  743   1HD2  LEU  97          1HD2      LEU  97  -8.505   6.246  -9.826
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.407  -8.822
  745   3HD2  LEU  97          3HD2      LEU  97  -8.646   6.199  -8.069
  746    H    VAL  98           H        VAL  98  -4.208   5.848 -11.144
  747    HA   VAL  98           HA       VAL  98  -2.849   3.762 -12.691
  748    HB   VAL  98           HB       VAL  98  -2.520   6.781 -12.882
  749   1HG1  VAL  98          1HG1      VAL  98  -1.025   4.461 -14.104
  750   2HG1  VAL  98          2HG1      VAL  98  -0.379   5.705 -13.036
  751   3HG1  VAL  98          3HG1      VAL  98  -0.882   6.123 -14.673
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.908 -15.156
  753   2HG2  VAL  98          2HG2      VAL  98  -3.415   6.653 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.469   5.573 -14.150
  755    H    PHE  99           H        PHE  99  -1.239   2.912 -11.257
  756    HA   PHE  99           HA       PHE  99  -0.234   4.766  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.719   1.815  -9.169
  758   2HB   PHE  99          1HB       PHE  99   0.435   2.563  -8.051
  759    HD1  PHE  99           HD1      PHE  99  -3.098   2.161  -8.947
  760    HD2  PHE  99           HD2      PHE  99  -0.266   3.912  -6.250
  761    HE1  PHE  99           HE1      PHE  99  -4.903   2.660  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.089   4.403  -4.663
  763    HZ   PHE  99           HZ       PHE  99  -4.397   3.778  -5.220
  764    H    ASP 100           H        ASP 100   1.948   5.076  -9.151
  765    HA   ASP 100           HA       ASP 100   3.708   3.599 -10.964
  766   1HB   ASP 100          2HB       ASP 100   3.847   5.986 -11.157
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.149  -9.411
  768    H    VAL 101           H        VAL 101   4.563   1.928  -9.766
  769    HA   VAL 101           HA       VAL 101   4.827   2.053  -6.828
  770    HB   VAL 101           HB       VAL 101   3.653  -0.201  -8.531
  771   1HG1  VAL 101          1HG1      VAL 101   3.149  -1.243  -6.291
  772   2HG1  VAL 101          2HG1      VAL 101   4.248  -0.061  -5.580
  773   3HG1  VAL 101          3HG1      VAL 101   4.851  -1.233  -6.751
  774   1HG2  VAL 101          1HG2      VAL 101   1.645   0.199  -7.114
  775   2HG2  VAL 101          2HG2      VAL 101   2.123   1.753  -7.797
  776   3HG2  VAL 101          3HG2      VAL 101   2.550   1.352  -6.132
  777    H    GLU 102           H        GLU 102   6.714   1.360  -6.030
  778    HA   GLU 102           HA       GLU 102   8.510  -0.105  -7.838
  779   1HB   GLU 102          2HB       GLU 102   9.366   2.100  -7.492
  780   2HB   GLU 102          1HB       GLU 102   9.085   1.988  -5.749
  781   1HG   GLU 102          2HG       GLU 102  10.832   0.480  -5.436
  782   2HG   GLU 102          1HG       GLU 102  10.876   0.033  -7.150
  783    H    LEU 103           H        LEU 103   8.833  -2.173  -7.006
  784    HA   LEU 103           HA       LEU 103   8.028  -2.669  -4.241
  785   1HB   LEU 103          2HB       LEU 103   7.225  -4.249  -5.863
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.467  -6.530
  787    HG   LEU 103           HG       LEU 103   9.548  -5.665  -4.532
  788   1HD1  LEU 103          1HD1      LEU 103   6.782  -4.963  -3.524
  789   2HD1  LEU 103          2HD1      LEU 103   8.336  -4.624  -2.761
  790   3HD1  LEU 103          3HD1      LEU 103   7.733  -6.280  -2.836
  791   1HD2  LEU 103          1HD2      LEU 103   7.981  -7.616  -4.729
  792   2HD2  LEU 103          2HD2      LEU 103   8.588  -7.006  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.950  -6.610  -5.747
  794    H    LEU 104           H        LEU 104   9.456  -2.278  -2.765
  795    HA   LEU 104           HA       LEU 104  12.289  -2.024  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.807  -1.446  -0.821
  797   2HB   LEU 104          1HB       LEU 104  12.476  -0.997  -1.181
  798    HG   LEU 104           HG       LEU 104  10.041   0.191  -2.506
  799   1HD1  LEU 104          1HD1      LEU 104  10.370   0.798  -0.055
  800   2HD1  LEU 104          2HD1      LEU 104  10.327   2.140  -1.199
  801   3HD1  LEU 104          3HD1      LEU 104  11.871   1.580  -0.555
  802   1HD2  LEU 104          1HD2      LEU 104  12.275   0.035  -3.736
  803   2HD2  LEU 104          2HD2      LEU 104  12.923   1.103  -2.493
  804   3HD2  LEU 104          3HD2      LEU 104  11.622   1.662  -3.544
  805    H    LYS 105           H        LYS 105  10.327  -4.008  -1.313
  806    HA   LYS 105           HA       LYS 105  12.566  -5.750  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.826  -3.636   0.611
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.082   1.446
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.014   2.349
  810   2HG   LYS 105          1HG       LYS 105  13.833  -5.708   1.416
  811   1HD   LYS 105          2HD       LYS 105  14.217  -3.641   2.556
  812   2HD   LYS 105          1HD       LYS 105  12.614  -3.695   3.310
  813   1HE   LYS 105          2HE       LYS 105  13.276  -5.923   4.301
  814   2HE   LYS 105          1HE       LYS 105  14.923  -5.603   3.733
  815   1HZ   LYS 105          1HZ       LYS 105  13.452  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.253  -3.309   4.908
  817   3HZ   LYS 105          3HZ       LYS 105  15.123  -4.567   5.661
  818    H    LEU 106           H        LEU 106  11.793  -7.704   0.372
  819    HA   LEU 106           HA       LEU 106   8.922  -7.755   1.010
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.084   0.183
  821   2HB   LEU 106          1HB       LEU 106   8.990 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.870  -8.834  -1.809
  823   1HD1  LEU 106          1HD1      LEU 106   8.416 -11.424  -1.350
  824   2HD1  LEU 106          2HD1      LEU 106  10.120 -11.286  -1.775
  825   3HD1  LEU 106          3HD1      LEU 106   8.884 -10.734  -2.904
  826   1HD2  LEU 106          1HD2      LEU 106   7.567  -8.573  -2.322
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.674
  828   3HD2  LEU 106          3HD2      LEU 106   7.073  -9.577  -0.960
  829    H    GLU 107           HN       GLU 107   8.525  -8.270   3.052
  830    HA   GLU 107           HA       GLU 107  10.716  -9.187   4.801
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.227   5.416
  832   2HB   GLU 107          1HB       GLU 107   9.696  -7.831   6.579
  833   1HG   GLU 107          2HG       GLU 107  11.467  -6.822   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.233  -6.152   4.165
  835    H2   GPI 108           H2       GPI 108  -4.784   1.300  -1.261
  836   1H5   GPI 108          1H5       GPI 108  -3.292   3.832  -2.222
  837   2H5   GPI 108          2H5       GPI 108  -2.267   4.204  -0.823
  838   1H3   GPI 108          1H3       GPI 108  -2.639   0.087  -1.319
  839   2H3   GPI 108          2H3       GPI 108  -2.100   0.819   0.203
  840   1H4   GPI 108          1H4       GPI 108  -2.076   1.903  -2.617
  841   2H4   GPI 108          2H4       GPI 108  -0.962   2.331  -1.281
  842   1H14  GPI 108          1H14      GPI 108  -7.541  -0.093   0.238
  843   2H14  GPI 108          2H14      GPI 108  -6.645   1.388  -0.171
  844   1H15  GPI 108          1H15      GPI 108  -6.503   1.470   2.566
  845   2H15  GPI 108          2H15      GPI 108  -7.795   2.253   1.627
  846   1H16  GPI 108          1H16      GPI 108  -7.914  -0.575   2.787
  847   2H16  GPI 108          2H16      GPI 108  -8.731   0.853   3.465
  848    H20  GPI 108           H20      GPI 108 -12.560  -0.412  -0.844
  849    H21  GPI 108           H21      GPI 108 -10.855  -2.203  -0.528
  850    H22  GPI 108           H22      GPI 108  -8.943  -1.834   1.025
  851    H18  GPI 108           H18      GPI 108 -10.430   2.107   1.946
  852   1H12  GPI 108          1H12      GPI 108  -6.909   5.221   1.080
  853   2H12  GPI 108          2H12      GPI 108  -6.913   6.956   1.222
  854   3H12  GPI 108          3H12      GPI 108  -7.668   6.189  -0.162
  855   1H13  GPI 108          1H13      GPI 108  -5.643   4.682  -1.746
  856   2H13  GPI 108          2H13      GPI 108  -6.721   6.066  -2.005
  857   3H13  GPI 108          3H13      GPI 108  -4.970   6.229  -2.319
  858   1H10  GPI 108          1H10      GPI 108  -4.047   7.716  -0.729
  859   2H10  GPI 108          2H10      GPI 108  -4.857   7.982   0.832
  860   1H11  GPI 108          1H11      GPI 108  -6.683   8.001  -1.489
  861   2H11  GPI 108          2H11      GPI 108  -6.593   9.093  -0.135
  862   3H11  GPI 108          3H11      GPI 108  -5.511   9.299  -1.499
  Start of MODEL    4
    1   1H    GLY   1          1H        GLY   1 -10.185  -5.720 -15.429
    2   2H    GLY   1          2H        GLY   1  -9.174  -4.435 -15.867
    3   3H    GLY   1          3H        GLY   1  -9.873  -4.486 -14.314
    4   1HA   GLY   1          1HA       GLY   1  -8.595  -6.396 -13.737
    5   2HA   GLY   1          2HA       GLY   1  -7.913  -6.427 -15.370
    6    H    VAL   2           H        VAL   2  -5.835  -6.109 -14.257
    7    HA   VAL   2           HA       VAL   2  -5.182  -3.271 -13.801
    8    HB   VAL   2           HB       VAL   2  -5.014  -4.370 -11.645
    9   1HG1  VAL   2          1HG1      VAL   2  -5.039  -6.651 -11.976
   10   2HG1  VAL   2          2HG1      VAL   2  -3.355  -6.388 -11.517
   11   3HG1  VAL   2          3HG1      VAL   2  -3.786  -6.591 -13.216
   12   1HG2  VAL   2          1HG2      VAL   2  -2.739  -3.984 -11.113
   13   2HG2  VAL   2          2HG2      VAL   2  -2.993  -2.998 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.185  -4.560 -12.685
   15    H    GLN   3           H        GLN   3  -3.402  -2.742 -15.041
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.697 -16.956
   17   1HB   GLN   3          2HB       GLN   3  -3.650  -3.062 -17.957
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.783 -16.984
   19   1HG   GLN   3          2HG       GLN   3  -0.839  -2.075 -18.217
   20   2HG   GLN   3          1HG       GLN   3  -1.636  -3.298 -19.224
   21   1HE2  GLN   3          1HE2      GLN   3  -0.896  -0.070 -19.217
   22   2HE2  GLN   3          2HE2      GLN   3  -2.173   0.476 -20.243
   23    H    VAL   4           H        VAL   4   0.028  -4.829 -16.596
   24    HA   VAL   4           HA       VAL   4   1.233  -3.084 -14.552
   25    HB   VAL   4           HB       VAL   4   1.946  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.454  -5.606 -13.275
   27   2HG1  VAL   4          2HG1      VAL   4   3.338  -3.909 -13.739
   28   3HG1  VAL   4          3HG1      VAL   4   4.019  -5.084 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.753 -13.786
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.128 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.451  -5.692 -12.606
   32    H    GLU   5           H        GLU   5   2.589  -1.533 -15.721
   33    HA   GLU   5           HA       GLU   5   3.859  -2.504 -18.203
   34   1HB   GLU   5          2HB       GLU   5   3.407   0.408 -17.570
   35   2HB   GLU   5          1HB       GLU   5   3.765  -0.336 -19.134
   36   1HG   GLU   5          2HG       GLU   5   1.576  -0.578 -19.581
   37   2HG   GLU   5          1HG       GLU   5   1.315  -1.439 -18.055
   38    H    THR   6           H        THR   6   6.171  -2.559 -17.862
   39    HA   THR   6           HA       THR   6   7.248  -1.667 -15.326
   40    HB   THR   6           HB       THR   6   8.547  -2.885 -17.814
   41    HG1  THR   6           HG1      THR   6   7.714  -4.258 -15.467
   42   1HG2  THR   6          1HG2      THR   6  10.110  -3.769 -15.964
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.270 -15.172
   44   3HG2  THR   6          3HG2      THR   6  10.363  -2.222 -16.773
   45    H    ILE   7           H        ILE   7   8.484  -0.099 -14.755
   46    HA   ILE   7           HA       ILE   7   9.324   1.985 -16.650
   47    HB   ILE   7           HB       ILE   7   9.174   1.956 -13.593
   48   1HG1  ILE   7          2HG1      ILE   7   7.572   3.425 -15.705
   49   2HG1  ILE   7          1HG1      ILE   7   7.036   1.948 -14.883
   50   1HG2  ILE   7          1HG2      ILE   7  10.901   3.494 -13.978
   51   2HG2  ILE   7          2HG2      ILE   7   9.451   4.491 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.147   4.116 -15.448
   53   1HD1  ILE   7          1HD1      ILE   7   6.104   4.220 -14.095
   54   2HD1  ILE   7          2HD1      ILE   7   7.675   4.427 -13.317
   55   3HD1  ILE   7          3HD1      ILE   7   6.645   3.063 -12.878
   56    H    SER   8           H        SER   8  10.603  -0.023 -13.869
   57    HA   SER   8           HA       SER   8  13.149  -0.214 -15.311
   58   1HB   SER   8          2HB       SER   8  12.964   0.239 -12.319
   59   2HB   SER   8          1HB       SER   8  14.444   0.043 -13.266
   60    HG   SER   8           HG       SER   8  13.495   1.891 -14.557
   61    HA   PRO   9           HA       PRO   9  12.196  -4.487 -14.335
   62   1HB   PRO   9          2HB       PRO   9  15.068  -4.994 -14.686
   63   2HB   PRO   9          1HB       PRO   9  13.701  -5.633 -15.585
   64   1HG   PRO   9          2HG       PRO   9  15.267  -3.814 -16.725
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.706 -16.935
   66   1HD   PRO   9          1HD       PRO   9  15.270  -2.168 -14.990
   67   2HD   PRO   9          2HD       PRO   9  14.047  -1.540 -16.073
   68    H    GLY  10           H        GLY  10  12.403  -6.055 -12.856
   69   1HA   GLY  10          2HA       GLY  10  13.701  -5.350 -10.325
   70   2HA   GLY  10          1HA       GLY  10  12.397  -6.526 -10.542
   71    H    ASP  11           H        ASP  11  13.969  -8.174  -9.354
   72    HA   ASP  11           HA       ASP  11  16.403  -8.727 -10.874
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.365  -9.171
   74   2HB   ASP  11          1HB       ASP  11  16.352  -8.884  -8.380
   75    H    GLY  12           H        GLY  12  13.237  -9.675 -11.217
   76   1HA   GLY  12          2HA       GLY  12  12.272 -11.204 -12.648
   77   2HA   GLY  12          1HA       GLY  12  13.900 -11.645 -13.185
   78    H    ARG  13           H        ARG  13  13.568 -12.073  -9.752
   79    HA   ARG  13           HA       ARG  13  12.730 -14.857 -10.202
   80   1HB   ARG  13          2HB       ARG  13  15.050 -14.301  -8.384
   81   2HB   ARG  13          1HB       ARG  13  14.617 -15.800  -9.217
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.963 -11.269
   83   2HG   ARG  13          1HG       ARG  13  15.850 -13.396 -10.515
   84   1HD   ARG  13          2HD       ARG  13  17.937 -14.356 -10.544
   85   2HD   ARG  13          1HD       ARG  13  17.369 -14.839  -8.939
   86    HE   ARG  13           HE       ARG  13  16.907 -17.033  -9.826
   87   1HH1  ARG  13          1HH1      ARG  13  18.198 -15.234 -12.843
   88   2HH1  ARG  13          2HH1      ARG  13  19.703 -15.786 -12.189
   89   1HH2  ARG  13          1HH2      ARG  13  17.672 -18.714 -11.201
   90   2HH2  ARG  13          2HH2      ARG  13  18.636 -18.328 -12.590
   91    H    THR  14           H        THR  14  12.902 -12.177  -7.904
   92    HA   THR  14           HA       THR  14  11.726 -13.893  -5.805
   93    HB   THR  14           HB       THR  14  12.786 -11.054  -5.376
   94    HG1  THR  14           HG1      THR  14  14.552 -12.027  -6.113
   95   1HG2  THR  14          1HG2      THR  14  12.296 -13.321  -3.518
   96   2HG2  THR  14          2HG2      THR  14  11.881 -11.615  -3.352
   97   3HG2  THR  14          3HG2      THR  14  13.559 -12.136  -3.191
   98    H    PHE  15           H        PHE  15   9.637 -13.947  -6.443
   99    HA   PHE  15           HA       PHE  15   8.161 -11.405  -6.742
  100   1HB   PHE  15          2HB       PHE  15   7.407 -14.236  -7.451
  101   2HB   PHE  15          1HB       PHE  15   6.391 -12.807  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.945 -11.193  -9.434
  103    HD2  PHE  15           HD2      PHE  15   9.294 -14.723  -8.926
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.858 -11.647
  105    HE2  PHE  15           HE2      PHE  15  10.270 -14.359 -11.157
  106    HZ   PHE  15           HZ       PHE  15   9.598 -12.445 -12.505
  107    HA   PRO  16           HA       PRO  16   6.581 -11.998  -2.681
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.530  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.842  -9.829  -2.629
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.092  -5.200
  111   2HG   PRO  16          1HG       PRO  16   5.229  -8.736  -4.652
  112   1HD   PRO  16          1HD       PRO  16   6.217 -10.465  -6.439
  113   2HD   PRO  16          2HD       PRO  16   7.246  -9.796  -5.189
  114    H    LYS  17           H        LYS  17   5.299 -13.160  -1.504
  115    HA   LYS  17           HA       LYS  17   3.409 -14.926  -2.910
  116   1HB   LYS  17          2HB       LYS  17   5.301 -15.564  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.166 -16.703  -1.348
  118   1HG   LYS  17          2HG       LYS  17   6.216 -15.321  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.666 -16.743  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.454 -18.131  -3.361
  121   2HD   LYS  17          1HD       LYS  17   4.100 -16.993  -3.456
  122   1HE   LYS  17          2HE       LYS  17   6.459 -16.407  -5.140
  123   2HE   LYS  17          1HE       LYS  17   5.469 -17.804  -5.593
  124   1HZ   LYS  17          1HZ       LYS  17   4.771 -15.767  -6.651
  125   2HZ   LYS  17          2HZ       LYS  17   4.466 -15.075  -5.138
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.424  -5.664
  127    H    ARG  18           H        ARG  18   1.602 -15.579  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.732   0.104
  129   1HB   ARG  18          2HB       ARG  18  -0.556 -15.877  -0.970
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.688   0.494
  131   1HG   ARG  18          2HG       ARG  18  -1.227 -14.882   1.779
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.488   0.238
  133   1HD   ARG  18          2HD       ARG  18  -3.315 -15.946   1.818
  134   2HD   ARG  18          1HD       ARG  18  -3.129 -16.548   0.165
  135    HE   ARG  18           HE       ARG  18  -1.064 -17.633   1.569
  136   1HH1  ARG  18          2HH1      ARG  18  -4.657 -18.505   1.492
  137   2HH1  ARG  18          1HH1      ARG  18  -4.458 -18.842   3.179
  138   1HH2  ARG  18          2HH2      ARG  18  -1.542 -19.660   3.427
  139   2HH2  ARG  18          1HH2      ARG  18  -1.805 -20.427   1.896
  140    H    GLY  19           H        GLY  19   0.549 -13.147   2.149
  141   1HA   GLY  19          2HA       GLY  19   0.935 -13.449   4.429
  142   2HA   GLY  19          1HA       GLY  19   1.904 -14.879   4.044
  143    H    GLN  20           H        GLN  20   3.266 -12.976   1.913
  144    HA   GLN  20           HA       GLN  20   5.253 -11.989   3.784
  145   1HB   GLN  20          2HB       GLN  20   5.101 -11.879   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.431 -11.203   1.722
  147   1HG   GLN  20          2HG       GLN  20   6.843 -13.492   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.123   1.570
  149   1HE2  GLN  20          1HE2      GLN  20   8.885 -13.778   1.915
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.642   0.258
  151    H    THR  21           H        THR  21   5.899  -9.935   4.063
  152    HA   THR  21           HA       THR  21   3.948  -7.848   3.443
  153    HB   THR  21           HB       THR  21   6.487  -7.829   5.134
  154    HG1  THR  21           HG1      THR  21   5.082  -8.526   6.606
  155   1HG2  THR  21          1HG2      THR  21   4.528  -5.600   4.683
  156   2HG2  THR  21          2HG2      THR  21   6.269  -5.594   4.396
  157   3HG2  THR  21          3HG2      THR  21   5.647  -5.683   6.044
  158    H    CYS  22           H        CYS  22   4.053  -6.679   1.689
  159    HA   CYS  22           HA       CYS  22   6.558  -6.385   0.226
  160   1HB   CYS  22          2HB       CYS  22   3.813  -5.362  -0.486
  161   2HB   CYS  22          1HB       CYS  22   5.234  -5.434  -1.545
  162    HG   CYS  22           HG       CYS  22   4.729  -7.766  -2.075
  163    H    VAL  23           H        VAL  23   7.678  -4.550   0.160
  164    HA   VAL  23           HA       VAL  23   6.771  -2.298   1.837
  165    HB   VAL  23           HB       VAL  23   9.633  -3.182   1.169
  166   1HG1  VAL  23          1HG1      VAL  23   8.492  -0.920   2.758
  167   2HG1  VAL  23          2HG1      VAL  23   9.898  -0.948   1.694
  168   3HG1  VAL  23          3HG1      VAL  23   9.996  -1.663   3.302
  169   1HG2  VAL  23          1HG2      VAL  23   7.797  -3.856   3.414
  170   2HG2  VAL  23          2HG2      VAL  23   9.509  -3.641   3.773
  171   3HG2  VAL  23          3HG2      VAL  23   9.001  -4.855   2.599
  172    H    VAL  24           H        VAL  24   6.137  -0.647   0.303
  173    HA   VAL  24           HA       VAL  24   7.580  -0.657  -2.263
  174    HB   VAL  24           HB       VAL  24   5.483  -0.200  -3.509
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.631  -1.779
  176   2HG1  VAL  24          2HG1      VAL  24   6.177  -2.584  -3.106
  177   3HG1  VAL  24          3HG1      VAL  24   4.459  -2.364  -3.429
  178   1HG2  VAL  24          1HG2      VAL  24   3.269  -0.454  -2.326
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.957  -1.798
  180   3HG2  VAL  24          3HG2      VAL  24   4.141  -0.491  -0.793
  181    H    HIS  25           H        HIS  25   7.789   1.374  -3.359
  182    HA   HIS  25           HA       HIS  25   6.699   3.596  -1.768
  183   1HB   HIS  25          2HB       HIS  25   9.116   3.369  -3.379
  184   2HB   HIS  25          1HB       HIS  25   8.118   4.724  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.081   5.443  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.970   4.836  -2.107
  187    HE1  HIS  25           HE1      HIS  25   8.512   6.539   0.827
  188    HE2  HIS  25           HE2      HIS  25  10.843   6.126   0.050
  189    H    TYR  26           H        TYR  26   5.065   5.001  -2.883
  190    HA   TYR  26           HA       TYR  26   4.445   4.246  -5.634
  191   1HB   TYR  26          2HB       TYR  26   2.139   3.706  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.742  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.748   5.510  -4.440
  194    HD2  TYR  26           HD2      TYR  26   2.893   3.060  -1.678
  195    HE1  TYR  26           HE1      TYR  26  -0.613   6.407  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.550   3.981   0.196
  197    HH   TYR  26           HH       TYR  26  -0.128   6.682   0.102
  198    H    THR  27           H        THR  27   3.221   5.734  -6.795
  199    HA   THR  27           HA       THR  27   2.334   8.163  -5.406
  200    HB   THR  27           HB       THR  27   3.482   8.077  -8.194
  201    HG1  THR  27           HG1      THR  27   4.356   8.925  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.782  -8.528
  203   2HG2  THR  27          2HG2      THR  27   3.187  10.687  -7.507
  204   3HG2  THR  27          3HG2      THR  27   1.738   9.972  -6.805
  205    H    GLY  28           H        GLY  28   0.073   8.084  -5.749
  206   1HA   GLY  28          2HA       GLY  28  -1.088   6.460  -7.921
  207   2HA   GLY  28          1HA       GLY  28  -1.923   6.972  -6.445
  208    H    MET  29           H        MET  29  -2.116   7.366  -9.513
  209    HA   MET  29           HA       MET  29  -2.905  10.191  -9.488
  210   1HB   MET  29          2HB       MET  29  -1.480   8.726 -11.720
  211   2HB   MET  29          1HB       MET  29  -2.185  10.343 -11.857
  212   1HG   MET  29          2HG       MET  29  -0.600  11.288 -10.509
  213   2HG   MET  29          1HG       MET  29  -0.179   9.743  -9.751
  214   1HE   MET  29          1HE       MET  29   0.793   8.008 -10.620
  215   2HE   MET  29          2HE       MET  29   2.360   8.218 -11.404
  216   3HE   MET  29          3HE       MET  29   0.961   7.704 -12.348
  217    H    LEU  30           H        LEU  30  -4.549  10.704 -10.718
  218    HA   LEU  30           HA       LEU  30  -6.563   8.804 -11.485
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.614 -10.972
  220   2HB   LEU  30          1HB       LEU  30  -7.161  11.340 -12.384
  221    HG   LEU  30           HG       LEU  30  -8.959  10.998 -11.160
  222   1HD1  LEU  30          1HD1      LEU  30  -8.541   8.872 -10.285
  223   2HD1  LEU  30          2HD1      LEU  30  -8.873   9.873  -8.871
  224   3HD1  LEU  30          3HD1      LEU  30  -7.211   9.451  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.616  12.083  -8.842
  226   2HD2  LEU  30          2HD2      LEU  30  -8.463  13.012 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.019  12.445  -9.495
  228    H    GLU  31           H        GLU  31  -7.370   8.958 -13.977
  229    HA   GLU  31           HA       GLU  31  -5.216   8.503 -15.715
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.085 -16.064
  231   2HB   GLU  31          1HB       GLU  31  -7.057   8.987 -17.473
  232   1HG   GLU  31          2HG       GLU  31  -6.309   6.759 -16.614
  233   2HG   GLU  31          1HG       GLU  31  -7.628   6.865 -15.435
  234    H    ASP  32           H        ASP  32  -6.495  11.595 -14.898
  235    HA   ASP  32           HA       ASP  32  -5.306  12.763 -17.294
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.857 -16.413
  237   2HB   ASP  32          1HB       ASP  32  -7.439  13.611 -16.364
  238    H    GLY  33           H        GLY  33  -3.817  11.614 -14.623
  239   1HA   GLY  33          2HA       GLY  33  -1.527  11.886 -14.229
  240   2HA   GLY  33          1HA       GLY  33  -1.619  13.507 -14.936
  241    H    LYS  34           H        LYS  34  -4.145  13.639 -12.941
  242    HA   LYS  34           HA       LYS  34  -2.769  15.196 -11.018
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.190 -11.900
  244   2HB   LYS  34          1HB       LYS  34  -5.505  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.975  16.471  -9.966
  246   2HG   LYS  34          1HG       LYS  34  -5.697  16.690 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.722  14.717  -8.286
  248   2HD   LYS  34          1HD       LYS  34  -5.073  16.407  -7.891
  249   1HE   LYS  34          2HE       LYS  34  -7.007  14.532  -9.255
  250   2HE   LYS  34          1HE       LYS  34  -7.005  14.871  -7.517
  251   1HZ   LYS  34          1HZ       LYS  34  -8.074  16.371  -9.645
  252   2HZ   LYS  34          2HZ       LYS  34  -6.990  17.299  -8.737
  253   3HZ   LYS  34          3HZ       LYS  34  -8.313  16.535  -7.978
  254    H    LYS  35           H        LYS  35  -1.723  14.606  -9.322
  255    HA   LYS  35           HA       LYS  35  -1.546  11.908  -8.413
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.566  -8.492
  257   2HB   LYS  35          1HB       LYS  35  -0.489  14.442  -7.182
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.540  -5.702
  259   2HG   LYS  35          1HG       LYS  35   0.771  11.725  -7.014
  260   1HD   LYS  35          2HD       LYS  35   2.378  12.751  -5.539
  261   2HD   LYS  35          1HD       LYS  35   2.364  13.635  -7.074
  262   1HE   LYS  35          2HE       LYS  35   0.923  15.362  -6.033
  263   2HE   LYS  35          1HE       LYS  35   1.033  14.496  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.282  14.953  -4.340
  265   2HZ   LYS  35          2HZ       LYS  35   2.542  16.414  -4.770
  266   3HZ   LYS  35          3HZ       LYS  35   3.381  15.499  -5.938
  267    H    PHE  36           H        PHE  36  -2.815  11.064  -6.759
  268    HA   PHE  36           HA       PHE  36  -4.245  13.050  -5.101
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.140  -4.494
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.610  -6.201
  271    HD1  PHE  36           HD1      PHE  36  -4.653   8.995  -3.835
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.542   6.622  -4.509
  274    HE2  PHE  36           HE2      PHE  36  -5.279   7.712  -8.565
  275    HZ   PHE  36           HZ       PHE  36  -4.859   5.985  -6.865
  276    H    ASP  37           H        ASP  37  -1.761  10.658  -4.991
  277    HA   ASP  37           HA       ASP  37  -1.055  11.468  -2.360
  278   1HB   ASP  37          2HB       ASP  37  -2.943   9.814  -1.834
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.555  -2.454
  280    H    SER  38           H        SER  38   0.978  10.467  -1.659
  281    HA   SER  38           HA       SER  38   2.321   8.515  -3.298
  282   1HB   SER  38          2HB       SER  38   2.765  10.582  -4.605
  283   2HB   SER  38          1HB       SER  38   3.450  11.334  -3.158
  284    HG   SER  38           HG       SER  38   5.033  10.354  -4.566
  285    H    SER  39           H        SER  39   3.581   7.304  -1.913
  286    HA   SER  39           HA       SER  39   4.091   8.271   0.753
  287   1HB   SER  39          2HB       SER  39   5.451   6.189   0.992
  288   2HB   SER  39          1HB       SER  39   3.791   5.894   0.458
  289    HG   SER  39           HG       SER  39   4.881   4.729  -0.965
  290    H    ARG  40           H        ARG  40   5.672   8.413  -2.311
  291    HA   ARG  40           HA       ARG  40   8.347   8.699  -1.495
  292   1HB   ARG  40          2HB       ARG  40   6.896   9.775  -3.938
  293   2HB   ARG  40          1HB       ARG  40   8.646   9.873  -3.706
  294   1HG   ARG  40          2HG       ARG  40   8.669   7.373  -3.553
  295   2HG   ARG  40          1HG       ARG  40   6.968   7.398  -4.047
  296   1HD   ARG  40          2HD       ARG  40   7.654   8.458  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.346   8.286  -5.687
  298    HE   ARG  40           HE       ARG  40   9.210   5.986  -6.101
  299   1HH1  ARG  40          1HH1      ARG  40   5.580   6.786  -6.203
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.968  -7.893
  301   1HH2  ARG  40          1HH2      ARG  40   7.872   3.981  -6.856
  302   2HH2  ARG  40          2HH2      ARG  40   6.915   4.487  -8.209
  303    H    ASP  41           H        ASP  41   5.606  11.042  -1.764
  304    HA   ASP  41           HA       ASP  41   7.157  13.334  -1.091
  305   1HB   ASP  41          2HB       ASP  41   4.187  12.793  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.959  14.377  -0.522
  307    H    ARG  42           H        ARG  42   5.682  10.787   0.920
  308    HA   ARG  42           HA       ARG  42   6.300  12.310   3.320
  309   1HB   ARG  42          2HB       ARG  42   5.438   9.438   3.145
  310   2HB   ARG  42          1HB       ARG  42   5.371  10.508   4.551
  311   1HG   ARG  42          2HG       ARG  42   3.751  11.917   3.343
  312   2HG   ARG  42          1HG       ARG  42   3.758  10.733   2.026
  313   1HD   ARG  42          2HD       ARG  42   3.174  10.027   4.871
  314   2HD   ARG  42          1HD       ARG  42   1.919  10.547   3.736
  315    HE   ARG  42           HE       ARG  42   3.115   7.957   3.944
  316   1HH1  ARG  42          1HH1      ARG  42   0.344   9.704   2.079
  317   2HH1  ARG  42          2HH1      ARG  42   1.577   9.539   0.875
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.328   2.838
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.788   1.326
  320    H    ASN  43           H        ASN  43   7.997  10.295   1.242
  321    HA   ASN  43           HA       ASN  43   9.990   9.199   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.557  11.533   2.022
  323   2HB   ASN  43          1HB       ASN  43  10.442  10.969   3.696
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.103   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.589   9.743   1.391
  326    H    LYS  44           H        LYS  44   7.798   7.927   2.742
  327    HA   LYS  44           HA       LYS  44   9.468   6.181   4.410
  328   1HB   LYS  44          2HB       LYS  44   8.223   7.817   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.710   7.205   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.014   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.598   6.830
  332   1HD   LYS  44          2HD       LYS  44   7.582   7.121   8.279
  333   2HD   LYS  44          1HD       LYS  44   6.034   6.934   7.436
  334   1HE   LYS  44          2HE       LYS  44   7.385   4.697   8.961
  335   2HE   LYS  44          1HE       LYS  44   6.178   5.778   9.676
  336   1HZ   LYS  44          1HZ       LYS  44   5.866   3.723   7.644
  337   2HZ   LYS  44          2HZ       LYS  44   4.809   5.044   7.655
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.033   9.022
  339    HA   PRO  45           HA       PRO  45   7.453   3.619   1.208
  340   1HB   PRO  45          2HB       PRO  45   8.336   1.316   2.814
  341   2HB   PRO  45          1HB       PRO  45   8.652   1.689   1.128
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.990   2.946
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.160   1.649
  344   1HD   PRO  45          1HD       PRO  45   9.468   3.382   4.523
  345   2HD   PRO  45          2HD       PRO  45  10.321   4.577   3.571
  346    H    PHE  46           H        PHE  46   5.602   2.323   1.036
  347    HA   PHE  46           HA       PHE  46   3.982   2.332   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.005   3.313   1.483
  349   2HB   PHE  46          1HB       PHE  46   3.340   1.839   0.559
  350    HD1  PHE  46           HD1      PHE  46   1.392   3.118   3.441
  351    HD2  PHE  46           HD2      PHE  46   1.765   0.211   0.358
  352    HE1  PHE  46           HE1      PHE  46  -0.840   2.248   3.983
  353    HE2  PHE  46           HE2      PHE  46  -0.461  -0.654   0.917
  354    HZ   PHE  46           HZ       PHE  46  -1.778   0.358   2.731
  355    H    LYS  47           H        LYS  47   3.424   0.256   4.455
  356    HA   LYS  47           HA       LYS  47   4.541  -2.088   3.051
  357   1HB   LYS  47          2HB       LYS  47   3.966  -1.642   5.984
  358   2HB   LYS  47          1HB       LYS  47   4.454  -3.194   5.293
  359   1HG   LYS  47          2HG       LYS  47   6.484  -2.130   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.002  -0.632   5.254
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.684   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.492  -3.262   6.666
  363   1HE   LYS  47          2HE       LYS  47   8.467  -2.421   5.552
  364   2HE   LYS  47          1HE       LYS  47   8.131  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.000   8.399
  366   2HZ   LYS  47          2HZ       LYS  47   9.621  -1.386   7.635
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.046   7.526
  368    H    PHE  48           H        PHE  48   3.031  -3.771   2.431
  369    HA   PHE  48           HA       PHE  48   0.643  -3.987   4.111
  370   1HB   PHE  48          2HB       PHE  48  -0.872  -4.237   2.306
  371   2HB   PHE  48          1HB       PHE  48   0.051  -2.759   1.981
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.773   0.222
  373    HD2  PHE  48           HD2      PHE  48  -0.909  -6.024   0.771
  374    HE1  PHE  48           HE1      PHE  48   2.259  -3.559  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.438  -6.811  -1.534
  376    HZ   PHE  48           HZ       PHE  48   1.146  -5.556  -2.944
  377    H    MET  49           H        MET  49  -0.030  -6.290   4.274
  378    HA   MET  49           HA       MET  49   1.872  -8.239   3.221
  379   1HB   MET  49          2HB       MET  49   1.322  -8.654   5.477
  380   2HB   MET  49          1HB       MET  49  -0.401  -8.377   5.188
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.503   4.182
  382   2HG   MET  49          1HG       MET  49   1.092 -10.766   4.148
  383   1HE   MET  49          1HE       MET  49   1.596 -10.935   8.133
  384   2HE   MET  49          2HE       MET  49   1.277  -9.410   7.306
  385   3HE   MET  49          3HE       MET  49   2.404 -10.574   6.607
  386    H    LEU  50           H        LEU  50   1.556  -9.322   1.511
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.100  -0.213
  388   1HB   LEU  50          2HB       LEU  50   1.837 -10.577  -0.103
  389   2HB   LEU  50          1HB       LEU  50   0.514 -11.617  -0.635
  390    HG   LEU  50           HG       LEU  50   1.997  -9.556  -2.080
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.295  -2.466
  392   2HD1  LEU  50          2HD1      LEU  50   2.462 -11.927  -2.292
  393   3HD1  LEU  50          3HD1      LEU  50   1.597 -11.431  -3.748
  394   1HD2  LEU  50          1HD2      LEU  50   0.265  -9.495  -3.780
  395   2HD2  LEU  50          2HD2      LEU  50  -0.223  -8.668  -2.300
  396   3HD2  LEU  50          3HD2      LEU  50  -0.850 -10.277  -2.661
  397    H    GLY  51           H        GLY  51  -2.500 -10.136  -0.243
  398   1HA   GLY  51          2HA       GLY  51  -3.966 -11.915  -0.223
  399   2HA   GLY  51          1HA       GLY  51  -2.816 -12.828   0.766
  400    H    LYS  52           H        LYS  52  -3.038  -9.957   2.331
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.122   4.259
  402   1HB   LYS  52          2HB       LYS  52  -2.633  -9.864   4.489
  403   2HB   LYS  52          1HB       LYS  52  -3.669  -8.436   4.366
  404   1HG   LYS  52          2HG       LYS  52  -4.947  -9.342   6.363
  405   2HG   LYS  52          1HG       LYS  52  -3.627 -10.506   6.555
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.610   6.084
  407   2HD   LYS  52          1HD       LYS  52  -3.413  -7.507   6.196
  408   1HE   LYS  52          2HE       LYS  52  -3.789  -8.460   8.459
  409   2HE   LYS  52          1HE       LYS  52  -2.180  -9.180   8.301
  410   1HZ   LYS  52          1HZ       LYS  52  -2.521  -6.809   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.380   7.620
  412   3HZ   LYS  52          3HZ       LYS  52  -1.188  -7.186   8.286
  413    H    GLN  53           H        GLN  53  -5.464  -9.221   1.592
  414    HA   GLN  53           HA       GLN  53  -7.282  -8.072   0.876
  415   1HB   GLN  53          2HB       GLN  53  -8.464  -9.202   3.402
  416   2HB   GLN  53          1HB       GLN  53  -9.381  -8.293   2.195
  417   1HG   GLN  53          2HG       GLN  53  -9.298  -9.999   0.666
  418   2HG   GLN  53          1HG       GLN  53  -7.926 -10.784   1.470
  419   1HE2  GLN  53          1HE2      GLN  53  -9.751 -12.935   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.730   3.277
  421    H    GLU  54           H        GLU  54  -5.348  -6.569   2.308
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.585   3.518
  423   1HB   GLU  54          2HB       GLU  54  -5.238  -3.759   4.724
  424   2HB   GLU  54          1HB       GLU  54  -5.554  -5.464   5.078
  425   1HG   GLU  54          2HG       GLU  54  -3.732  -6.107   3.601
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.399   3.248
  427    H    VAL  55           H        VAL  55  -5.458  -5.034   0.730
  428    HA   VAL  55           HA       VAL  55  -5.542  -2.136   0.239
  429    HB   VAL  55           HB       VAL  55  -3.882  -2.657  -1.663
  430   1HG1  VAL  55          1HG1      VAL  55  -3.276  -2.882   1.283
  431   2HG1  VAL  55          2HG1      VAL  55  -3.214  -1.441   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.006  -2.710   0.072
  433   1HG2  VAL  55          1HG2      VAL  55  -3.253  -5.154  -0.162
  434   2HG2  VAL  55          2HG2      VAL  55  -2.604  -4.582  -1.698
  435   3HG2  VAL  55          3HG2      VAL  55  -4.278  -5.126  -1.596
  436    H    ILE  56           H        ILE  56  -5.906  -1.831  -2.310
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.119  -2.877
  438    HB   ILE  56           HB       ILE  56  -8.230  -1.807  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.913  -0.391  -3.803
  440   2HG1  ILE  56          1HG1      ILE  56  -5.702  -1.647  -5.033
  441   1HG2  ILE  56          1HG2      ILE  56  -9.529  -0.598  -3.669
  442   2HG2  ILE  56          2HG2      ILE  56  -8.131   0.475  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.378  -0.755  -2.342
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.249  -6.671
  445   2HD1  ILE  56          2HD1      ILE  56  -5.492   0.605  -5.993
  446   3HD1  ILE  56          3HD1      ILE  56  -7.123   0.997  -5.449
  447    H    ARG  57           H        ARG  57  -8.930  -4.372  -4.686
  448    HA   ARG  57           HA       ARG  57  -7.301  -6.654  -4.956
  449   1HB   ARG  57          2HB       ARG  57  -9.778  -6.631  -5.312
  450   2HB   ARG  57          1HB       ARG  57  -9.544  -5.687  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.333  -7.515  -7.790
  452   2HG   ARG  57          1HG       ARG  57  -8.506  -8.460  -6.301
  453   1HD   ARG  57          2HD       ARG  57 -10.926  -8.588  -6.657
  454   2HD   ARG  57          1HD       ARG  57 -10.766  -7.626  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.771  -8.134
  456   1HH1  ARG  57          1HH1      ARG  57 -12.266  -9.326  -9.730
  457   2HH1  ARG  57          2HH1      ARG  57 -12.630 -10.669  -8.699
  458   1HH2  ARG  57          1HH2      ARG  57  -9.482 -11.967  -9.048
  459   2HH2  ARG  57          2HH2      ARG  57 -10.210 -11.505 -10.549
  460    H    GLY  58           H        GLY  58  -7.318  -3.873  -7.249
  461   1HA   GLY  58          2HA       GLY  58  -5.787  -5.258  -9.177
  462   2HA   GLY  58          1HA       GLY  58  -5.913  -3.499  -9.003
  463    H    TRP  59           H        TRP  59  -4.853  -3.703  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.018  -3.684  -6.666
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.134  -4.344
  466   2HB   TRP  59          1HB       TRP  59  -2.167  -3.716  -3.948
  467    HD1  TRP  59           HD1      TRP  59  -3.605  -1.156  -6.511
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.903  -6.378
  469    HE3  TRP  59           HE3      TRP  59  -0.322  -2.655  -2.813
  470    HZ2  TRP  59           HZ2      TRP  59   0.091   1.799  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.101  -2.154
  472    HH2  TRP  59           HH2      TRP  59   1.658   1.074  -3.214
  473    H    GLU  60           H        GLU  60  -3.997  -5.884  -4.553
  474    HA   GLU  60           HA       GLU  60  -2.181  -7.808  -3.913
  475   1HB   GLU  60          2HB       GLU  60  -4.937  -8.445  -4.978
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.489  -3.961
  477   1HG   GLU  60          2HG       GLU  60  -4.905  -6.876  -2.951
  478   2HG   GLU  60          1HG       GLU  60  -5.969  -8.292  -2.983
  479    H    GLU  61           H        GLU  61  -3.992  -7.515  -6.943
  480    HA   GLU  61           HA       GLU  61  -2.771  -9.828  -8.163
  481   1HB   GLU  61          2HB       GLU  61  -4.419  -7.607  -9.393
  482   2HB   GLU  61          1HB       GLU  61  -4.041  -9.165 -10.139
  483   1HG   GLU  61          2HG       GLU  61  -5.246  -9.498  -7.529
  484   2HG   GLU  61          1HG       GLU  61  -6.275  -8.538  -8.605
  485    H    GLY  62           H        GLY  62  -2.125  -6.341  -8.335
  486   1HA   GLY  62          2HA       GLY  62  -0.507  -6.786 -10.674
  487   2HA   GLY  62          1HA       GLY  62  -0.757  -5.248  -9.833
  488    H    VAL  63           H        VAL  63   0.134  -5.860  -7.306
  489    HA   VAL  63           HA       VAL  63   2.942  -5.684  -7.764
  490    HB   VAL  63           HB       VAL  63   1.301  -5.995  -5.199
  491   1HG1  VAL  63          1HG1      VAL  63   3.647  -6.695  -4.933
  492   2HG1  VAL  63          2HG1      VAL  63   3.349  -5.180  -4.083
  493   3HG1  VAL  63          3HG1      VAL  63   4.187  -5.170  -5.634
  494   1HG2  VAL  63          1HG2      VAL  63   0.932  -3.779  -6.427
  495   2HG2  VAL  63          2HG2      VAL  63   2.678  -3.533  -6.449
  496   3HG2  VAL  63          3HG2      VAL  63   1.808  -3.530  -4.916
  497    H    ALA  64           H        ALA  64   0.822  -8.472  -7.069
  498    HA   ALA  64           HA       ALA  64   2.871 -10.244  -6.295
  499   1HB   ALA  64          1HB       ALA  64   0.456 -10.984  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.405 -10.690  -6.179
  501   3HB   ALA  64          3HB       ALA  64   1.386 -12.007  -6.820
  502    H    GLN  65           H        GLN  65   2.108  -8.871  -9.375
  503    HA   GLN  65           HA       GLN  65   3.585 -10.842 -10.888
  504   1HB   GLN  65          2HB       GLN  65   2.248  -8.222 -11.564
  505   2HB   GLN  65          1HB       GLN  65   3.243  -9.100 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.822 -11.070 -12.540
  507   2HG   GLN  65          1HG       GLN  65   0.885 -10.308 -11.243
  508   1HE2  GLN  65          1HE2      GLN  65  -1.178  -9.486 -12.158
  509   2HE2  GLN  65          2HE2      GLN  65  -0.903  -8.128 -13.191
  510    H    MET  66           H        MET  66   4.752  -8.572  -8.815
  511    HA   MET  66           HA       MET  66   6.776  -7.619 -10.721
  512   1HB   MET  66          2HB       MET  66   5.985  -6.534  -8.024
  513   2HB   MET  66          1HB       MET  66   7.236  -5.863  -9.078
  514   1HG   MET  66          2HG       MET  66   5.598  -5.381 -10.781
  515   2HG   MET  66          1HG       MET  66   4.327  -6.153  -9.815
  516   1HE   MET  66          1HE       MET  66   7.231  -3.850  -8.685
  517   2HE   MET  66          2HE       MET  66   6.481  -2.254  -8.657
  518   3HE   MET  66          3HE       MET  66   6.730  -3.085 -10.192
  519    H    SER  67           H        SER  67   8.935  -7.975 -10.280
  520    HA   SER  67           HA       SER  67   9.648  -9.757  -8.078
  521   1HB   SER  67          2HB       SER  67  11.858  -9.704  -9.290
  522   2HB   SER  67          1HB       SER  67  10.496 -10.434 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.799 -11.555
  524    H    VAL  68           H        VAL  68  11.482  -9.147  -6.637
  525    HA   VAL  68           HA       VAL  68  11.309  -6.545  -5.629
  526    HB   VAL  68           HB       VAL  68  13.513  -8.620  -5.346
  527   1HG1  VAL  68          1HG1      VAL  68  14.188  -7.417  -3.307
  528   2HG1  VAL  68          2HG1      VAL  68  12.990  -6.166  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.360  -6.391  -4.731
  530   1HG2  VAL  68          1HG2      VAL  68  11.725  -9.651  -4.481
  531   2HG2  VAL  68          2HG2      VAL  68  10.883  -8.142  -4.130
  532   3HG2  VAL  68          3HG2      VAL  68  12.173  -8.699  -3.064
  533    H    GLY  69           H        GLY  69  12.137  -4.762  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.884  -3.300  -6.746
  535   2HA   GLY  69          1HA       GLY  69  14.459  -4.530  -7.884
  536    H    GLN  70           H        GLN  70  11.269  -4.687  -8.435
  537    HA   GLN  70           HA       GLN  70  11.690  -3.130 -10.840
  538   1HB   GLN  70          2HB       GLN  70  10.813  -5.488 -10.676
  539   2HB   GLN  70          1HB       GLN  70   9.325  -4.777 -10.036
  540   1HG   GLN  70          2HG       GLN  70   9.149  -3.444 -12.105
  541   2HG   GLN  70          1HG       GLN  70  10.538  -4.345 -12.741
  542   1HE2  GLN  70          2HE2      GLN  70   9.493  -7.238 -12.033
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.873 -11.427
  544    H    ARG  71           H        ARG  71  10.583  -1.586 -11.625
  545    HA   ARG  71           HA       ARG  71   8.697  -0.178  -9.844
  546   1HB   ARG  71          2HB       ARG  71  10.803   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.688   1.054 -11.764
  548   1HG   ARG  71          2HG       ARG  71   8.898   2.569 -11.794
  549   2HG   ARG  71          1HG       ARG  71   8.397   2.160 -10.145
  550   1HD   ARG  71          2HD       ARG  71  10.283   3.311  -9.215
  551   2HD   ARG  71          1HD       ARG  71  10.990   3.554 -10.820
  552    HE   ARG  71           HE       ARG  71   8.425   4.696 -10.780
  553   1HH1  ARG  71          2HH1      ARG  71  11.612   5.179  -9.290
  554   2HH1  ARG  71          1HH1      ARG  71  11.463   6.905  -9.284
  555   1HH2  ARG  71          1HH2      ARG  71   8.121   6.875 -10.463
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.985
  557    H    ALA  72           H        ALA  72   6.801  -0.069 -10.812
  558    HA   ALA  72           HA       ALA  72   6.470  -0.150 -13.715
  559   1HB   ALA  72          1HB       ALA  72   5.012  -2.006 -13.696
  560   2HB   ALA  72          2HB       ALA  72   4.894  -1.997 -11.937
  561   3HB   ALA  72          3HB       ALA  72   6.392  -2.503 -12.717
  562    H    LYS  73           H        LYS  73   4.462   0.425 -14.507
  563    HA   LYS  73           HA       LYS  73   2.807   2.084 -12.736
  564   1HB   LYS  73          2HB       LYS  73   3.832   3.035 -14.745
  565   2HB   LYS  73          1HB       LYS  73   2.997   1.822 -15.723
  566   1HG   LYS  73          2HG       LYS  73   0.828   2.876 -14.911
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.217 -14.335
  568   1HD   LYS  73          2HD       LYS  73   2.966   4.301 -16.496
  569   2HD   LYS  73          1HD       LYS  73   1.972   2.953 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.017   4.448 -16.678
  571   2HE   LYS  73          1HE       LYS  73   1.147   5.770 -16.499
  572   1HZ   LYS  73          1HZ       LYS  73   0.807   4.007 -18.847
  573   2HZ   LYS  73          2HZ       LYS  73   2.038   5.156 -18.682
  574   3HZ   LYS  73          3HZ       LYS  73   0.409   5.648 -18.751
  575    H    LEU  74           H        LEU  74   0.909   1.250 -12.075
  576    HA   LEU  74           HA       LEU  74  -0.135  -1.173 -13.368
  577   1HB   LEU  74          2HB       LEU  74   0.213  -0.093 -10.655
  578   2HB   LEU  74          1HB       LEU  74  -1.340  -0.882 -10.937
  579    HG   LEU  74           HG       LEU  74  -0.401  -3.000 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.990  -3.483 -11.265
  581   2HD1  LEU  74          2HD1      LEU  74   2.323  -1.757 -11.424
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.588 -12.650
  583   1HD2  LEU  74          1HD2      LEU  74  -0.467  -1.888  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.230  -1.448  -9.035
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.146  -8.938
  586    H    THR  75           H        THR  75  -1.870  -0.573 -14.791
  587    HA   THR  75           HA       THR  75  -3.497   1.772 -14.023
  588    HB   THR  75           HB       THR  75  -3.435   0.122 -16.596
  589    HG1  THR  75           HG1      THR  75  -1.653   1.267 -16.760
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.967 -17.627
  591   2HG2  THR  75          2HG2      THR  75  -4.844   2.694 -16.037
  592   3HG2  THR  75          3HG2      THR  75  -5.575   1.134 -16.413
  593    H    ILE  76           H        ILE  76  -5.455   1.332 -12.988
  594    HA   ILE  76           HA       ILE  76  -6.291  -1.484 -12.781
  595    HB   ILE  76           HB       ILE  76  -6.388   0.674 -10.636
  596   1HG1  ILE  76          2HG1      ILE  76  -4.508  -1.672 -10.946
  597   2HG1  ILE  76          1HG1      ILE  76  -4.084   0.026 -11.221
  598   1HG2  ILE  76          1HG2      ILE  76  -7.209  -2.170 -10.633
  599   2HG2  ILE  76          2HG2      ILE  76  -8.131  -0.727 -10.215
  600   3HG2  ILE  76          3HG2      ILE  76  -6.833  -1.282  -9.156
  601   1HD1  ILE  76          1HD1      ILE  76  -4.414  -1.467  -8.691
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.221  -8.707
  603   3HD1  ILE  76          3HD1      ILE  76  -3.266  -0.199  -9.126
  604    H    SER  77           H        SER  77  -8.340  -1.762 -13.534
  605    HA   SER  77           HA       SER  77 -10.076   0.347 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.733  -1.396 -14.643
  607   2HB   SER  77          1HB       SER  77 -10.164  -1.886 -15.294
  608    HG   SER  77           HG       SER  77 -11.683  -3.015 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.060   1.321 -10.425
  610   1HB   PRO  78          2HB       PRO  78 -14.776   1.357 -11.227
  611   2HB   PRO  78          1HB       PRO  78 -13.688   2.734 -11.184
  612   1HG   PRO  78          2HG       PRO  78 -14.507   1.056 -13.514
  613   2HG   PRO  78          1HG       PRO  78 -14.012   2.740 -13.488
  614   1HD   PRO  78          1HD       PRO  78 -12.359   0.789 -14.398
  615   2HD   PRO  78          2HD       PRO  78 -11.741   2.211 -13.585
  616    H    ASP  79           H        ASP  79 -13.479  -1.462 -12.055
  617    HA   ASP  79           HA       ASP  79 -14.745  -2.335  -9.643
  618   1HB   ASP  79          2HB       ASP  79 -15.147  -4.411 -10.855
  619   2HB   ASP  79          1HB       ASP  79 -15.490  -3.031 -11.910
  620    H    TYR  80           H        TYR  80 -11.546  -2.401 -10.612
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.456  -8.686
  622   1HB   TYR  80          2HB       TYR  80  -9.559  -3.182 -11.070
  623   2HB   TYR  80          1HB       TYR  80  -8.479  -3.757  -9.788
  624    HD1  TYR  80           HD1      TYR  80 -11.503  -4.892 -11.642
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.878
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.200 -12.484
  627    HE2  TYR  80           HE2      TYR  80  -7.919  -8.146 -10.692
  628    HH   TYR  80           HH       TYR  80  -8.976  -9.434 -12.229
  629    H    ALA  81           H        ALA  81 -11.563  -1.442  -8.396
  630    HA   ALA  81           HA       ALA  81  -9.392  -0.751  -6.537
  631   1HB   ALA  81          1HB       ALA  81  -9.043   0.365  -8.764
  632   2HB   ALA  81          2HB       ALA  81  -9.310   1.510  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.616   1.142  -8.573
  634    H    TYR  82           H        TYR  82 -11.706   1.777  -7.022
  635    HA   TYR  82           HA       TYR  82 -13.144   0.958  -4.577
  636   1HB   TYR  82          2HB       TYR  82 -12.503   3.643  -5.852
  637   2HB   TYR  82          1HB       TYR  82 -13.463   3.449  -4.376
  638    HD1  TYR  82           HD1      TYR  82 -12.315   2.134  -2.429
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.940  -5.711
  640    HE1  TYR  82           HE1      TYR  82 -10.207   2.035  -1.125
  641    HE2  TYR  82           HE2      TYR  82  -8.142   3.837  -4.423
  642    HH   TYR  82           HH       TYR  82  -7.555   3.779  -1.856
  643    H    GLY  83           H        GLY  83 -13.805   0.860  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.708   0.432  -8.896
  645   2HA   GLY  83          1HA       GLY  83 -16.440   0.098  -7.320
  646    H    ALA  84           H        ALA  84 -18.269   0.982  -7.434
  647    HA   ALA  84           HA       ALA  84 -18.707   3.583  -8.635
  648   1HB   ALA  84          1HB       ALA  84 -20.324   1.691  -8.791
  649   2HB   ALA  84          2HB       ALA  84 -21.024   3.180  -8.157
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.863  -7.058
  651    H    THR  85           H        THR  85 -18.020   2.427  -5.346
  652    HA   THR  85           HA       THR  85 -19.181   4.739  -4.103
  653    HB   THR  85           HB       THR  85 -16.855   3.115  -3.034
  654    HG1  THR  85           HG1      THR  85 -19.571   2.453  -2.690
  655   1HG2  THR  85          1HG2      THR  85 -19.157   4.616  -1.811
  656   2HG2  THR  85          2HG2      THR  85 -17.432   4.850  -1.532
  657   3HG2  THR  85          3HG2      THR  85 -18.238   3.409  -0.916
  658    H    GLY  86           H        GLY  86 -15.913   4.003  -5.319
  659   1HA   GLY  86          2HA       GLY  86 -14.099   5.462  -5.596
  660   2HA   GLY  86          1HA       GLY  86 -15.215   6.806  -5.306
  661    H    HIS  87           H        HIS  87 -13.165   7.511  -3.886
  662    HA   HIS  87           HA       HIS  87 -13.464   6.201  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.190   6.024  -2.259
  664   2HB   HIS  87          1HB       HIS  87 -11.087   7.793  -2.210
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.797   0.417
  666    HD2  HIS  87           HD2      HIS  87 -10.710   4.670  -0.092
  667    HE1  HIS  87           HE1      HIS  87 -10.104   7.850   2.597
  668    HE2  HIS  87           HE2      HIS  87 -10.001   5.371   2.223
  669    HA   PRO  88           HA       PRO  88 -15.772  10.118  -0.978
  670   1HB   PRO  88          2HB       PRO  88 -15.862  10.505   1.732
  671   2HB   PRO  88          1HB       PRO  88 -16.876   9.332   0.912
  672   1HG   PRO  88          2HG       PRO  88 -14.226   8.864   2.306
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.496
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.988   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.540   6.972   0.309
  676    H    GLY  89           H        GLY  89 -15.167  11.873  -1.573
  677   1HA   GLY  89          2HA       GLY  89 -14.151  13.915  -1.651
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.214
  679    H    ILE  90           H        ILE  90 -12.042  11.022  -1.772
  680    HA   ILE  90           HA       ILE  90  -9.979  12.656  -3.119
  681    HB   ILE  90           HB       ILE  90  -9.842   9.884  -1.827
  682   1HG1  ILE  90          2HG1      ILE  90  -8.445  12.389  -0.968
  683   2HG1  ILE  90          1HG1      ILE  90 -10.098  12.030  -0.441
  684   1HG2  ILE  90          1HG2      ILE  90  -7.309  10.386  -1.932
  685   2HG2  ILE  90          2HG2      ILE  90  -7.712  11.628  -3.117
  686   3HG2  ILE  90          3HG2      ILE  90  -8.066   9.934  -3.459
  687   1HD1  ILE  90          1HD1      ILE  90  -9.336  10.709   1.163
  688   2HD1  ILE  90          2HD1      ILE  90  -7.693  11.180   0.726
  689   3HD1  ILE  90          3HD1      ILE  90  -8.424   9.749  -0.003
  690    H    ILE  91           H        ILE  91 -11.665   9.562  -3.637
  691    HA   ILE  91           HA       ILE  91 -10.635   9.709  -6.402
  692    HB   ILE  91           HB       ILE  91 -11.716   7.252  -4.977
  693   1HG1  ILE  91          2HG1      ILE  91  -9.603   7.976  -3.971
  694   2HG1  ILE  91          1HG1      ILE  91  -9.414   6.461  -4.873
  695   1HG2  ILE  91          1HG2      ILE  91 -10.553   6.112  -6.911
  696   2HG2  ILE  91          2HG2      ILE  91 -10.439   7.708  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.021   7.011  -7.294
  698   1HD1  ILE  91          1HD1      ILE  91  -7.508   7.969  -5.199
  699   2HD1  ILE  91          2HD1      ILE  91  -8.594   9.197  -5.854
  700   3HD1  ILE  91          3HD1      ILE  91  -8.369   7.671  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.251  10.298  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.681   9.827  -9.877
  703   2HB   PRO  92          1HB       PRO  92 -15.345  11.254  -9.101
  704   1HG   PRO  92          2HG       PRO  92 -12.862  11.317 -10.115
  705   2HG   PRO  92          1HG       PRO  92 -13.210  12.132  -8.600
  706   1HD   PRO  92          1HD       PRO  92 -12.060   9.357  -8.999
  707   2HD   PRO  92          2HD       PRO  92 -11.420  10.653  -8.012
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.869
  709   1HB   PRO  93          2HB       PRO  93 -18.920   7.282  -9.560
  710   2HB   PRO  93          1HB       PRO  93 -19.087   6.342  -8.086
  711   1HG   PRO  93          2HG       PRO  93 -19.618   9.036  -8.232
  712   2HG   PRO  93          1HG       PRO  93 -19.150   8.220  -6.750
  713   1HD   PRO  93          1HD       PRO  93 -17.515   9.977  -8.525
  714   2HD   PRO  93          2HD       PRO  93 -17.370   9.713  -6.801
  715    H    HIS  94           H        HIS  94 -16.500   4.744  -9.376
  716    HA   HIS  94           HA       HIS  94 -15.944   3.695 -11.309
  717   1HB   HIS  94          2HB       HIS  94 -17.265   6.169 -12.562
  718   2HB   HIS  94          1HB       HIS  94 -16.933   4.652 -13.416
  719    HD1  HIS  94           HD1      HIS  94 -18.295   2.487 -12.154
  720    HD2  HIS  94           HD2      HIS  94 -19.606   6.360 -11.436
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.311 -11.165
  722    HE2  HIS  94           HE2      HIS  94 -21.352   4.658 -10.759
  723    H    ALA  95           H        ALA  95 -13.895   5.538 -10.142
  724    HA   ALA  95           HA       ALA  95 -12.524   6.636 -12.451
  725   1HB   ALA  95          1HB       ALA  95 -12.630   7.329  -9.872
  726   2HB   ALA  95          2HB       ALA  95 -11.238   7.692 -10.891
  727   3HB   ALA  95          3HB       ALA  95 -11.203   6.293  -9.819
  728    H    THR  96           H        THR  96 -10.925   5.698 -13.745
  729    HA   THR  96           HA       THR  96  -9.716   3.198 -13.009
  730    HB   THR  96           HB       THR  96  -9.159   5.172 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.420   3.812 -16.393
  732   1HG2  THR  96          1HG2      THR  96  -7.731   2.634 -14.646
  733   2HG2  THR  96          2HG2      THR  96  -7.064   4.252 -14.873
  734   3HG2  THR  96          3HG2      THR  96  -7.753   3.381 -16.245
  735    H    LEU  97           H        LEU  97  -7.696   3.076 -11.872
  736    HA   LEU  97           HA       LEU  97  -6.462   5.643 -11.105
  737   1HB   LEU  97          2HB       LEU  97  -6.522   2.946  -9.733
  738   2HB   LEU  97          1HB       LEU  97  -5.731   4.392  -9.102
  739    HG   LEU  97           HG       LEU  97  -8.695   3.976  -9.443
  740   1HD1  LEU  97          1HD1      LEU  97  -8.706   3.956  -7.054
  741   2HD1  LEU  97          2HD1      LEU  97  -6.988   4.351  -6.993
  742   3HD1  LEU  97          3HD1      LEU  97  -7.510   2.781  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.504   6.246  -9.825
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.406  -8.822
  745   3HD2  LEU  97          3HD2      LEU  97  -8.644   6.199  -8.068
  746    H    VAL  98           H        VAL  98  -4.208   5.848 -11.143
  747    HA   VAL  98           HA       VAL  98  -2.849   3.761 -12.691
  748    HB   VAL  98           HB       VAL  98  -2.520   6.782 -12.882
  749   1HG1  VAL  98          1HG1      VAL  98  -1.026   4.460 -14.104
  750   2HG1  VAL  98          2HG1      VAL  98  -0.378   5.705 -13.035
  751   3HG1  VAL  98          3HG1      VAL  98  -0.882   6.123 -14.673
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.908 -15.157
  753   2HG2  VAL  98          2HG2      VAL  98  -3.414   6.654 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.468   5.574 -14.149
  755    H    PHE  99           H        PHE  99  -1.240   2.911 -11.258
  756    HA   PHE  99           HA       PHE  99  -0.233   4.767  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.719   1.816  -9.169
  758   2HB   PHE  99          1HB       PHE  99   0.436   2.563  -8.051
  759    HD1  PHE  99           HD1      PHE  99  -3.098   2.161  -8.947
  760    HD2  PHE  99           HD2      PHE  99  -0.266   3.912  -6.250
  761    HE1  PHE  99           HE1      PHE  99  -4.903   2.661  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.089   4.403  -4.663
  763    HZ   PHE  99           HZ       PHE  99  -4.397   3.778  -5.220
  764    H    ASP 100           H        ASP 100   1.949   5.076  -9.152
  765    HA   ASP 100           HA       ASP 100   3.710   3.599 -10.963
  766   1HB   ASP 100          2HB       ASP 100   3.846   5.986 -11.157
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.149  -9.410
  768    H    VAL 101           H        VAL 101   4.563   1.928  -9.767
  769    HA   VAL 101           HA       VAL 101   4.827   2.053  -6.829
  770    HB   VAL 101           HB       VAL 101   3.653  -0.202  -8.531
  771   1HG1  VAL 101          1HG1      VAL 101   3.150  -1.243  -6.290
  772   2HG1  VAL 101          2HG1      VAL 101   4.248  -0.060  -5.581
  773   3HG1  VAL 101          3HG1      VAL 101   4.852  -1.234  -6.751
  774   1HG2  VAL 101          1HG2      VAL 101   1.643   0.199  -7.113
  775   2HG2  VAL 101          2HG2      VAL 101   2.123   1.753  -7.796
  776   3HG2  VAL 101          3HG2      VAL 101   2.551   1.353  -6.133
  777    H    GLU 102           H        GLU 102   6.714   1.361  -6.030
  778    HA   GLU 102           HA       GLU 102   8.511  -0.106  -7.837
  779   1HB   GLU 102          2HB       GLU 102   9.366   2.099  -7.493
  780   2HB   GLU 102          1HB       GLU 102   9.085   1.987  -5.750
  781   1HG   GLU 102          2HG       GLU 102  10.832   0.480  -5.436
  782   2HG   GLU 102          1HG       GLU 102  10.876   0.034  -7.151
  783    H    LEU 103           H        LEU 103   8.833  -2.173  -7.007
  784    HA   LEU 103           HA       LEU 103   8.027  -2.669  -4.240
  785   1HB   LEU 103          2HB       LEU 103   7.226  -4.249  -5.863
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.466  -6.530
  787    HG   LEU 103           HG       LEU 103   9.547  -5.664  -4.532
  788   1HD1  LEU 103          1HD1      LEU 103   6.783  -4.963  -3.523
  789   2HD1  LEU 103          2HD1      LEU 103   8.336  -4.624  -2.761
  790   3HD1  LEU 103          3HD1      LEU 103   7.733  -6.279  -2.836
  791   1HD2  LEU 103          1HD2      LEU 103   7.981  -7.615  -4.730
  792   2HD2  LEU 103          2HD2      LEU 103   8.589  -7.005  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.951  -6.609  -5.746
  794    H    LEU 104           H        LEU 104   9.457  -2.278  -2.765
  795    HA   LEU 104           HA       LEU 104  12.289  -2.024  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.808  -1.447  -0.821
  797   2HB   LEU 104          1HB       LEU 104  12.477  -0.996  -1.180
  798    HG   LEU 104           HG       LEU 104  10.041   0.191  -2.507
  799   1HD1  LEU 104          1HD1      LEU 104  10.370   0.799  -0.055
  800   2HD1  LEU 104          2HD1      LEU 104  10.327   2.140  -1.200
  801   3HD1  LEU 104          3HD1      LEU 104  11.870   1.578  -0.555
  802   1HD2  LEU 104          1HD2      LEU 104  12.275   0.035  -3.735
  803   2HD2  LEU 104          2HD2      LEU 104  12.923   1.105  -2.492
  804   3HD2  LEU 104          3HD2      LEU 104  11.622   1.662  -3.544
  805    H    LYS 105           H        LYS 105  10.327  -4.008  -1.311
  806    HA   LYS 105           HA       LYS 105  12.566  -5.749  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.825  -3.636   0.612
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.082   1.447
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.014   2.349
  810   2HG   LYS 105          1HG       LYS 105  13.833  -5.708   1.415
  811   1HD   LYS 105          2HD       LYS 105  14.217  -3.641   2.555
  812   2HD   LYS 105          1HD       LYS 105  12.614  -3.695   3.310
  813   1HE   LYS 105          2HE       LYS 105  13.275  -5.923   4.301
  814   2HE   LYS 105          1HE       LYS 105  14.922  -5.603   3.734
  815   1HZ   LYS 105          1HZ       LYS 105  13.454  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.253  -3.309   4.908
  817   3HZ   LYS 105          3HZ       LYS 105  15.123  -4.566   5.660
  818    H    LEU 106           H        LEU 106  11.794  -7.702   0.372
  819    HA   LEU 106           HA       LEU 106   8.922  -7.755   1.009
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.084   0.182
  821   2HB   LEU 106          1HB       LEU 106   8.989 -10.214   0.746
  822    HG   LEU 106           HG       LEU 106   9.870  -8.833  -1.808
  823   1HD1  LEU 106          1HD1      LEU 106   8.416 -11.424  -1.350
  824   2HD1  LEU 106          2HD1      LEU 106  10.120 -11.285  -1.776
  825   3HD1  LEU 106          3HD1      LEU 106   8.882 -10.734  -2.904
  826   1HD2  LEU 106          1HD2      LEU 106   7.567  -8.573  -2.323
  827   2HD2  LEU 106          2HD2      LEU 106   7.754  -7.976  -0.673
  828   3HD2  LEU 106          3HD2      LEU 106   7.073  -9.577  -0.960
  829    H    GLU 107           HN       GLU 107   8.525  -8.269   3.051
  830    HA   GLU 107           HA       GLU 107  10.716  -9.187   4.801
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.228   5.416
  832   2HB   GLU 107          1HB       GLU 107   9.697  -7.831   6.579
  833   1HG   GLU 107          2HG       GLU 107  11.468  -6.821   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.234  -6.152   4.165
  835    H2   GPI 108           H2       GPI 108  -5.061   1.315  -0.722
  836   1H5   GPI 108          1H5       GPI 108  -3.640   3.941  -1.560
  837   2H5   GPI 108          2H5       GPI 108  -2.518   4.190  -0.209
  838   1H3   GPI 108          1H3       GPI 108  -2.925   0.135  -1.056
  839   2H3   GPI 108          2H3       GPI 108  -2.275   0.724   0.484
  840   1H4   GPI 108          1H4       GPI 108  -2.455   2.066  -2.216
  841   2H4   GPI 108          2H4       GPI 108  -1.249   2.376  -0.929
  842   1H14  GPI 108          1H14      GPI 108  -6.927   1.287   0.781
  843   2H14  GPI 108          2H14      GPI 108  -7.705  -0.281   1.093
  844   1H15  GPI 108          1H15      GPI 108  -6.264   1.177   3.325
  845   2H15  GPI 108          2H15      GPI 108  -7.578  -0.018   3.434
  846   1H16  GPI 108          1H16      GPI 108  -8.382   2.308   3.893
  847   2H16  GPI 108          2H16      GPI 108  -7.855   2.794   2.268
  848    H20  GPI 108           H20      GPI 108 -12.925   0.152   0.803
  849    H21  GPI 108           H21      GPI 108 -11.615  -1.285   2.360
  850    H22  GPI 108           H22      GPI 108  -9.468  -0.449   3.307
  851    H18  GPI 108           H18      GPI 108  -9.935   3.252   1.146
  852   1H12  GPI 108          1H12      GPI 108  -7.107   6.347   2.492
  853   2H12  GPI 108          2H12      GPI 108  -7.888   6.096   0.956
  854   3H12  GPI 108          3H12      GPI 108  -7.129   4.748   1.782
  855   1H13  GPI 108          1H13      GPI 108  -5.379   5.104  -1.034
  856   2H13  GPI 108          2H13      GPI 108  -7.015   5.771  -0.869
  857   3H13  GPI 108          3H13      GPI 108  -5.635   6.861  -1.185
  858   1H10  GPI 108          1H10      GPI 108  -4.402   7.787   0.616
  859   2H10  GPI 108          2H10      GPI 108  -5.148   7.661   2.226
  860   1H11  GPI 108          1H11      GPI 108  -7.257   7.976   0.325
  861   2H11  GPI 108          2H11      GPI 108  -6.762   9.087   1.571
  862   3H11  GPI 108          3H11      GPI 108  -6.055   9.194  -0.030
  Start of MODEL    5
    1   1H    GLY   1          1H        GLY   1 -10.185  -5.720 -15.430
    2   2H    GLY   1          2H        GLY   1  -9.175  -4.436 -15.867
    3   3H    GLY   1          3H        GLY   1  -9.874  -4.486 -14.313
    4   1HA   GLY   1          1HA       GLY   1  -8.596  -6.397 -13.736
    5   2HA   GLY   1          2HA       GLY   1  -7.913  -6.426 -15.369
    6    H    VAL   2           H        VAL   2  -5.835  -6.109 -14.257
    7    HA   VAL   2           HA       VAL   2  -5.182  -3.272 -13.801
    8    HB   VAL   2           HB       VAL   2  -5.014  -4.370 -11.644
    9   1HG1  VAL   2          1HG1      VAL   2  -5.038  -6.651 -11.975
   10   2HG1  VAL   2          2HG1      VAL   2  -3.355  -6.388 -11.517
   11   3HG1  VAL   2          3HG1      VAL   2  -3.785  -6.592 -13.215
   12   1HG2  VAL   2          1HG2      VAL   2  -2.739  -3.984 -11.112
   13   2HG2  VAL   2          2HG2      VAL   2  -2.995  -2.998 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.185  -4.561 -12.686
   15    H    GLN   3           H        GLN   3  -3.403  -2.742 -15.042
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.698 -16.956
   17   1HB   GLN   3          2HB       GLN   3  -3.651  -3.061 -17.957
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.782 -16.984
   19   1HG   GLN   3          2HG       GLN   3  -0.839  -2.075 -18.217
   20   2HG   GLN   3          1HG       GLN   3  -1.637  -3.298 -19.223
   21   1HE2  GLN   3          1HE2      GLN   3  -0.895  -0.070 -19.216
   22   2HE2  GLN   3          2HE2      GLN   3  -2.174   0.476 -20.243
   23    H    VAL   4           H        VAL   4   0.028  -4.829 -16.595
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.552
   25    HB   VAL   4           HB       VAL   4   1.946  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.454  -5.606 -13.275
   27   2HG1  VAL   4          2HG1      VAL   4   3.339  -3.908 -13.738
   28   3HG1  VAL   4          3HG1      VAL   4   4.018  -5.085 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.752 -13.786
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.129 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.451  -5.692 -12.608
   32    H    GLU   5           H        GLU   5   2.590  -1.533 -15.720
   33    HA   GLU   5           HA       GLU   5   3.858  -2.504 -18.204
   34   1HB   GLU   5          2HB       GLU   5   3.406   0.408 -17.571
   35   2HB   GLU   5          1HB       GLU   5   3.765  -0.336 -19.133
   36   1HG   GLU   5          2HG       GLU   5   1.576  -0.579 -19.582
   37   2HG   GLU   5          1HG       GLU   5   1.316  -1.438 -18.055
   38    H    THR   6           H        THR   6   6.172  -2.559 -17.862
   39    HA   THR   6           HA       THR   6   7.248  -1.667 -15.326
   40    HB   THR   6           HB       THR   6   8.546  -2.886 -17.813
   41    HG1  THR   6           HG1      THR   6   7.713  -4.258 -15.467
   42   1HG2  THR   6          1HG2      THR   6  10.111  -3.769 -15.963
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.270 -15.171
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.222 -16.773
   45    H    ILE   7           H        ILE   7   8.484  -0.099 -14.755
   46    HA   ILE   7           HA       ILE   7   9.325   1.984 -16.650
   47    HB   ILE   7           HB       ILE   7   9.174   1.955 -13.592
   48   1HG1  ILE   7          2HG1      ILE   7   7.573   3.424 -15.704
   49   2HG1  ILE   7          1HG1      ILE   7   7.036   1.948 -14.883
   50   1HG2  ILE   7          1HG2      ILE   7  10.902   3.493 -13.979
   51   2HG2  ILE   7          2HG2      ILE   7   9.451   4.491 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.148   4.116 -15.447
   53   1HD1  ILE   7          1HD1      ILE   7   6.105   4.220 -14.096
   54   2HD1  ILE   7          2HD1      ILE   7   7.674   4.426 -13.317
   55   3HD1  ILE   7          3HD1      ILE   7   6.644   3.063 -12.878
   56    H    SER   8           H        SER   8  10.603  -0.024 -13.868
   57    HA   SER   8           HA       SER   8  13.150  -0.214 -15.311
   58   1HB   SER   8          2HB       SER   8  12.963   0.240 -12.319
   59   2HB   SER   8          1HB       SER   8  14.444   0.042 -13.266
   60    HG   SER   8           HG       SER   8  13.494   1.892 -14.557
   61    HA   PRO   9           HA       PRO   9  12.196  -4.487 -14.335
   62   1HB   PRO   9          2HB       PRO   9  15.067  -4.994 -14.688
   63   2HB   PRO   9          1HB       PRO   9  13.700  -5.633 -15.585
   64   1HG   PRO   9          2HG       PRO   9  15.267  -3.813 -16.725
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.706 -16.935
   66   1HD   PRO   9          1HD       PRO   9  15.271  -2.167 -14.990
   67   2HD   PRO   9          2HD       PRO   9  14.047  -1.540 -16.073
   68    H    GLY  10           H        GLY  10  12.403  -6.054 -12.857
   69   1HA   GLY  10          2HA       GLY  10  13.702  -5.349 -10.325
   70   2HA   GLY  10          1HA       GLY  10  12.397  -6.526 -10.541
   71    H    ASP  11           H        ASP  11  13.970  -8.174  -9.355
   72    HA   ASP  11           HA       ASP  11  16.403  -8.727 -10.874
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.365  -9.171
   74   2HB   ASP  11          1HB       ASP  11  16.352  -8.884  -8.381
   75    H    GLY  12           H        GLY  12  13.237  -9.675 -11.217
   76   1HA   GLY  12          2HA       GLY  12  12.273 -11.204 -12.648
   77   2HA   GLY  12          1HA       GLY  12  13.900 -11.646 -13.185
   78    H    ARG  13           H        ARG  13  13.568 -12.074  -9.752
   79    HA   ARG  13           HA       ARG  13  12.730 -14.856 -10.202
   80   1HB   ARG  13          2HB       ARG  13  15.050 -14.301  -8.384
   81   2HB   ARG  13          1HB       ARG  13  14.616 -15.800  -9.217
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.962 -11.269
   83   2HG   ARG  13          1HG       ARG  13  15.850 -13.397 -10.514
   84   1HD   ARG  13          2HD       ARG  13  17.938 -14.356 -10.544
   85   2HD   ARG  13          1HD       ARG  13  17.367 -14.839  -8.939
   86    HE   ARG  13           HE       ARG  13  16.907 -17.033  -9.825
   87   1HH1  ARG  13          1HH1      ARG  13  18.198 -15.233 -12.844
   88   2HH1  ARG  13          2HH1      ARG  13  19.703 -15.785 -12.190
   89   1HH2  ARG  13          1HH2      ARG  13  17.672 -18.713 -11.202
   90   2HH2  ARG  13          2HH2      ARG  13  18.635 -18.328 -12.589
   91    H    THR  14           H        THR  14  12.902 -12.177  -7.903
   92    HA   THR  14           HA       THR  14  11.726 -13.894  -5.804
   93    HB   THR  14           HB       THR  14  12.787 -11.053  -5.377
   94    HG1  THR  14           HG1      THR  14  14.553 -12.026  -6.113
   95   1HG2  THR  14          1HG2      THR  14  12.295 -13.321  -3.519
   96   2HG2  THR  14          2HG2      THR  14  11.883 -11.615  -3.352
   97   3HG2  THR  14          3HG2      THR  14  13.559 -12.136  -3.191
   98    H    PHE  15           H        PHE  15   9.637 -13.947  -6.444
   99    HA   PHE  15           HA       PHE  15   8.161 -11.405  -6.742
  100   1HB   PHE  15          2HB       PHE  15   7.407 -14.235  -7.451
  101   2HB   PHE  15          1HB       PHE  15   6.391 -12.807  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.944 -11.192  -9.435
  103    HD2  PHE  15           HD2      PHE  15   9.293 -14.723  -8.927
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.858 -11.648
  105    HE2  PHE  15           HE2      PHE  15  10.269 -14.359 -11.157
  106    HZ   PHE  15           HZ       PHE  15   9.598 -12.444 -12.504
  107    HA   PRO  16           HA       PRO  16   6.582 -11.999  -2.682
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.530  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.841  -9.830  -2.630
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.092  -5.201
  111   2HG   PRO  16          1HG       PRO  16   5.228  -8.737  -4.652
  112   1HD   PRO  16          1HD       PRO  16   6.217 -10.464  -6.439
  113   2HD   PRO  16          2HD       PRO  16   7.246  -9.796  -5.189
  114    H    LYS  17           H        LYS  17   5.298 -13.161  -1.505
  115    HA   LYS  17           HA       LYS  17   3.410 -14.927  -2.910
  116   1HB   LYS  17          2HB       LYS  17   5.301 -15.563  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.166 -16.702  -1.347
  118   1HG   LYS  17          2HG       LYS  17   6.217 -15.321  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.666 -16.743  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.454 -18.131  -3.361
  121   2HD   LYS  17          1HD       LYS  17   4.100 -16.993  -3.457
  122   1HE   LYS  17          2HE       LYS  17   6.460 -16.407  -5.140
  123   2HE   LYS  17          1HE       LYS  17   5.470 -17.804  -5.593
  124   1HZ   LYS  17          1HZ       LYS  17   4.771 -15.767  -6.650
  125   2HZ   LYS  17          2HZ       LYS  17   4.466 -15.075  -5.138
  126   3HZ   LYS  17          3HZ       LYS  17   3.565 -16.423  -5.663
  127    H    ARG  18           H        ARG  18   1.602 -15.580  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.733   0.104
  129   1HB   ARG  18          2HB       ARG  18  -0.557 -15.876  -0.970
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.688   0.494
  131   1HG   ARG  18          2HG       ARG  18  -1.226 -14.882   1.778
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.487   0.237
  133   1HD   ARG  18          2HD       ARG  18  -3.315 -15.945   1.818
  134   2HD   ARG  18          1HD       ARG  18  -3.128 -16.548   0.164
  135    HE   ARG  18           HE       ARG  18  -1.064 -17.634   1.570
  136   1HH1  ARG  18          2HH1      ARG  18  -4.658 -18.505   1.492
  137   2HH1  ARG  18          1HH1      ARG  18  -4.458 -18.843   3.178
  138   1HH2  ARG  18          2HH2      ARG  18  -1.543 -19.659   3.426
  139   2HH2  ARG  18          1HH2      ARG  18  -1.805 -20.427   1.896
  140    H    GLY  19           H        GLY  19   0.550 -13.148   2.148
  141   1HA   GLY  19          2HA       GLY  19   0.935 -13.448   4.429
  142   2HA   GLY  19          1HA       GLY  19   1.904 -14.879   4.045
  143    H    GLN  20           H        GLN  20   3.267 -12.976   1.913
  144    HA   GLN  20           HA       GLN  20   5.254 -11.989   3.783
  145   1HB   GLN  20          2HB       GLN  20   5.102 -11.880   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.431 -11.203   1.721
  147   1HG   GLN  20          2HG       GLN  20   6.842 -13.491   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.123   1.569
  149   1HE2  GLN  20          1HE2      GLN  20   8.885 -13.778   1.915
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.642   0.258
  151    H    THR  21           H        THR  21   5.898  -9.935   4.063
  152    HA   THR  21           HA       THR  21   3.949  -7.848   3.444
  153    HB   THR  21           HB       THR  21   6.487  -7.828   5.134
  154    HG1  THR  21           HG1      THR  21   5.082  -8.527   6.606
  155   1HG2  THR  21          1HG2      THR  21   4.528  -5.600   4.682
  156   2HG2  THR  21          2HG2      THR  21   6.269  -5.594   4.396
  157   3HG2  THR  21          3HG2      THR  21   5.647  -5.682   6.044
  158    H    CYS  22           H        CYS  22   4.052  -6.679   1.689
  159    HA   CYS  22           HA       CYS  22   6.558  -6.385   0.225
  160   1HB   CYS  22          2HB       CYS  22   3.813  -5.362  -0.487
  161   2HB   CYS  22          1HB       CYS  22   5.233  -5.434  -1.545
  162    HG   CYS  22           HG       CYS  22   4.730  -7.767  -2.075
  163    H    VAL  23           H        VAL  23   7.677  -4.551   0.161
  164    HA   VAL  23           HA       VAL  23   6.772  -2.298   1.836
  165    HB   VAL  23           HB       VAL  23   9.634  -3.181   1.170
  166   1HG1  VAL  23          1HG1      VAL  23   8.492  -0.919   2.757
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.948   1.692
  168   3HG1  VAL  23          3HG1      VAL  23   9.996  -1.664   3.301
  169   1HG2  VAL  23          1HG2      VAL  23   7.797  -3.856   3.414
  170   2HG2  VAL  23          2HG2      VAL  23   9.509  -3.641   3.773
  171   3HG2  VAL  23          3HG2      VAL  23   9.000  -4.855   2.599
  172    H    VAL  24           H        VAL  24   6.137  -0.648   0.302
  173    HA   VAL  24           HA       VAL  24   7.581  -0.658  -2.263
  174    HB   VAL  24           HB       VAL  24   5.483  -0.201  -3.509
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.630  -1.779
  176   2HG1  VAL  24          2HG1      VAL  24   6.178  -2.583  -3.106
  177   3HG1  VAL  24          3HG1      VAL  24   4.459  -2.363  -3.429
  178   1HG2  VAL  24          1HG2      VAL  24   3.267  -0.455  -2.325
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.957  -1.798
  180   3HG2  VAL  24          3HG2      VAL  24   4.141  -0.491  -0.794
  181    H    HIS  25           H        HIS  25   7.790   1.373  -3.359
  182    HA   HIS  25           HA       HIS  25   6.700   3.596  -1.768
  183   1HB   HIS  25          2HB       HIS  25   9.116   3.370  -3.379
  184   2HB   HIS  25          1HB       HIS  25   8.117   4.723  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.080   5.443  -0.903
  186    HD2  HIS  25           HD2      HIS  25  10.969   4.836  -2.108
  187    HE1  HIS  25           HE1      HIS  25   8.511   6.539   0.827
  188    HE2  HIS  25           HE2      HIS  25  10.844   6.126   0.051
  189    H    TYR  26           H        TYR  26   5.065   5.001  -2.882
  190    HA   TYR  26           HA       TYR  26   4.444   4.246  -5.634
  191   1HB   TYR  26          2HB       TYR  26   2.140   3.707  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.742  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.747   5.509  -4.440
  194    HD2  TYR  26           HD2      TYR  26   2.894   3.060  -1.678
  195    HE1  TYR  26           HE1      TYR  26  -0.613   6.407  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.550   3.981   0.195
  197    HH   TYR  26           HH       TYR  26  -0.127   6.682   0.103
  198    H    THR  27           H        THR  27   3.221   5.733  -6.795
  199    HA   THR  27           HA       THR  27   2.335   8.164  -5.407
  200    HB   THR  27           HB       THR  27   3.482   8.077  -8.195
  201    HG1  THR  27           HG1      THR  27   4.355   8.924  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.782  -8.528
  203   2HG2  THR  27          2HG2      THR  27   3.188  10.687  -7.507
  204   3HG2  THR  27          3HG2      THR  27   1.738   9.972  -6.806
  205    H    GLY  28           H        GLY  28   0.073   8.084  -5.750
  206   1HA   GLY  28          2HA       GLY  28  -1.089   6.460  -7.921
  207   2HA   GLY  28          1HA       GLY  28  -1.922   6.972  -6.445
  208    H    MET  29           H        MET  29  -2.117   7.366  -9.513
  209    HA   MET  29           HA       MET  29  -2.905  10.190  -9.487
  210   1HB   MET  29          2HB       MET  29  -1.481   8.727 -11.719
  211   2HB   MET  29          1HB       MET  29  -2.184  10.343 -11.857
  212   1HG   MET  29          2HG       MET  29  -0.600  11.288 -10.509
  213   2HG   MET  29          1HG       MET  29  -0.178   9.743  -9.751
  214   1HE   MET  29          1HE       MET  29   0.794   8.008 -10.619
  215   2HE   MET  29          2HE       MET  29   2.360   8.217 -11.403
  216   3HE   MET  29          3HE       MET  29   0.961   7.703 -12.348
  217    H    LEU  30           H        LEU  30  -4.549  10.704 -10.717
  218    HA   LEU  30           HA       LEU  30  -6.563   8.804 -11.486
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.615 -10.972
  220   2HB   LEU  30          1HB       LEU  30  -7.160  11.339 -12.384
  221    HG   LEU  30           HG       LEU  30  -8.959  10.998 -11.160
  222   1HD1  LEU  30          1HD1      LEU  30  -8.541   8.874 -10.284
  223   2HD1  LEU  30          2HD1      LEU  30  -8.873   9.873  -8.871
  224   3HD1  LEU  30          3HD1      LEU  30  -7.211   9.451  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.617  12.082  -8.843
  226   2HD2  LEU  30          2HD2      LEU  30  -8.464  13.011 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.019  12.446  -9.495
  228    H    GLU  31           H        GLU  31  -7.370   8.958 -13.976
  229    HA   GLU  31           HA       GLU  31  -5.215   8.503 -15.715
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.086 -16.064
  231   2HB   GLU  31          1HB       GLU  31  -7.057   8.987 -17.474
  232   1HG   GLU  31          2HG       GLU  31  -6.309   6.758 -16.614
  233   2HG   GLU  31          1HG       GLU  31  -7.628   6.866 -15.435
  234    H    ASP  32           H        ASP  32  -6.496  11.596 -14.899
  235    HA   ASP  32           HA       ASP  32  -5.306  12.762 -17.295
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.857 -16.414
  237   2HB   ASP  32          1HB       ASP  32  -7.438  13.611 -16.364
  238    H    GLY  33           H        GLY  33  -3.817  11.614 -14.623
  239   1HA   GLY  33          2HA       GLY  33  -1.526  11.887 -14.229
  240   2HA   GLY  33          1HA       GLY  33  -1.619  13.506 -14.937
  241    H    LYS  34           H        LYS  34  -4.145  13.638 -12.941
  242    HA   LYS  34           HA       LYS  34  -2.768  15.197 -11.018
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.190 -11.901
  244   2HB   LYS  34          1HB       LYS  34  -5.505  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.976  16.471  -9.966
  246   2HG   LYS  34          1HG       LYS  34  -5.697  16.690 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.722  14.718  -8.287
  248   2HD   LYS  34          1HD       LYS  34  -5.072  16.407  -7.890
  249   1HE   LYS  34          2HE       LYS  34  -7.007  14.532  -9.256
  250   2HE   LYS  34          1HE       LYS  34  -7.004  14.870  -7.517
  251   1HZ   LYS  34          1HZ       LYS  34  -8.074  16.371  -9.645
  252   2HZ   LYS  34          2HZ       LYS  34  -6.991  17.299  -8.737
  253   3HZ   LYS  34          3HZ       LYS  34  -8.313  16.535  -7.978
  254    H    LYS  35           H        LYS  35  -1.722  14.607  -9.322
  255    HA   LYS  35           HA       LYS  35  -1.546  11.908  -8.413
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.565  -8.492
  257   2HB   LYS  35          1HB       LYS  35  -0.488  14.442  -7.182
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.540  -5.702
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.725  -7.013
  260   1HD   LYS  35          2HD       LYS  35   2.379  12.751  -5.539
  261   2HD   LYS  35          1HD       LYS  35   2.365  13.635  -7.075
  262   1HE   LYS  35          2HE       LYS  35   0.922  15.361  -6.034
  263   2HE   LYS  35          1HE       LYS  35   1.033  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.281  14.954  -4.341
  265   2HZ   LYS  35          2HZ       LYS  35   2.541  16.413  -4.770
  266   3HZ   LYS  35          3HZ       LYS  35   3.382  15.499  -5.938
  267    H    PHE  36           H        PHE  36  -2.816  11.063  -6.760
  268    HA   PHE  36           HA       PHE  36  -4.244  13.051  -5.102
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.140  -4.493
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.610  -6.200
  271    HD1  PHE  36           HD1      PHE  36  -4.653   8.995  -3.836
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.098  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.541   6.621  -4.509
  274    HE2  PHE  36           HE2      PHE  36  -5.279   7.711  -8.565
  275    HZ   PHE  36           HZ       PHE  36  -4.858   5.985  -6.865
  276    H    ASP  37           H        ASP  37  -1.761  10.659  -4.991
  277    HA   ASP  37           HA       ASP  37  -1.055  11.467  -2.360
  278   1HB   ASP  37          2HB       ASP  37  -2.942   9.815  -1.834
  279   2HB   ASP  37          1HB       ASP  37  -1.865   8.555  -2.453
  280    H    SER  38           H        SER  38   0.978  10.467  -1.659
  281    HA   SER  38           HA       SER  38   2.320   8.514  -3.297
  282   1HB   SER  38          2HB       SER  38   2.764  10.582  -4.605
  283   2HB   SER  38          1HB       SER  38   3.449  11.334  -3.158
  284    HG   SER  38           HG       SER  38   5.033  10.353  -4.565
  285    H    SER  39           H        SER  39   3.581   7.305  -1.913
  286    HA   SER  39           HA       SER  39   4.091   8.271   0.752
  287   1HB   SER  39          2HB       SER  39   5.451   6.188   0.992
  288   2HB   SER  39          1HB       SER  39   3.791   5.894   0.458
  289    HG   SER  39           HG       SER  39   4.880   4.729  -0.965
  290    H    ARG  40           H        ARG  40   5.671   8.414  -2.311
  291    HA   ARG  40           HA       ARG  40   8.347   8.699  -1.495
  292   1HB   ARG  40          2HB       ARG  40   6.896   9.774  -3.938
  293   2HB   ARG  40          1HB       ARG  40   8.646   9.873  -3.706
  294   1HG   ARG  40          2HG       ARG  40   8.669   7.372  -3.552
  295   2HG   ARG  40          1HG       ARG  40   6.968   7.398  -4.047
  296   1HD   ARG  40          2HD       ARG  40   7.654   8.458  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.346   8.285  -5.688
  298    HE   ARG  40           HE       ARG  40   9.209   5.986  -6.101
  299   1HH1  ARG  40          1HH1      ARG  40   5.579   6.786  -6.202
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.968  -7.893
  301   1HH2  ARG  40          1HH2      ARG  40   7.871   3.981  -6.856
  302   2HH2  ARG  40          2HH2      ARG  40   6.914   4.487  -8.208
  303    H    ASP  41           H        ASP  41   5.606  11.042  -1.764
  304    HA   ASP  41           HA       ASP  41   7.158  13.334  -1.090
  305   1HB   ASP  41          2HB       ASP  41   4.187  12.794  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.377  -0.522
  307    H    ARG  42           H        ARG  42   5.682  10.787   0.920
  308    HA   ARG  42           HA       ARG  42   6.300  12.311   3.321
  309   1HB   ARG  42          2HB       ARG  42   5.439   9.439   3.145
  310   2HB   ARG  42          1HB       ARG  42   5.372  10.508   4.551
  311   1HG   ARG  42          2HG       ARG  42   3.750  11.917   3.343
  312   2HG   ARG  42          1HG       ARG  42   3.758  10.733   2.025
  313   1HD   ARG  42          2HD       ARG  42   3.174  10.027   4.870
  314   2HD   ARG  42          1HD       ARG  42   1.919  10.548   3.735
  315    HE   ARG  42           HE       ARG  42   3.114   7.958   3.945
  316   1HH1  ARG  42          1HH1      ARG  42   0.345   9.704   2.080
  317   2HH1  ARG  42          2HH1      ARG  42   1.578   9.540   0.876
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.328   2.838
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.787   1.328
  320    H    ASN  43           H        ASN  43   7.997  10.294   1.242
  321    HA   ASN  43           HA       ASN  43   9.990   9.198   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.556  11.533   2.022
  323   2HB   ASN  43          1HB       ASN  43  10.442  10.968   3.696
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.104   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.588   9.744   1.391
  326    H    LYS  44           H        LYS  44   7.797   7.928   2.741
  327    HA   LYS  44           HA       LYS  44   9.468   6.182   4.409
  328   1HB   LYS  44          2HB       LYS  44   8.223   7.817   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.710   7.205   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.014   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.599   6.830
  332   1HD   LYS  44          2HD       LYS  44   7.583   7.120   8.278
  333   2HD   LYS  44          1HD       LYS  44   6.034   6.934   7.436
  334   1HE   LYS  44          2HE       LYS  44   7.384   4.697   8.961
  335   2HE   LYS  44          1HE       LYS  44   6.179   5.777   9.677
  336   1HZ   LYS  44          1HZ       LYS  44   5.866   3.723   7.645
  337   2HZ   LYS  44          2HZ       LYS  44   4.809   5.044   7.655
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.035   9.022
  339    HA   PRO  45           HA       PRO  45   7.454   3.618   1.208
  340   1HB   PRO  45          2HB       PRO  45   8.336   1.316   2.816
  341   2HB   PRO  45          1HB       PRO  45   8.652   1.689   1.129
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.990   2.946
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.161   1.649
  344   1HD   PRO  45          1HD       PRO  45   9.468   3.381   4.524
  345   2HD   PRO  45          2HD       PRO  45  10.320   4.577   3.571
  346    H    PHE  46           H        PHE  46   5.602   2.323   1.037
  347    HA   PHE  46           HA       PHE  46   3.982   2.331   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.005   3.312   1.483
  349   2HB   PHE  46          1HB       PHE  46   3.340   1.838   0.559
  350    HD1  PHE  46           HD1      PHE  46   1.392   3.118   3.441
  351    HD2  PHE  46           HD2      PHE  46   1.765   0.211   0.358
  352    HE1  PHE  46           HE1      PHE  46  -0.841   2.248   3.983
  353    HE2  PHE  46           HE2      PHE  46  -0.461  -0.654   0.918
  354    HZ   PHE  46           HZ       PHE  46  -1.778   0.358   2.732
  355    H    LYS  47           H        LYS  47   3.423   0.256   4.455
  356    HA   LYS  47           HA       LYS  47   4.541  -2.088   3.050
  357   1HB   LYS  47          2HB       LYS  47   3.966  -1.641   5.983
  358   2HB   LYS  47          1HB       LYS  47   4.455  -3.194   5.294
  359   1HG   LYS  47          2HG       LYS  47   6.483  -2.130   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.002  -0.633   5.254
  361   1HD   LYS  47          2HD       LYS  47   6.196  -1.684   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.493  -3.262   6.665
  363   1HE   LYS  47          2HE       LYS  47   8.468  -2.421   5.551
  364   2HE   LYS  47          1HE       LYS  47   8.132  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.000   8.400
  366   2HZ   LYS  47          2HZ       LYS  47   9.621  -1.385   7.634
  367   3HZ   LYS  47          3HZ       LYS  47   9.248  -3.046   7.526
  368    H    PHE  48           H        PHE  48   3.032  -3.771   2.432
  369    HA   PHE  48           HA       PHE  48   0.643  -3.987   4.111
  370   1HB   PHE  48          2HB       PHE  48  -0.872  -4.237   2.306
  371   2HB   PHE  48          1HB       PHE  48   0.050  -2.759   1.981
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.774   0.223
  373    HD2  PHE  48           HD2      PHE  48  -0.909  -6.024   0.771
  374    HE1  PHE  48           HE1      PHE  48   2.259  -3.558  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.440  -6.811  -1.533
  376    HZ   PHE  48           HZ       PHE  48   1.146  -5.556  -2.944
  377    H    MET  49           H        MET  49  -0.030  -6.291   4.274
  378    HA   MET  49           HA       MET  49   1.874  -8.239   3.220
  379   1HB   MET  49          2HB       MET  49   1.321  -8.654   5.477
  380   2HB   MET  49          1HB       MET  49  -0.400  -8.377   5.188
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.502   4.182
  382   2HG   MET  49          1HG       MET  49   1.092 -10.766   4.147
  383   1HE   MET  49          1HE       MET  49   1.596 -10.936   8.133
  384   2HE   MET  49          2HE       MET  49   1.276  -9.410   7.306
  385   3HE   MET  49          3HE       MET  49   2.403 -10.574   6.607
  386    H    LEU  50           H        LEU  50   1.556  -9.321   1.510
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.100  -0.214
  388   1HB   LEU  50          2HB       LEU  50   1.837 -10.577  -0.103
  389   2HB   LEU  50          1HB       LEU  50   0.514 -11.616  -0.635
  390    HG   LEU  50           HG       LEU  50   1.997  -9.556  -2.080
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.296  -2.468
  392   2HD1  LEU  50          2HD1      LEU  50   2.461 -11.927  -2.292
  393   3HD1  LEU  50          3HD1      LEU  50   1.596 -11.432  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.265  -9.495  -3.780
  395   2HD2  LEU  50          2HD2      LEU  50  -0.225  -8.669  -2.301
  396   3HD2  LEU  50          3HD2      LEU  50  -0.849 -10.277  -2.661
  397    H    GLY  51           H        GLY  51  -2.500 -10.135  -0.243
  398   1HA   GLY  51          2HA       GLY  51  -3.965 -11.915  -0.223
  399   2HA   GLY  51          1HA       GLY  51  -2.817 -12.829   0.766
  400    H    LYS  52           H        LYS  52  -3.036  -9.957   2.331
  401    HA   LYS  52           HA       LYS  52  -4.860 -11.123   4.260
  402   1HB   LYS  52          2HB       LYS  52  -2.633  -9.864   4.490
  403   2HB   LYS  52          1HB       LYS  52  -3.669  -8.436   4.366
  404   1HG   LYS  52          2HG       LYS  52  -4.948  -9.342   6.362
  405   2HG   LYS  52          1HG       LYS  52  -3.626 -10.506   6.556
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.610   6.084
  407   2HD   LYS  52          1HD       LYS  52  -3.414  -7.509   6.196
  408   1HE   LYS  52          2HE       LYS  52  -3.790  -8.460   8.458
  409   2HE   LYS  52          1HE       LYS  52  -2.180  -9.180   8.302
  410   1HZ   LYS  52          1HZ       LYS  52  -2.521  -6.809   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.380   7.619
  412   3HZ   LYS  52          3HZ       LYS  52  -1.188  -7.186   8.286
  413    H    GLN  53           H        GLN  53  -5.464  -9.221   1.592
  414    HA   GLN  53           HA       GLN  53  -7.281  -8.072   0.876
  415   1HB   GLN  53          2HB       GLN  53  -8.464  -9.203   3.401
  416   2HB   GLN  53          1HB       GLN  53  -9.383  -8.294   2.194
  417   1HG   GLN  53          2HG       GLN  53  -9.297 -10.000   0.666
  418   2HG   GLN  53          1HG       GLN  53  -7.927 -10.784   1.471
  419   1HE2  GLN  53          1HE2      GLN  53  -9.752 -12.935   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.732   3.276
  421    H    GLU  54           H        GLU  54  -5.347  -6.569   2.308
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.584   3.518
  423   1HB   GLU  54          2HB       GLU  54  -5.240  -3.760   4.724
  424   2HB   GLU  54          1HB       GLU  54  -5.554  -5.464   5.078
  425   1HG   GLU  54          2HG       GLU  54  -3.731  -6.107   3.601
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.399   3.248
  427    H    VAL  55           H        VAL  55  -5.458  -5.033   0.730
  428    HA   VAL  55           HA       VAL  55  -5.543  -2.134   0.239
  429    HB   VAL  55           HB       VAL  55  -3.882  -2.656  -1.664
  430   1HG1  VAL  55          1HG1      VAL  55  -3.276  -2.882   1.283
  431   2HG1  VAL  55          2HG1      VAL  55  -3.215  -1.440   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.006  -2.710   0.072
  433   1HG2  VAL  55          1HG2      VAL  55  -3.254  -5.154  -0.163
  434   2HG2  VAL  55          2HG2      VAL  55  -2.604  -4.581  -1.699
  435   3HG2  VAL  55          3HG2      VAL  55  -4.278  -5.125  -1.597
  436    H    ILE  56           H        ILE  56  -5.906  -1.830  -2.310
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.119  -2.877
  438    HB   ILE  56           HB       ILE  56  -8.230  -1.807  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.913  -0.390  -3.803
  440   2HG1  ILE  56          1HG1      ILE  56  -5.702  -1.647  -5.034
  441   1HG2  ILE  56          1HG2      ILE  56  -9.529  -0.598  -3.669
  442   2HG2  ILE  56          2HG2      ILE  56  -8.131   0.475  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.379  -0.754  -2.341
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.251  -6.671
  445   2HD1  ILE  56          2HD1      ILE  56  -5.492   0.606  -5.993
  446   3HD1  ILE  56          3HD1      ILE  56  -7.124   0.996  -5.449
  447    H    ARG  57           H        ARG  57  -8.928  -4.372  -4.685
  448    HA   ARG  57           HA       ARG  57  -7.302  -6.654  -4.956
  449   1HB   ARG  57          2HB       ARG  57  -9.777  -6.631  -5.311
  450   2HB   ARG  57          1HB       ARG  57  -9.544  -5.687  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.335  -7.515  -7.790
  452   2HG   ARG  57          1HG       ARG  57  -8.506  -8.459  -6.301
  453   1HD   ARG  57          2HD       ARG  57 -10.927  -8.587  -6.657
  454   2HD   ARG  57          1HD       ARG  57 -10.767  -7.626  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.770  -8.133
  456   1HH1  ARG  57          1HH1      ARG  57 -12.265  -9.326  -9.730
  457   2HH1  ARG  57          2HH1      ARG  57 -12.630 -10.669  -8.700
  458   1HH2  ARG  57          1HH2      ARG  57  -9.483 -11.967  -9.049
  459   2HH2  ARG  57          2HH2      ARG  57 -10.210 -11.504 -10.551
  460    H    GLY  58           H        GLY  58  -7.318  -3.873  -7.249
  461   1HA   GLY  58          2HA       GLY  58  -5.787  -5.257  -9.176
  462   2HA   GLY  58          1HA       GLY  58  -5.913  -3.499  -9.003
  463    H    TRP  59           H        TRP  59  -4.852  -3.703  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.018  -3.685  -6.666
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.134  -4.344
  466   2HB   TRP  59          1HB       TRP  59  -2.168  -3.716  -3.948
  467    HD1  TRP  59           HD1      TRP  59  -3.605  -1.155  -6.510
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.903  -6.378
  469    HE3  TRP  59           HE3      TRP  59  -0.323  -2.655  -2.814
  470    HZ2  TRP  59           HZ2      TRP  59   0.090   1.799  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.154
  472    HH2  TRP  59           HH2      TRP  59   1.657   1.075  -3.215
  473    H    GLU  60           H        GLU  60  -3.997  -5.884  -4.553
  474    HA   GLU  60           HA       GLU  60  -2.182  -7.808  -3.914
  475   1HB   GLU  60          2HB       GLU  60  -4.937  -8.446  -4.978
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.488  -3.962
  477   1HG   GLU  60          2HG       GLU  60  -4.905  -6.875  -2.951
  478   2HG   GLU  60          1HG       GLU  60  -5.970  -8.292  -2.983
  479    H    GLU  61           H        GLU  61  -3.992  -7.516  -6.943
  480    HA   GLU  61           HA       GLU  61  -2.772  -9.827  -8.164
  481   1HB   GLU  61          2HB       GLU  61  -4.419  -7.607  -9.393
  482   2HB   GLU  61          1HB       GLU  61  -4.041  -9.165 -10.139
  483   1HG   GLU  61          2HG       GLU  61  -5.246  -9.498  -7.529
  484   2HG   GLU  61          1HG       GLU  61  -6.275  -8.538  -8.605
  485    H    GLY  62           H        GLY  62  -2.126  -6.341  -8.335
  486   1HA   GLY  62          2HA       GLY  62  -0.508  -6.785 -10.673
  487   2HA   GLY  62          1HA       GLY  62  -0.757  -5.248  -9.834
  488    H    VAL  63           H        VAL  63   0.134  -5.861  -7.306
  489    HA   VAL  63           HA       VAL  63   2.943  -5.683  -7.765
  490    HB   VAL  63           HB       VAL  63   1.302  -5.994  -5.198
  491   1HG1  VAL  63          1HG1      VAL  63   3.648  -6.696  -4.932
  492   2HG1  VAL  63          2HG1      VAL  63   3.350  -5.180  -4.082
  493   3HG1  VAL  63          3HG1      VAL  63   4.186  -5.171  -5.634
  494   1HG2  VAL  63          1HG2      VAL  63   0.932  -3.779  -6.426
  495   2HG2  VAL  63          2HG2      VAL  63   2.677  -3.532  -6.450
  496   3HG2  VAL  63          3HG2      VAL  63   1.806  -3.530  -4.916
  497    H    ALA  64           H        ALA  64   0.822  -8.472  -7.069
  498    HA   ALA  64           HA       ALA  64   2.871 -10.243  -6.295
  499   1HB   ALA  64          1HB       ALA  64   0.456 -10.984  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.405 -10.688  -6.178
  501   3HB   ALA  64          3HB       ALA  64   1.385 -12.005  -6.820
  502    H    GLN  65           H        GLN  65   2.108  -8.870  -9.375
  503    HA   GLN  65           HA       GLN  65   3.584 -10.841 -10.888
  504   1HB   GLN  65          2HB       GLN  65   2.247  -8.223 -11.563
  505   2HB   GLN  65          1HB       GLN  65   3.243  -9.100 -12.734
  506   1HG   GLN  65          2HG       GLN  65   1.822 -11.071 -12.541
  507   2HG   GLN  65          1HG       GLN  65   0.884 -10.308 -11.244
  508   1HE2  GLN  65          1HE2      GLN  65  -1.178  -9.486 -12.158
  509   2HE2  GLN  65          2HE2      GLN  65  -0.902  -8.129 -13.190
  510    H    MET  66           H        MET  66   4.753  -8.572  -8.816
  511    HA   MET  66           HA       MET  66   6.777  -7.619 -10.720
  512   1HB   MET  66          2HB       MET  66   5.985  -6.535  -8.025
  513   2HB   MET  66          1HB       MET  66   7.236  -5.864  -9.079
  514   1HG   MET  66          2HG       MET  66   5.598  -5.382 -10.782
  515   2HG   MET  66          1HG       MET  66   4.329  -6.153  -9.815
  516   1HE   MET  66          1HE       MET  66   7.229  -3.850  -8.685
  517   2HE   MET  66          2HE       MET  66   6.481  -2.254  -8.656
  518   3HE   MET  66          3HE       MET  66   6.731  -3.084 -10.192
  519    H    SER  67           H        SER  67   8.936  -7.975 -10.280
  520    HA   SER  67           HA       SER  67   9.649  -9.757  -8.077
  521   1HB   SER  67          2HB       SER  67  11.858  -9.704  -9.291
  522   2HB   SER  67          1HB       SER  67  10.496 -10.435 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.800 -11.554
  524    H    VAL  68           H        VAL  68  11.483  -9.148  -6.637
  525    HA   VAL  68           HA       VAL  68  11.309  -6.546  -5.628
  526    HB   VAL  68           HB       VAL  68  13.513  -8.621  -5.345
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.416  -3.307
  528   2HG1  VAL  68          2HG1      VAL  68  12.990  -6.167  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.359  -6.391  -4.731
  530   1HG2  VAL  68          1HG2      VAL  68  11.725  -9.652  -4.479
  531   2HG2  VAL  68          2HG2      VAL  68  10.884  -8.142  -4.130
  532   3HG2  VAL  68          3HG2      VAL  68  12.173  -8.699  -3.065
  533    H    GLY  69           H        GLY  69  12.137  -4.763  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.883  -3.301  -6.746
  535   2HA   GLY  69          1HA       GLY  69  14.459  -4.530  -7.883
  536    H    GLN  70           H        GLN  70  11.270  -4.687  -8.434
  537    HA   GLN  70           HA       GLN  70  11.691  -3.131 -10.841
  538   1HB   GLN  70          2HB       GLN  70  10.813  -5.489 -10.676
  539   2HB   GLN  70          1HB       GLN  70   9.325  -4.777 -10.035
  540   1HG   GLN  70          2HG       GLN  70   9.150  -3.445 -12.105
  541   2HG   GLN  70          1HG       GLN  70  10.537  -4.346 -12.742
  542   1HE2  GLN  70          2HE2      GLN  70   9.493  -7.239 -12.034
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.874 -11.427
  544    H    ARG  71           H        ARG  71  10.582  -1.587 -11.624
  545    HA   ARG  71           HA       ARG  71   8.697  -0.178  -9.844
  546   1HB   ARG  71          2HB       ARG  71  10.802   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.688   1.054 -11.765
  548   1HG   ARG  71          2HG       ARG  71   8.898   2.569 -11.793
  549   2HG   ARG  71          1HG       ARG  71   8.397   2.160 -10.146
  550   1HD   ARG  71          2HD       ARG  71  10.283   3.311  -9.214
  551   2HD   ARG  71          1HD       ARG  71  10.990   3.554 -10.819
  552    HE   ARG  71           HE       ARG  71   8.426   4.695 -10.780
  553   1HH1  ARG  71          2HH1      ARG  71  11.613   5.178  -9.290
  554   2HH1  ARG  71          1HH1      ARG  71  11.463   6.904  -9.285
  555   1HH2  ARG  71          1HH2      ARG  71   8.120   6.876 -10.465
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.986
  557    H    ALA  72           H        ALA  72   6.800  -0.068 -10.812
  558    HA   ALA  72           HA       ALA  72   6.469  -0.150 -13.715
  559   1HB   ALA  72          1HB       ALA  72   5.012  -2.006 -13.696
  560   2HB   ALA  72          2HB       ALA  72   4.894  -1.997 -11.937
  561   3HB   ALA  72          3HB       ALA  72   6.393  -2.503 -12.717
  562    H    LYS  73           H        LYS  73   4.461   0.425 -14.507
  563    HA   LYS  73           HA       LYS  73   2.807   2.083 -12.737
  564   1HB   LYS  73          2HB       LYS  73   3.832   3.035 -14.744
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.821 -15.724
  566   1HG   LYS  73          2HG       LYS  73   0.829   2.875 -14.912
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.217 -14.335
  568   1HD   LYS  73          2HD       LYS  73   2.965   4.301 -16.496
  569   2HD   LYS  73          1HD       LYS  73   1.970   2.953 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.018   4.448 -16.678
  571   2HE   LYS  73          1HE       LYS  73   1.148   5.769 -16.499
  572   1HZ   LYS  73          1HZ       LYS  73   0.808   4.007 -18.847
  573   2HZ   LYS  73          2HZ       LYS  73   2.039   5.157 -18.682
  574   3HZ   LYS  73          3HZ       LYS  73   0.409   5.648 -18.751
  575    H    LEU  74           H        LEU  74   0.910   1.250 -12.075
  576    HA   LEU  74           HA       LEU  74  -0.136  -1.173 -13.369
  577   1HB   LEU  74          2HB       LEU  74   0.214  -0.092 -10.656
  578   2HB   LEU  74          1HB       LEU  74  -1.340  -0.881 -10.937
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.000 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.990  -3.481 -11.265
  581   2HD1  LEU  74          2HD1      LEU  74   2.322  -1.757 -11.425
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.587 -12.650
  583   1HD2  LEU  74          1HD2      LEU  74  -0.468  -1.889  -8.848
  584   2HD2  LEU  74          2HD2      LEU  74   1.231  -1.448  -9.036
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.146  -8.937
  586    H    THR  75           H        THR  75  -1.870  -0.573 -14.790
  587    HA   THR  75           HA       THR  75  -3.498   1.772 -14.022
  588    HB   THR  75           HB       THR  75  -3.435   0.122 -16.597
  589    HG1  THR  75           HG1      THR  75  -1.652   1.267 -16.761
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.968 -17.628
  591   2HG2  THR  75          2HG2      THR  75  -4.844   2.694 -16.038
  592   3HG2  THR  75          3HG2      THR  75  -5.575   1.134 -16.413
  593    H    ILE  76           H        ILE  76  -5.455   1.333 -12.989
  594    HA   ILE  76           HA       ILE  76  -6.290  -1.483 -12.780
  595    HB   ILE  76           HB       ILE  76  -6.388   0.674 -10.637
  596   1HG1  ILE  76          2HG1      ILE  76  -4.508  -1.674 -10.945
  597   2HG1  ILE  76          1HG1      ILE  76  -4.084   0.026 -11.222
  598   1HG2  ILE  76          1HG2      ILE  76  -7.209  -2.170 -10.634
  599   2HG2  ILE  76          2HG2      ILE  76  -8.130  -0.726 -10.214
  600   3HG2  ILE  76          3HG2      ILE  76  -6.834  -1.283  -9.158
  601   1HD1  ILE  76          1HD1      ILE  76  -4.414  -1.467  -8.691
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.220  -8.707
  603   3HD1  ILE  76          3HD1      ILE  76  -3.266  -0.200  -9.127
  604    H    SER  77           H        SER  77  -8.340  -1.763 -13.535
  605    HA   SER  77           HA       SER  77 -10.074   0.347 -14.261
  606   1HB   SER  77          2HB       SER  77 -11.734  -1.397 -14.644
  607   2HB   SER  77          1HB       SER  77 -10.163  -1.886 -15.294
  608    HG   SER  77           HG       SER  77 -11.683  -3.015 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.059   1.321 -10.425
  610   1HB   PRO  78          2HB       PRO  78 -14.776   1.357 -11.227
  611   2HB   PRO  78          1HB       PRO  78 -13.688   2.734 -11.184
  612   1HG   PRO  78          2HG       PRO  78 -14.507   1.056 -13.514
  613   2HG   PRO  78          1HG       PRO  78 -14.013   2.740 -13.488
  614   1HD   PRO  78          1HD       PRO  78 -12.360   0.788 -14.398
  615   2HD   PRO  78          2HD       PRO  78 -11.741   2.211 -13.585
  616    H    ASP  79           H        ASP  79 -13.478  -1.462 -12.055
  617    HA   ASP  79           HA       ASP  79 -14.744  -2.335  -9.643
  618   1HB   ASP  79          2HB       ASP  79 -15.146  -4.410 -10.854
  619   2HB   ASP  79          1HB       ASP  79 -15.489  -3.031 -11.909
  620    H    TYR  80           H        TYR  80 -11.545  -2.401 -10.611
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.457  -8.687
  622   1HB   TYR  80          2HB       TYR  80  -9.560  -3.182 -11.070
  623   2HB   TYR  80          1HB       TYR  80  -8.479  -3.757  -9.787
  624    HD1  TYR  80           HD1      TYR  80 -11.503  -4.892 -11.641
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.819  -9.878
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.200 -12.483
  627    HE2  TYR  80           HE2      TYR  80  -7.918  -8.146 -10.692
  628    HH   TYR  80           HH       TYR  80  -8.975  -9.435 -12.229
  629    H    ALA  81           H        ALA  81 -11.563  -1.443  -8.396
  630    HA   ALA  81           HA       ALA  81  -9.393  -0.749  -6.537
  631   1HB   ALA  81          1HB       ALA  81  -9.043   0.365  -8.763
  632   2HB   ALA  81          2HB       ALA  81  -9.309   1.510  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.615   1.142  -8.574
  634    H    TYR  82           H        TYR  82 -11.706   1.776  -7.021
  635    HA   TYR  82           HA       TYR  82 -13.145   0.958  -4.576
  636   1HB   TYR  82          2HB       TYR  82 -12.502   3.643  -5.852
  637   2HB   TYR  82          1HB       TYR  82 -13.463   3.450  -4.377
  638    HD1  TYR  82           HD1      TYR  82 -12.314   2.134  -2.429
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.940  -5.711
  640    HE1  TYR  82           HE1      TYR  82 -10.208   2.035  -1.125
  641    HE2  TYR  82           HE2      TYR  82  -8.142   3.838  -4.422
  642    HH   TYR  82           HH       TYR  82  -7.556   3.779  -1.856
  643    H    GLY  83           H        GLY  83 -13.805   0.861  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.707   0.432  -8.897
  645   2HA   GLY  83          1HA       GLY  83 -16.439   0.098  -7.319
  646    H    ALA  84           H        ALA  84 -18.269   0.982  -7.434
  647    HA   ALA  84           HA       ALA  84 -18.706   3.584  -8.634
  648   1HB   ALA  84          1HB       ALA  84 -20.323   1.690  -8.790
  649   2HB   ALA  84          2HB       ALA  84 -21.023   3.181  -8.156
  650   3HB   ALA  84          3HB       ALA  84 -20.612   1.863  -7.059
  651    H    THR  85           H        THR  85 -18.019   2.428  -5.346
  652    HA   THR  85           HA       THR  85 -19.182   4.739  -4.103
  653    HB   THR  85           HB       THR  85 -16.856   3.115  -3.033
  654    HG1  THR  85           HG1      THR  85 -19.571   2.453  -2.689
  655   1HG2  THR  85          1HG2      THR  85 -19.157   4.616  -1.811
  656   2HG2  THR  85          2HG2      THR  85 -17.431   4.851  -1.534
  657   3HG2  THR  85          3HG2      THR  85 -18.237   3.409  -0.916
  658    H    GLY  86           H        GLY  86 -15.913   4.003  -5.319
  659   1HA   GLY  86          2HA       GLY  86 -14.100   5.463  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.215   6.806  -5.305
  661    H    HIS  87           H        HIS  87 -13.165   7.511  -3.886
  662    HA   HIS  87           HA       HIS  87 -13.464   6.202  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.190   6.025  -2.258
  664   2HB   HIS  87          1HB       HIS  87 -11.087   7.793  -2.210
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.797   0.416
  666    HD2  HIS  87           HD2      HIS  87 -10.710   4.669  -0.092
  667    HE1  HIS  87           HE1      HIS  87 -10.103   7.850   2.598
  668    HE2  HIS  87           HE2      HIS  87 -10.001   5.372   2.223
  669    HA   PRO  88           HA       PRO  88 -15.772  10.118  -0.978
  670   1HB   PRO  88          2HB       PRO  88 -15.861  10.505   1.732
  671   2HB   PRO  88          1HB       PRO  88 -16.876   9.331   0.912
  672   1HG   PRO  88          2HG       PRO  88 -14.225   8.864   2.307
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.495
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.988   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.539   6.972   0.308
  676    H    GLY  89           H        GLY  89 -15.167  11.873  -1.572
  677   1HA   GLY  89          2HA       GLY  89 -14.150  13.914  -1.650
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.214
  679    H    ILE  90           H        ILE  90 -12.042  11.021  -1.770
  680    HA   ILE  90           HA       ILE  90  -9.977  12.656  -3.119
  681    HB   ILE  90           HB       ILE  90  -9.842   9.883  -1.827
  682   1HG1  ILE  90          2HG1      ILE  90  -8.445  12.390  -0.968
  683   2HG1  ILE  90          1HG1      ILE  90 -10.098  12.029  -0.441
  684   1HG2  ILE  90          1HG2      ILE  90  -7.309  10.385  -1.933
  685   2HG2  ILE  90          2HG2      ILE  90  -7.713  11.627  -3.117
  686   3HG2  ILE  90          3HG2      ILE  90  -8.067   9.934  -3.459
  687   1HD1  ILE  90          1HD1      ILE  90  -9.336  10.708   1.162
  688   2HD1  ILE  90          2HD1      ILE  90  -7.694  11.180   0.726
  689   3HD1  ILE  90          3HD1      ILE  90  -8.424   9.749  -0.002
  690    H    ILE  91           H        ILE  91 -11.664   9.563  -3.637
  691    HA   ILE  91           HA       ILE  91 -10.634   9.708  -6.402
  692    HB   ILE  91           HB       ILE  91 -11.716   7.252  -4.977
  693   1HG1  ILE  91          2HG1      ILE  91  -9.603   7.976  -3.972
  694   2HG1  ILE  91          1HG1      ILE  91  -9.414   6.462  -4.873
  695   1HG2  ILE  91          1HG2      ILE  91 -10.553   6.111  -6.910
  696   2HG2  ILE  91          2HG2      ILE  91 -10.439   7.707  -7.653
  697   3HG2  ILE  91          3HG2      ILE  91 -12.020   7.012  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.509   7.969  -5.200
  699   2HD1  ILE  91          2HD1      ILE  91  -8.593   9.197  -5.853
  700   3HD1  ILE  91          3HD1      ILE  91  -8.368   7.672  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.250  10.299  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.682   9.826  -9.877
  703   2HB   PRO  92          1HB       PRO  92 -15.346  11.254  -9.101
  704   1HG   PRO  92          2HG       PRO  92 -12.861  11.318 -10.115
  705   2HG   PRO  92          1HG       PRO  92 -13.211  12.132  -8.601
  706   1HD   PRO  92          1HD       PRO  92 -12.059   9.356  -8.999
  707   2HD   PRO  92          2HD       PRO  92 -11.420  10.653  -8.011
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.869
  709   1HB   PRO  93          2HB       PRO  93 -18.920   7.282  -9.559
  710   2HB   PRO  93          1HB       PRO  93 -19.087   6.342  -8.086
  711   1HG   PRO  93          2HG       PRO  93 -19.618   9.036  -8.233
  712   2HG   PRO  93          1HG       PRO  93 -19.150   8.220  -6.749
  713   1HD   PRO  93          1HD       PRO  93 -17.515   9.977  -8.524
  714   2HD   PRO  93          2HD       PRO  93 -17.369   9.712  -6.800
  715    H    HIS  94           H        HIS  94 -16.500   4.743  -9.377
  716    HA   HIS  94           HA       HIS  94 -15.944   3.693 -11.309
  717   1HB   HIS  94          2HB       HIS  94 -17.266   6.170 -12.563
  718   2HB   HIS  94          1HB       HIS  94 -16.933   4.652 -13.417
  719    HD1  HIS  94           HD1      HIS  94 -18.296   2.487 -12.154
  720    HD2  HIS  94           HD2      HIS  94 -19.607   6.360 -11.436
  721    HE1  HIS  94           HE1      HIS  94 -20.596   2.311 -11.164
  722    HE2  HIS  94           HE2      HIS  94 -21.351   4.657 -10.759
  723    H    ALA  95           H        ALA  95 -13.894   5.537 -10.142
  724    HA   ALA  95           HA       ALA  95 -12.524   6.635 -12.451
  725   1HB   ALA  95          1HB       ALA  95 -12.630   7.328  -9.872
  726   2HB   ALA  95          2HB       ALA  95 -11.237   7.692 -10.892
  727   3HB   ALA  95          3HB       ALA  95 -11.204   6.294  -9.819
  728    H    THR  96           H        THR  96 -10.924   5.698 -13.745
  729    HA   THR  96           HA       THR  96  -9.715   3.198 -13.010
  730    HB   THR  96           HB       THR  96  -9.159   5.172 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.420   3.811 -16.393
  732   1HG2  THR  96          1HG2      THR  96  -7.732   2.635 -14.646
  733   2HG2  THR  96          2HG2      THR  96  -7.065   4.252 -14.874
  734   3HG2  THR  96          3HG2      THR  96  -7.753   3.381 -16.245
  735    H    LEU  97           H        LEU  97  -7.695   3.076 -11.871
  736    HA   LEU  97           HA       LEU  97  -6.463   5.645 -11.105
  737   1HB   LEU  97          2HB       LEU  97  -6.522   2.947  -9.734
  738   2HB   LEU  97          1HB       LEU  97  -5.730   4.392  -9.103
  739    HG   LEU  97           HG       LEU  97  -8.696   3.975  -9.442
  740   1HD1  LEU  97          1HD1      LEU  97  -8.707   3.955  -7.054
  741   2HD1  LEU  97          2HD1      LEU  97  -6.988   4.350  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.510   2.780  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.505   6.246  -9.826
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.407  -8.822
  745   3HD2  LEU  97          3HD2      LEU  97  -8.646   6.198  -8.068
  746    H    VAL  98           H        VAL  98  -4.208   5.848 -11.143
  747    HA   VAL  98           HA       VAL  98  -2.849   3.761 -12.691
  748    HB   VAL  98           HB       VAL  98  -2.520   6.782 -12.882
  749   1HG1  VAL  98          1HG1      VAL  98  -1.026   4.461 -14.105
  750   2HG1  VAL  98          2HG1      VAL  98  -0.379   5.705 -13.035
  751   3HG1  VAL  98          3HG1      VAL  98  -0.882   6.124 -14.673
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.908 -15.157
  753   2HG2  VAL  98          2HG2      VAL  98  -3.415   6.653 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.468   5.573 -14.150
  755    H    PHE  99           H        PHE  99  -1.240   2.911 -11.258
  756    HA   PHE  99           HA       PHE  99  -0.233   4.766  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.718   1.816  -9.168
  758   2HB   PHE  99          1HB       PHE  99   0.436   2.563  -8.052
  759    HD1  PHE  99           HD1      PHE  99  -3.099   2.160  -8.947
  760    HD2  PHE  99           HD2      PHE  99  -0.266   3.912  -6.251
  761    HE1  PHE  99           HE1      PHE  99  -4.903   2.660  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.088   4.403  -4.663
  763    HZ   PHE  99           HZ       PHE  99  -4.397   3.778  -5.221
  764    H    ASP 100           H        ASP 100   1.948   5.076  -9.151
  765    HA   ASP 100           HA       ASP 100   3.709   3.599 -10.963
  766   1HB   ASP 100          2HB       ASP 100   3.847   5.986 -11.157
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.148  -9.411
  768    H    VAL 101           H        VAL 101   4.563   1.927  -9.767
  769    HA   VAL 101           HA       VAL 101   4.827   2.053  -6.828
  770    HB   VAL 101           HB       VAL 101   3.653  -0.203  -8.531
  771   1HG1  VAL 101          1HG1      VAL 101   3.149  -1.243  -6.290
  772   2HG1  VAL 101          2HG1      VAL 101   4.249  -0.061  -5.580
  773   3HG1  VAL 101          3HG1      VAL 101   4.851  -1.233  -6.752
  774   1HG2  VAL 101          1HG2      VAL 101   1.644   0.199  -7.113
  775   2HG2  VAL 101          2HG2      VAL 101   2.123   1.754  -7.796
  776   3HG2  VAL 101          3HG2      VAL 101   2.549   1.352  -6.133
  777    H    GLU 102           H        GLU 102   6.714   1.361  -6.030
  778    HA   GLU 102           HA       GLU 102   8.510  -0.106  -7.837
  779   1HB   GLU 102          2HB       GLU 102   9.366   2.100  -7.492
  780   2HB   GLU 102          1HB       GLU 102   9.085   1.987  -5.750
  781   1HG   GLU 102          2HG       GLU 102  10.833   0.480  -5.436
  782   2HG   GLU 102          1HG       GLU 102  10.875   0.034  -7.151
  783    H    LEU 103           H        LEU 103   8.833  -2.173  -7.006
  784    HA   LEU 103           HA       LEU 103   8.027  -2.669  -4.241
  785   1HB   LEU 103          2HB       LEU 103   7.226  -4.250  -5.862
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.466  -6.530
  787    HG   LEU 103           HG       LEU 103   9.548  -5.665  -4.532
  788   1HD1  LEU 103          1HD1      LEU 103   6.782  -4.963  -3.523
  789   2HD1  LEU 103          2HD1      LEU 103   8.336  -4.625  -2.761
  790   3HD1  LEU 103          3HD1      LEU 103   7.734  -6.279  -2.836
  791   1HD2  LEU 103          1HD2      LEU 103   7.981  -7.615  -4.731
  792   2HD2  LEU 103          2HD2      LEU 103   8.587  -7.007  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.951  -6.609  -5.746
  794    H    LEU 104           H        LEU 104   9.457  -2.278  -2.765
  795    HA   LEU 104           HA       LEU 104  12.289  -2.023  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.807  -1.447  -0.821
  797   2HB   LEU 104          1HB       LEU 104  12.476  -0.997  -1.180
  798    HG   LEU 104           HG       LEU 104  10.041   0.191  -2.506
  799   1HD1  LEU 104          1HD1      LEU 104  10.370   0.799  -0.055
  800   2HD1  LEU 104          2HD1      LEU 104  10.328   2.140  -1.199
  801   3HD1  LEU 104          3HD1      LEU 104  11.870   1.579  -0.555
  802   1HD2  LEU 104          1HD2      LEU 104  12.274   0.034  -3.736
  803   2HD2  LEU 104          2HD2      LEU 104  12.924   1.104  -2.492
  804   3HD2  LEU 104          3HD2      LEU 104  11.622   1.661  -3.544
  805    H    LYS 105           H        LYS 105  10.327  -4.008  -1.313
  806    HA   LYS 105           HA       LYS 105  12.566  -5.749  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.826  -3.636   0.611
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.083   1.446
  809   1HG   LYS 105          2HG       LYS 105  12.358  -6.014   2.350
  810   2HG   LYS 105          1HG       LYS 105  13.833  -5.708   1.416
  811   1HD   LYS 105          2HD       LYS 105  14.216  -3.641   2.555
  812   2HD   LYS 105          1HD       LYS 105  12.614  -3.696   3.311
  813   1HE   LYS 105          2HE       LYS 105  13.276  -5.924   4.302
  814   2HE   LYS 105          1HE       LYS 105  14.922  -5.603   3.734
  815   1HZ   LYS 105          1HZ       LYS 105  13.453  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.253  -3.309   4.907
  817   3HZ   LYS 105          3HZ       LYS 105  15.123  -4.566   5.660
  818    H    LEU 106           H        LEU 106  11.794  -7.703   0.372
  819    HA   LEU 106           HA       LEU 106   8.921  -7.755   1.010
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.085   0.182
  821   2HB   LEU 106          1HB       LEU 106   8.989 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.870  -8.833  -1.808
  823   1HD1  LEU 106          1HD1      LEU 106   8.415 -11.424  -1.350
  824   2HD1  LEU 106          2HD1      LEU 106  10.121 -11.286  -1.776
  825   3HD1  LEU 106          3HD1      LEU 106   8.884 -10.734  -2.903
  826   1HD2  LEU 106          1HD2      LEU 106   7.566  -8.572  -2.322
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.673
  828   3HD2  LEU 106          3HD2      LEU 106   7.072  -9.577  -0.959
  829    H    GLU 107           HN       GLU 107   8.525  -8.269   3.052
  830    HA   GLU 107           HA       GLU 107  10.717  -9.187   4.800
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.228   5.416
  832   2HB   GLU 107          1HB       GLU 107   9.697  -7.831   6.579
  833   1HG   GLU 107          2HG       GLU 107  11.468  -6.821   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.233  -6.151   4.164
  835    H2   GPI 108           H2       GPI 108  -3.515   1.730  -2.319
  836   1H5   GPI 108          1H5       GPI 108  -1.953   4.322  -1.637
  837   2H5   GPI 108          2H5       GPI 108  -1.995   4.311   0.136
  838   1H3   GPI 108          1H3       GPI 108  -1.649   0.442  -1.358
  839   2H3   GPI 108          2H3       GPI 108  -2.177   0.775   0.301
  840   1H4   GPI 108          1H4       GPI 108  -0.580   2.460  -1.626
  841   2H4   GPI 108          2H4       GPI 108  -0.524   2.511   0.164
  842   1H14  GPI 108          1H14      GPI 108  -6.921   1.369  -0.058
  843   2H14  GPI 108          2H14      GPI 108  -6.593  -0.238   0.632
  844   1H15  GPI 108          1H15      GPI 108  -6.585   2.328   2.289
  845   2H15  GPI 108          2H15      GPI 108  -6.551   0.653   2.888
  846   1H16  GPI 108          1H16      GPI 108  -8.844   1.943   1.330
  847   2H16  GPI 108          2H16      GPI 108  -8.834   1.608   3.078
  848    H20  GPI 108           H20      GPI 108 -10.192  -3.796   1.136
  849    H21  GPI 108           H21      GPI 108 -10.742  -1.966  -0.465
  850    H22  GPI 108           H22      GPI 108  -9.949   0.352  -0.015
  851    H18  GPI 108           H18      GPI 108  -8.062  -0.981   3.626
  852   1H12  GPI 108          1H12      GPI 108  -3.128   4.537   1.855
  853   2H12  GPI 108          2H12      GPI 108  -3.540   5.697   3.086
  854   3H12  GPI 108          3H12      GPI 108  -4.400   4.172   2.998
  855   1H13  GPI 108          1H13      GPI 108  -7.044   5.939   1.942
  856   2H13  GPI 108          2H13      GPI 108  -6.731   4.454   1.024
  857   3H13  GPI 108          3H13      GPI 108  -6.339   4.524   2.765
  858   1H10  GPI 108          1H10      GPI 108  -3.919   7.487   1.369
  859   2H10  GPI 108          2H10      GPI 108  -5.110   7.386   2.686
  860   1H11  GPI 108          1H11      GPI 108  -6.844   7.990   1.310
  861   2H11  GPI 108          2H11      GPI 108  -5.573   8.697   0.352
  862   3H11  GPI 108          3H11      GPI 108  -6.209   7.118  -0.067
  Start of MODEL    6
    1   1H    GLY   1          1H        GLY   1 -10.184  -5.720 -15.430
    2   2H    GLY   1          2H        GLY   1  -9.174  -4.436 -15.868
    3   3H    GLY   1          3H        GLY   1  -9.873  -4.485 -14.313
    4   1HA   GLY   1          1HA       GLY   1  -8.595  -6.397 -13.736
    5   2HA   GLY   1          2HA       GLY   1  -7.913  -6.426 -15.370
    6    H    VAL   2           H        VAL   2  -5.836  -6.109 -14.257
    7    HA   VAL   2           HA       VAL   2  -5.182  -3.272 -13.801
    8    HB   VAL   2           HB       VAL   2  -5.015  -4.370 -11.645
    9   1HG1  VAL   2          1HG1      VAL   2  -5.039  -6.652 -11.975
   10   2HG1  VAL   2          2HG1      VAL   2  -3.356  -6.388 -11.518
   11   3HG1  VAL   2          3HG1      VAL   2  -3.786  -6.592 -13.216
   12   1HG2  VAL   2          1HG2      VAL   2  -2.739  -3.984 -11.113
   13   2HG2  VAL   2          2HG2      VAL   2  -2.994  -2.999 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.185  -4.560 -12.686
   15    H    GLN   3           H        GLN   3  -3.402  -2.742 -15.042
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.696 -16.955
   17   1HB   GLN   3          2HB       GLN   3  -3.650  -3.062 -17.957
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.781 -16.985
   19   1HG   GLN   3          2HG       GLN   3  -0.838  -2.076 -18.216
   20   2HG   GLN   3          1HG       GLN   3  -1.636  -3.299 -19.224
   21   1HE2  GLN   3          1HE2      GLN   3  -0.895  -0.070 -19.216
   22   2HE2  GLN   3          2HE2      GLN   3  -2.173   0.477 -20.243
   23    H    VAL   4           H        VAL   4   0.028  -4.828 -16.597
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.553
   25    HB   VAL   4           HB       VAL   4   1.947  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.455  -5.606 -13.276
   27   2HG1  VAL   4          2HG1      VAL   4   3.339  -3.909 -13.738
   28   3HG1  VAL   4          3HG1      VAL   4   4.019  -5.085 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.753 -13.785
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.128 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.451  -5.692 -12.607
   32    H    GLU   5           H        GLU   5   2.589  -1.533 -15.720
   33    HA   GLU   5           HA       GLU   5   3.858  -2.505 -18.204
   34   1HB   GLU   5          2HB       GLU   5   3.406   0.409 -17.570
   35   2HB   GLU   5          1HB       GLU   5   3.765  -0.336 -19.133
   36   1HG   GLU   5          2HG       GLU   5   1.576  -0.578 -19.581
   37   2HG   GLU   5          1HG       GLU   5   1.315  -1.438 -18.054
   38    H    THR   6           H        THR   6   6.173  -2.560 -17.862
   39    HA   THR   6           HA       THR   6   7.249  -1.666 -15.327
   40    HB   THR   6           HB       THR   6   8.546  -2.887 -17.814
   41    HG1  THR   6           HG1      THR   6   7.713  -4.258 -15.467
   42   1HG2  THR   6          1HG2      THR   6  10.110  -3.768 -15.964
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.269 -15.172
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.222 -16.772
   45    H    ILE   7           H        ILE   7   8.484  -0.098 -14.755
   46    HA   ILE   7           HA       ILE   7   9.325   1.984 -16.649
   47    HB   ILE   7           HB       ILE   7   9.174   1.956 -13.592
   48   1HG1  ILE   7          2HG1      ILE   7   7.573   3.424 -15.705
   49   2HG1  ILE   7          1HG1      ILE   7   7.037   1.948 -14.884
   50   1HG2  ILE   7          1HG2      ILE   7  10.901   3.494 -13.979
   51   2HG2  ILE   7          2HG2      ILE   7   9.451   4.491 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.148   4.116 -15.446
   53   1HD1  ILE   7          1HD1      ILE   7   6.104   4.221 -14.094
   54   2HD1  ILE   7          2HD1      ILE   7   7.674   4.427 -13.318
   55   3HD1  ILE   7          3HD1      ILE   7   6.644   3.063 -12.879
   56    H    SER   8           H        SER   8  10.603  -0.024 -13.869
   57    HA   SER   8           HA       SER   8  13.150  -0.215 -15.311
   58   1HB   SER   8          2HB       SER   8  12.963   0.238 -12.319
   59   2HB   SER   8          1HB       SER   8  14.444   0.042 -13.267
   60    HG   SER   8           HG       SER   8  13.494   1.892 -14.557
   61    HA   PRO   9           HA       PRO   9  12.195  -4.489 -14.335
   62   1HB   PRO   9          2HB       PRO   9  15.067  -4.994 -14.687
   63   2HB   PRO   9          1HB       PRO   9  13.701  -5.633 -15.585
   64   1HG   PRO   9          2HG       PRO   9  15.266  -3.814 -16.724
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.706 -16.935
   66   1HD   PRO   9          1HD       PRO   9  15.269  -2.168 -14.991
   67   2HD   PRO   9          2HD       PRO   9  14.046  -1.540 -16.073
   68    H    GLY  10           H        GLY  10  12.402  -6.055 -12.856
   69   1HA   GLY  10          2HA       GLY  10  13.702  -5.350 -10.325
   70   2HA   GLY  10          1HA       GLY  10  12.398  -6.526 -10.541
   71    H    ASP  11           H        ASP  11  13.970  -8.173  -9.355
   72    HA   ASP  11           HA       ASP  11  16.402  -8.727 -10.873
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.365  -9.171
   74   2HB   ASP  11          1HB       ASP  11  16.353  -8.884  -8.381
   75    H    GLY  12           H        GLY  12  13.236  -9.675 -11.216
   76   1HA   GLY  12          2HA       GLY  12  12.273 -11.204 -12.648
   77   2HA   GLY  12          1HA       GLY  12  13.901 -11.646 -13.186
   78    H    ARG  13           H        ARG  13  13.568 -12.072  -9.752
   79    HA   ARG  13           HA       ARG  13  12.730 -14.857 -10.202
   80   1HB   ARG  13          2HB       ARG  13  15.051 -14.302  -8.383
   81   2HB   ARG  13          1HB       ARG  13  14.617 -15.800  -9.218
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.963 -11.270
   83   2HG   ARG  13          1HG       ARG  13  15.850 -13.397 -10.515
   84   1HD   ARG  13          2HD       ARG  13  17.938 -14.356 -10.543
   85   2HD   ARG  13          1HD       ARG  13  17.369 -14.839  -8.938
   86    HE   ARG  13           HE       ARG  13  16.907 -17.032  -9.825
   87   1HH1  ARG  13          1HH1      ARG  13  18.197 -15.233 -12.843
   88   2HH1  ARG  13          2HH1      ARG  13  19.703 -15.784 -12.190
   89   1HH2  ARG  13          1HH2      ARG  13  17.672 -18.713 -11.201
   90   2HH2  ARG  13          2HH2      ARG  13  18.635 -18.327 -12.589
   91    H    THR  14           H        THR  14  12.901 -12.176  -7.903
   92    HA   THR  14           HA       THR  14  11.726 -13.893  -5.804
   93    HB   THR  14           HB       THR  14  12.786 -11.053  -5.376
   94    HG1  THR  14           HG1      THR  14  14.552 -12.027  -6.113
   95   1HG2  THR  14          1HG2      THR  14  12.296 -13.321  -3.518
   96   2HG2  THR  14          2HG2      THR  14  11.881 -11.615  -3.351
   97   3HG2  THR  14          3HG2      THR  14  13.559 -12.136  -3.191
   98    H    PHE  15           H        PHE  15   9.637 -13.947  -6.443
   99    HA   PHE  15           HA       PHE  15   8.162 -11.406  -6.742
  100   1HB   PHE  15          2HB       PHE  15   7.407 -14.236  -7.450
  101   2HB   PHE  15          1HB       PHE  15   6.391 -12.807  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.945 -11.193  -9.435
  103    HD2  PHE  15           HD2      PHE  15   9.293 -14.723  -8.926
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.858 -11.648
  105    HE2  PHE  15           HE2      PHE  15  10.270 -14.359 -11.157
  106    HZ   PHE  15           HZ       PHE  15   9.599 -12.445 -12.505
  107    HA   PRO  16           HA       PRO  16   6.582 -11.998  -2.682
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.530  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.841  -9.829  -2.630
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.092  -5.200
  111   2HG   PRO  16          1HG       PRO  16   5.229  -8.736  -4.652
  112   1HD   PRO  16          1HD       PRO  16   6.217 -10.464  -6.438
  113   2HD   PRO  16          2HD       PRO  16   7.246  -9.796  -5.188
  114    H    LYS  17           H        LYS  17   5.299 -13.160  -1.505
  115    HA   LYS  17           HA       LYS  17   3.409 -14.927  -2.909
  116   1HB   LYS  17          2HB       LYS  17   5.300 -15.563  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.167 -16.702  -1.347
  118   1HG   LYS  17          2HG       LYS  17   6.217 -15.321  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.666 -16.743  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.454 -18.131  -3.361
  121   2HD   LYS  17          1HD       LYS  17   4.099 -16.993  -3.456
  122   1HE   LYS  17          2HE       LYS  17   6.459 -16.407  -5.140
  123   2HE   LYS  17          1HE       LYS  17   5.469 -17.804  -5.592
  124   1HZ   LYS  17          1HZ       LYS  17   4.770 -15.767  -6.651
  125   2HZ   LYS  17          2HZ       LYS  17   4.465 -15.075  -5.137
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.424  -5.664
  127    H    ARG  18           H        ARG  18   1.603 -15.580  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.732   0.103
  129   1HB   ARG  18          2HB       ARG  18  -0.557 -15.878  -0.970
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.687   0.495
  131   1HG   ARG  18          2HG       ARG  18  -1.227 -14.883   1.778
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.488   0.237
  133   1HD   ARG  18          2HD       ARG  18  -3.315 -15.944   1.818
  134   2HD   ARG  18          1HD       ARG  18  -3.129 -16.548   0.164
  135    HE   ARG  18           HE       ARG  18  -1.064 -17.633   1.570
  136   1HH1  ARG  18          2HH1      ARG  18  -4.657 -18.504   1.492
  137   2HH1  ARG  18          1HH1      ARG  18  -4.459 -18.843   3.179
  138   1HH2  ARG  18          2HH2      ARG  18  -1.542 -19.659   3.427
  139   2HH2  ARG  18          1HH2      ARG  18  -1.805 -20.427   1.897
  140    H    GLY  19           H        GLY  19   0.549 -13.147   2.148
  141   1HA   GLY  19          2HA       GLY  19   0.936 -13.448   4.429
  142   2HA   GLY  19          1HA       GLY  19   1.904 -14.879   4.044
  143    H    GLN  20           H        GLN  20   3.267 -12.976   1.914
  144    HA   GLN  20           HA       GLN  20   5.253 -11.989   3.785
  145   1HB   GLN  20          2HB       GLN  20   5.101 -11.879   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.432 -11.204   1.721
  147   1HG   GLN  20          2HG       GLN  20   6.843 -13.491   2.670
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.124   1.569
  149   1HE2  GLN  20          1HE2      GLN  20   8.885 -13.777   1.914
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.642   0.258
  151    H    THR  21           H        THR  21   5.898  -9.934   4.063
  152    HA   THR  21           HA       THR  21   3.948  -7.848   3.444
  153    HB   THR  21           HB       THR  21   6.487  -7.829   5.134
  154    HG1  THR  21           HG1      THR  21   5.081  -8.527   6.606
  155   1HG2  THR  21          1HG2      THR  21   4.527  -5.599   4.683
  156   2HG2  THR  21          2HG2      THR  21   6.269  -5.594   4.396
  157   3HG2  THR  21          3HG2      THR  21   5.646  -5.683   6.043
  158    H    CYS  22           H        CYS  22   4.053  -6.679   1.689
  159    HA   CYS  22           HA       CYS  22   6.559  -6.386   0.225
  160   1HB   CYS  22          2HB       CYS  22   3.813  -5.362  -0.486
  161   2HB   CYS  22          1HB       CYS  22   5.233  -5.434  -1.545
  162    HG   CYS  22           HG       CYS  22   4.730  -7.766  -2.075
  163    H    VAL  23           H        VAL  23   7.677  -4.552   0.162
  164    HA   VAL  23           HA       VAL  23   6.771  -2.297   1.836
  165    HB   VAL  23           HB       VAL  23   9.632  -3.180   1.169
  166   1HG1  VAL  23          1HG1      VAL  23   8.493  -0.920   2.757
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.948   1.693
  168   3HG1  VAL  23          3HG1      VAL  23   9.996  -1.663   3.301
  169   1HG2  VAL  23          1HG2      VAL  23   7.797  -3.856   3.414
  170   2HG2  VAL  23          2HG2      VAL  23   9.510  -3.641   3.772
  171   3HG2  VAL  23          3HG2      VAL  23   9.000  -4.855   2.599
  172    H    VAL  24           H        VAL  24   6.137  -0.648   0.303
  173    HA   VAL  24           HA       VAL  24   7.581  -0.658  -2.263
  174    HB   VAL  24           HB       VAL  24   5.484  -0.200  -3.508
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.631  -1.778
  176   2HG1  VAL  24          2HG1      VAL  24   6.177  -2.583  -3.107
  177   3HG1  VAL  24          3HG1      VAL  24   4.459  -2.363  -3.429
  178   1HG2  VAL  24          1HG2      VAL  24   3.269  -0.454  -2.326
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.958  -1.799
  180   3HG2  VAL  24          3HG2      VAL  24   4.142  -0.491  -0.794
  181    H    HIS  25           H        HIS  25   7.790   1.373  -3.358
  182    HA   HIS  25           HA       HIS  25   6.699   3.596  -1.767
  183   1HB   HIS  25          2HB       HIS  25   9.116   3.369  -3.379
  184   2HB   HIS  25          1HB       HIS  25   8.118   4.724  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.081   5.443  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.970   4.836  -2.107
  187    HE1  HIS  25           HE1      HIS  25   8.512   6.540   0.826
  188    HE2  HIS  25           HE2      HIS  25  10.843   6.126   0.049
  189    H    TYR  26           H        TYR  26   5.065   5.001  -2.882
  190    HA   TYR  26           HA       TYR  26   4.445   4.246  -5.633
  191   1HB   TYR  26          2HB       TYR  26   2.139   3.706  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.742  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.748   5.510  -4.440
  194    HD2  TYR  26           HD2      TYR  26   2.893   3.061  -1.679
  195    HE1  TYR  26           HE1      TYR  26  -0.612   6.408  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.550   3.981   0.195
  197    HH   TYR  26           HH       TYR  26  -0.126   6.682   0.102
  198    H    THR  27           H        THR  27   3.221   5.733  -6.795
  199    HA   THR  27           HA       THR  27   2.335   8.163  -5.406
  200    HB   THR  27           HB       THR  27   3.483   8.077  -8.194
  201    HG1  THR  27           HG1      THR  27   4.356   8.924  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.781  -8.528
  203   2HG2  THR  27          2HG2      THR  27   3.188  10.688  -7.507
  204   3HG2  THR  27          3HG2      THR  27   1.737   9.972  -6.805
  205    H    GLY  28           H        GLY  28   0.073   8.085  -5.749
  206   1HA   GLY  28          2HA       GLY  28  -1.088   6.460  -7.921
  207   2HA   GLY  28          1HA       GLY  28  -1.923   6.973  -6.445
  208    H    MET  29           H        MET  29  -2.116   7.366  -9.513
  209    HA   MET  29           HA       MET  29  -2.906  10.190  -9.488
  210   1HB   MET  29          2HB       MET  29  -1.480   8.727 -11.719
  211   2HB   MET  29          1HB       MET  29  -2.184  10.343 -11.858
  212   1HG   MET  29          2HG       MET  29  -0.600  11.288 -10.509
  213   2HG   MET  29          1HG       MET  29  -0.178   9.743  -9.751
  214   1HE   MET  29          1HE       MET  29   0.794   8.008 -10.620
  215   2HE   MET  29          2HE       MET  29   2.360   8.218 -11.403
  216   3HE   MET  29          3HE       MET  29   0.961   7.703 -12.348
  217    H    LEU  30           H        LEU  30  -4.550  10.704 -10.718
  218    HA   LEU  30           HA       LEU  30  -6.562   8.806 -11.485
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.615 -10.971
  220   2HB   LEU  30          1HB       LEU  30  -7.161  11.340 -12.384
  221    HG   LEU  30           HG       LEU  30  -8.958  10.997 -11.160
  222   1HD1  LEU  30          1HD1      LEU  30  -8.540   8.873 -10.285
  223   2HD1  LEU  30          2HD1      LEU  30  -8.873   9.872  -8.871
  224   3HD1  LEU  30          3HD1      LEU  30  -7.211   9.450  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.617  12.084  -8.844
  226   2HD2  LEU  30          2HD2      LEU  30  -8.464  13.011 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.018  12.446  -9.495
  228    H    GLU  31           H        GLU  31  -7.370   8.958 -13.976
  229    HA   GLU  31           HA       GLU  31  -5.215   8.503 -15.715
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.085 -16.064
  231   2HB   GLU  31          1HB       GLU  31  -7.057   8.987 -17.474
  232   1HG   GLU  31          2HG       GLU  31  -6.309   6.759 -16.613
  233   2HG   GLU  31          1HG       GLU  31  -7.627   6.865 -15.434
  234    H    ASP  32           H        ASP  32  -6.495  11.596 -14.898
  235    HA   ASP  32           HA       ASP  32  -5.307  12.763 -17.294
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.857 -16.414
  237   2HB   ASP  32          1HB       ASP  32  -7.438  13.611 -16.365
  238    H    GLY  33           H        GLY  33  -3.818  11.614 -14.623
  239   1HA   GLY  33          2HA       GLY  33  -1.526  11.886 -14.229
  240   2HA   GLY  33          1HA       GLY  33  -1.618  13.506 -14.936
  241    H    LYS  34           H        LYS  34  -4.144  13.639 -12.940
  242    HA   LYS  34           HA       LYS  34  -2.768  15.196 -11.019
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.190 -11.900
  244   2HB   LYS  34          1HB       LYS  34  -5.506  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.976  16.471  -9.966
  246   2HG   LYS  34          1HG       LYS  34  -5.697  16.691 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.722  14.716  -8.287
  248   2HD   LYS  34          1HD       LYS  34  -5.072  16.408  -7.891
  249   1HE   LYS  34          2HE       LYS  34  -7.007  14.533  -9.255
  250   2HE   LYS  34          1HE       LYS  34  -7.005  14.870  -7.517
  251   1HZ   LYS  34          1HZ       LYS  34  -8.075  16.371  -9.644
  252   2HZ   LYS  34          2HZ       LYS  34  -6.990  17.300  -8.737
  253   3HZ   LYS  34          3HZ       LYS  34  -8.312  16.535  -7.978
  254    H    LYS  35           H        LYS  35  -1.722  14.606  -9.322
  255    HA   LYS  35           HA       LYS  35  -1.546  11.908  -8.414
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.565  -8.492
  257   2HB   LYS  35          1HB       LYS  35  -0.489  14.442  -7.182
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.540  -5.702
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.725  -7.013
  260   1HD   LYS  35          2HD       LYS  35   2.379  12.751  -5.539
  261   2HD   LYS  35          1HD       LYS  35   2.365  13.635  -7.074
  262   1HE   LYS  35          2HE       LYS  35   0.922  15.361  -6.034
  263   2HE   LYS  35          1HE       LYS  35   1.033  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.281  14.954  -4.340
  265   2HZ   LYS  35          2HZ       LYS  35   2.541  16.414  -4.771
  266   3HZ   LYS  35          3HZ       LYS  35   3.381  15.498  -5.938
  267    H    PHE  36           H        PHE  36  -2.815  11.064  -6.760
  268    HA   PHE  36           HA       PHE  36  -4.245  13.051  -5.102
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.141  -4.494
  270   2HB   PHE  36          1HB       PHE  36  -5.796  11.610  -6.201
  271    HD1  PHE  36           HD1      PHE  36  -4.653   8.995  -3.834
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.542   6.621  -4.509
  274    HE2  PHE  36           HE2      PHE  36  -5.278   7.712  -8.564
  275    HZ   PHE  36           HZ       PHE  36  -4.859   5.986  -6.865
  276    H    ASP  37           H        ASP  37  -1.761  10.657  -4.990
  277    HA   ASP  37           HA       ASP  37  -1.055  11.468  -2.360
  278   1HB   ASP  37          2HB       ASP  37  -2.942   9.814  -1.834
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.555  -2.454
  280    H    SER  38           H        SER  38   0.978  10.467  -1.659
  281    HA   SER  38           HA       SER  38   2.321   8.514  -3.298
  282   1HB   SER  38          2HB       SER  38   2.764  10.582  -4.606
  283   2HB   SER  38          1HB       SER  38   3.449  11.334  -3.158
  284    HG   SER  38           HG       SER  38   5.034  10.354  -4.566
  285    H    SER  39           H        SER  39   3.580   7.305  -1.913
  286    HA   SER  39           HA       SER  39   4.090   8.271   0.753
  287   1HB   SER  39          2HB       SER  39   5.451   6.189   0.992
  288   2HB   SER  39          1HB       SER  39   3.791   5.894   0.458
  289    HG   SER  39           HG       SER  39   4.880   4.729  -0.965
  290    H    ARG  40           H        ARG  40   5.672   8.414  -2.310
  291    HA   ARG  40           HA       ARG  40   8.346   8.699  -1.495
  292   1HB   ARG  40          2HB       ARG  40   6.896   9.775  -3.937
  293   2HB   ARG  40          1HB       ARG  40   8.646   9.873  -3.706
  294   1HG   ARG  40          2HG       ARG  40   8.669   7.373  -3.553
  295   2HG   ARG  40          1HG       ARG  40   6.968   7.398  -4.046
  296   1HD   ARG  40          2HD       ARG  40   7.654   8.458  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.346   8.286  -5.688
  298    HE   ARG  40           HE       ARG  40   9.209   5.986  -6.100
  299   1HH1  ARG  40          1HH1      ARG  40   5.579   6.786  -6.202
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.968  -7.892
  301   1HH2  ARG  40          1HH2      ARG  40   7.873   3.981  -6.855
  302   2HH2  ARG  40          2HH2      ARG  40   6.914   4.487  -8.209
  303    H    ASP  41           H        ASP  41   5.607  11.043  -1.764
  304    HA   ASP  41           HA       ASP  41   7.158  13.334  -1.091
  305   1HB   ASP  41          2HB       ASP  41   4.187  12.793  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.378  -0.523
  307    H    ARG  42           H        ARG  42   5.682  10.787   0.920
  308    HA   ARG  42           HA       ARG  42   6.301  12.310   3.320
  309   1HB   ARG  42          2HB       ARG  42   5.439   9.439   3.145
  310   2HB   ARG  42          1HB       ARG  42   5.371  10.509   4.551
  311   1HG   ARG  42          2HG       ARG  42   3.750  11.916   3.344
  312   2HG   ARG  42          1HG       ARG  42   3.758  10.733   2.025
  313   1HD   ARG  42          2HD       ARG  42   3.173  10.027   4.870
  314   2HD   ARG  42          1HD       ARG  42   1.919  10.548   3.736
  315    HE   ARG  42           HE       ARG  42   3.115   7.957   3.944
  316   1HH1  ARG  42          1HH1      ARG  42   0.345   9.703   2.080
  317   2HH1  ARG  42          2HH1      ARG  42   1.578   9.539   0.875
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.329   2.839
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.788   1.327
  320    H    ASN  43           H        ASN  43   7.997  10.295   1.243
  321    HA   ASN  43           HA       ASN  43   9.990   9.199   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.556  11.533   2.023
  323   2HB   ASN  43          1HB       ASN  43  10.442  10.968   3.695
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.104   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.588   9.743   1.390
  326    H    LYS  44           H        LYS  44   7.798   7.928   2.743
  327    HA   LYS  44           HA       LYS  44   9.468   6.181   4.409
  328   1HB   LYS  44          2HB       LYS  44   8.224   7.817   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.711   7.206   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.014   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.598   6.829
  332   1HD   LYS  44          2HD       LYS  44   7.582   7.121   8.278
  333   2HD   LYS  44          1HD       LYS  44   6.034   6.934   7.436
  334   1HE   LYS  44          2HE       LYS  44   7.385   4.697   8.962
  335   2HE   LYS  44          1HE       LYS  44   6.179   5.778   9.677
  336   1HZ   LYS  44          1HZ       LYS  44   5.866   3.723   7.645
  337   2HZ   LYS  44          2HZ       LYS  44   4.809   5.044   7.654
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.033   9.022
  339    HA   PRO  45           HA       PRO  45   7.454   3.618   1.208
  340   1HB   PRO  45          2HB       PRO  45   8.336   1.317   2.814
  341   2HB   PRO  45          1HB       PRO  45   8.651   1.689   1.130
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.989   2.946
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.160   1.650
  344   1HD   PRO  45          1HD       PRO  45   9.468   3.381   4.525
  345   2HD   PRO  45          2HD       PRO  45  10.321   4.576   3.570
  346    H    PHE  46           H        PHE  46   5.603   2.323   1.037
  347    HA   PHE  46           HA       PHE  46   3.983   2.332   3.475
  348   1HB   PHE  46          2HB       PHE  46   3.005   3.314   1.482
  349   2HB   PHE  46          1HB       PHE  46   3.340   1.840   0.559
  350    HD1  PHE  46           HD1      PHE  46   1.391   3.118   3.442
  351    HD2  PHE  46           HD2      PHE  46   1.766   0.211   0.358
  352    HE1  PHE  46           HE1      PHE  46  -0.841   2.247   3.983
  353    HE2  PHE  46           HE2      PHE  46  -0.462  -0.654   0.917
  354    HZ   PHE  46           HZ       PHE  46  -1.778   0.358   2.732
  355    H    LYS  47           H        LYS  47   3.423   0.256   4.456
  356    HA   LYS  47           HA       LYS  47   4.540  -2.088   3.051
  357   1HB   LYS  47          2HB       LYS  47   3.966  -1.642   5.984
  358   2HB   LYS  47          1HB       LYS  47   4.454  -3.195   5.294
  359   1HG   LYS  47          2HG       LYS  47   6.483  -2.131   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.001  -0.633   5.254
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.683   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.493  -3.262   6.665
  363   1HE   LYS  47          2HE       LYS  47   8.468  -2.422   5.551
  364   2HE   LYS  47          1HE       LYS  47   8.132  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.243  -2.000   8.399
  366   2HZ   LYS  47          2HZ       LYS  47   9.622  -1.385   7.634
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.046   7.526
  368    H    PHE  48           H        PHE  48   3.031  -3.772   2.432
  369    HA   PHE  48           HA       PHE  48   0.643  -3.987   4.111
  370   1HB   PHE  48          2HB       PHE  48  -0.872  -4.237   2.306
  371   2HB   PHE  48          1HB       PHE  48   0.050  -2.759   1.980
  372    HD1  PHE  48           HD1      PHE  48   1.792  -2.773   0.223
  373    HD2  PHE  48           HD2      PHE  48  -0.909  -6.024   0.770
  374    HE1  PHE  48           HE1      PHE  48   2.258  -3.558  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.439  -6.811  -1.533
  376    HZ   PHE  48           HZ       PHE  48   1.147  -5.556  -2.944
  377    H    MET  49           H        MET  49  -0.031  -6.290   4.274
  378    HA   MET  49           HA       MET  49   1.872  -8.238   3.221
  379   1HB   MET  49          2HB       MET  49   1.321  -8.653   5.477
  380   2HB   MET  49          1HB       MET  49  -0.401  -8.377   5.187
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.502   4.182
  382   2HG   MET  49          1HG       MET  49   1.092 -10.765   4.147
  383   1HE   MET  49          1HE       MET  49   1.596 -10.935   8.132
  384   2HE   MET  49          2HE       MET  49   1.276  -9.410   7.306
  385   3HE   MET  49          3HE       MET  49   2.403 -10.574   6.607
  386    H    LEU  50           H        LEU  50   1.556  -9.321   1.510
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.100  -0.214
  388   1HB   LEU  50          2HB       LEU  50   1.838 -10.577  -0.104
  389   2HB   LEU  50          1HB       LEU  50   0.514 -11.617  -0.635
  390    HG   LEU  50           HG       LEU  50   1.997  -9.556  -2.080
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.297  -2.467
  392   2HD1  LEU  50          2HD1      LEU  50   2.461 -11.927  -2.291
  393   3HD1  LEU  50          3HD1      LEU  50   1.597 -11.431  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.266  -9.496  -3.780
  395   2HD2  LEU  50          2HD2      LEU  50  -0.225  -8.668  -2.301
  396   3HD2  LEU  50          3HD2      LEU  50  -0.850 -10.277  -2.661
  397    H    GLY  51           H        GLY  51  -2.500 -10.135  -0.243
  398   1HA   GLY  51          2HA       GLY  51  -3.966 -11.914  -0.223
  399   2HA   GLY  51          1HA       GLY  51  -2.816 -12.829   0.766
  400    H    LYS  52           H        LYS  52  -3.037  -9.957   2.331
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.122   4.260
  402   1HB   LYS  52          2HB       LYS  52  -2.633  -9.864   4.490
  403   2HB   LYS  52          1HB       LYS  52  -3.669  -8.436   4.367
  404   1HG   LYS  52          2HG       LYS  52  -4.948  -9.342   6.363
  405   2HG   LYS  52          1HG       LYS  52  -3.627 -10.506   6.556
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.611   6.084
  407   2HD   LYS  52          1HD       LYS  52  -3.413  -7.508   6.196
  408   1HE   LYS  52          2HE       LYS  52  -3.791  -8.459   8.459
  409   2HE   LYS  52          1HE       LYS  52  -2.180  -9.179   8.302
  410   1HZ   LYS  52          1HZ       LYS  52  -2.522  -6.809   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.380   7.620
  412   3HZ   LYS  52          3HZ       LYS  52  -1.188  -7.186   8.286
  413    H    GLN  53           H        GLN  53  -5.464  -9.221   1.593
  414    HA   GLN  53           HA       GLN  53  -7.281  -8.072   0.877
  415   1HB   GLN  53          2HB       GLN  53  -8.463  -9.203   3.401
  416   2HB   GLN  53          1HB       GLN  53  -9.382  -8.293   2.195
  417   1HG   GLN  53          2HG       GLN  53  -9.298 -10.000   0.666
  418   2HG   GLN  53          1HG       GLN  53  -7.927 -10.783   1.470
  419   1HE2  GLN  53          1HE2      GLN  53  -9.752 -12.935   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.730   3.276
  421    H    GLU  54           H        GLU  54  -5.348  -6.569   2.308
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.584   3.518
  423   1HB   GLU  54          2HB       GLU  54  -5.240  -3.760   4.725
  424   2HB   GLU  54          1HB       GLU  54  -5.553  -5.464   5.078
  425   1HG   GLU  54          2HG       GLU  54  -3.732  -6.107   3.601
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.400   3.248
  427    H    VAL  55           H        VAL  55  -5.459  -5.033   0.730
  428    HA   VAL  55           HA       VAL  55  -5.543  -2.135   0.238
  429    HB   VAL  55           HB       VAL  55  -3.882  -2.656  -1.664
  430   1HG1  VAL  55          1HG1      VAL  55  -3.277  -2.882   1.283
  431   2HG1  VAL  55          2HG1      VAL  55  -3.215  -1.440   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.006  -2.710   0.071
  433   1HG2  VAL  55          1HG2      VAL  55  -3.253  -5.155  -0.162
  434   2HG2  VAL  55          2HG2      VAL  55  -2.604  -4.582  -1.698
  435   3HG2  VAL  55          3HG2      VAL  55  -4.279  -5.126  -1.597
  436    H    ILE  56           H        ILE  56  -5.906  -1.830  -2.309
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.119  -2.876
  438    HB   ILE  56           HB       ILE  56  -8.229  -1.807  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.912  -0.390  -3.802
  440   2HG1  ILE  56          1HG1      ILE  56  -5.702  -1.648  -5.033
  441   1HG2  ILE  56          1HG2      ILE  56  -9.528  -0.597  -3.669
  442   2HG2  ILE  56          2HG2      ILE  56  -8.131   0.475  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.378  -0.755  -2.342
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.250  -6.672
  445   2HD1  ILE  56          2HD1      ILE  56  -5.491   0.605  -5.993
  446   3HD1  ILE  56          3HD1      ILE  56  -7.124   0.996  -5.448
  447    H    ARG  57           H        ARG  57  -8.929  -4.372  -4.684
  448    HA   ARG  57           HA       ARG  57  -7.301  -6.655  -4.957
  449   1HB   ARG  57          2HB       ARG  57  -9.778  -6.631  -5.312
  450   2HB   ARG  57          1HB       ARG  57  -9.544  -5.687  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.333  -7.515  -7.790
  452   2HG   ARG  57          1HG       ARG  57  -8.506  -8.460  -6.302
  453   1HD   ARG  57          2HD       ARG  57 -10.926  -8.588  -6.657
  454   2HD   ARG  57          1HD       ARG  57 -10.767  -7.626  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.771  -8.133
  456   1HH1  ARG  57          1HH1      ARG  57 -12.265  -9.326  -9.730
  457   2HH1  ARG  57          2HH1      ARG  57 -12.630 -10.669  -8.699
  458   1HH2  ARG  57          1HH2      ARG  57  -9.482 -11.968  -9.050
  459   2HH2  ARG  57          2HH2      ARG  57 -10.210 -11.504 -10.550
  460    H    GLY  58           H        GLY  58  -7.318  -3.873  -7.250
  461   1HA   GLY  58          2HA       GLY  58  -5.786  -5.257  -9.176
  462   2HA   GLY  58          1HA       GLY  58  -5.914  -3.499  -9.003
  463    H    TRP  59           H        TRP  59  -4.852  -3.702  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.019  -3.685  -6.666
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.134  -4.345
  466   2HB   TRP  59          1HB       TRP  59  -2.168  -3.716  -3.948
  467    HD1  TRP  59           HD1      TRP  59  -3.604  -1.157  -6.510
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.903  -6.378
  469    HE3  TRP  59           HE3      TRP  59  -0.322  -2.655  -2.814
  470    HZ2  TRP  59           HZ2      TRP  59   0.090   1.799  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.154
  472    HH2  TRP  59           HH2      TRP  59   1.657   1.073  -3.214
  473    H    GLU  60           H        GLU  60  -3.998  -5.884  -4.553
  474    HA   GLU  60           HA       GLU  60  -2.182  -7.808  -3.913
  475   1HB   GLU  60          2HB       GLU  60  -4.937  -8.445  -4.979
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.488  -3.961
  477   1HG   GLU  60          2HG       GLU  60  -4.904  -6.876  -2.951
  478   2HG   GLU  60          1HG       GLU  60  -5.969  -8.291  -2.984
  479    H    GLU  61           H        GLU  61  -3.993  -7.515  -6.943
  480    HA   GLU  61           HA       GLU  61  -2.771  -9.827  -8.164
  481   1HB   GLU  61          2HB       GLU  61  -4.418  -7.607  -9.393
  482   2HB   GLU  61          1HB       GLU  61  -4.040  -9.166 -10.139
  483   1HG   GLU  61          2HG       GLU  61  -5.246  -9.498  -7.529
  484   2HG   GLU  61          1HG       GLU  61  -6.275  -8.538  -8.605
  485    H    GLY  62           H        GLY  62  -2.126  -6.341  -8.334
  486   1HA   GLY  62          2HA       GLY  62  -0.508  -6.785 -10.673
  487   2HA   GLY  62          1HA       GLY  62  -0.757  -5.248  -9.833
  488    H    VAL  63           H        VAL  63   0.134  -5.861  -7.306
  489    HA   VAL  63           HA       VAL  63   2.943  -5.683  -7.764
  490    HB   VAL  63           HB       VAL  63   1.302  -5.995  -5.198
  491   1HG1  VAL  63          1HG1      VAL  63   3.647  -6.697  -4.933
  492   2HG1  VAL  63          2HG1      VAL  63   3.350  -5.180  -4.083
  493   3HG1  VAL  63          3HG1      VAL  63   4.186  -5.171  -5.634
  494   1HG2  VAL  63          1HG2      VAL  63   0.933  -3.779  -6.426
  495   2HG2  VAL  63          2HG2      VAL  63   2.679  -3.533  -6.449
  496   3HG2  VAL  63          3HG2      VAL  63   1.807  -3.530  -4.916
  497    H    ALA  64           H        ALA  64   0.822  -8.473  -7.070
  498    HA   ALA  64           HA       ALA  64   2.870 -10.243  -6.294
  499   1HB   ALA  64          1HB       ALA  64   0.456 -10.984  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.405 -10.690  -6.179
  501   3HB   ALA  64          3HB       ALA  64   1.386 -12.007  -6.820
  502    H    GLN  65           H        GLN  65   2.108  -8.871  -9.375
  503    HA   GLN  65           HA       GLN  65   3.584 -10.842 -10.888
  504   1HB   GLN  65          2HB       GLN  65   2.247  -8.223 -11.564
  505   2HB   GLN  65          1HB       GLN  65   3.243  -9.099 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.822 -11.072 -12.541
  507   2HG   GLN  65          1HG       GLN  65   0.884 -10.309 -11.243
  508   1HE2  GLN  65          1HE2      GLN  65  -1.178  -9.487 -12.158
  509   2HE2  GLN  65          2HE2      GLN  65  -0.902  -8.128 -13.191
  510    H    MET  66           H        MET  66   4.752  -8.572  -8.816
  511    HA   MET  66           HA       MET  66   6.777  -7.620 -10.720
  512   1HB   MET  66          2HB       MET  66   5.986  -6.535  -8.024
  513   2HB   MET  66          1HB       MET  66   7.237  -5.863  -9.079
  514   1HG   MET  66          2HG       MET  66   5.598  -5.381 -10.782
  515   2HG   MET  66          1HG       MET  66   4.328  -6.153  -9.816
  516   1HE   MET  66          1HE       MET  66   7.231  -3.851  -8.686
  517   2HE   MET  66          2HE       MET  66   6.480  -2.254  -8.657
  518   3HE   MET  66          3HE       MET  66   6.730  -3.084 -10.193
  519    H    SER  67           H        SER  67   8.935  -7.974 -10.279
  520    HA   SER  67           HA       SER  67   9.649  -9.757  -8.078
  521   1HB   SER  67          2HB       SER  67  11.857  -9.704  -9.291
  522   2HB   SER  67          1HB       SER  67  10.496 -10.435 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.800 -11.555
  524    H    VAL  68           H        VAL  68  11.482  -9.147  -6.636
  525    HA   VAL  68           HA       VAL  68  11.309  -6.545  -5.629
  526    HB   VAL  68           HB       VAL  68  13.513  -8.621  -5.346
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.417  -3.308
  528   2HG1  VAL  68          2HG1      VAL  68  12.989  -6.167  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.359  -6.391  -4.732
  530   1HG2  VAL  68          1HG2      VAL  68  11.725  -9.651  -4.480
  531   2HG2  VAL  68          2HG2      VAL  68  10.883  -8.142  -4.129
  532   3HG2  VAL  68          3HG2      VAL  68  12.173  -8.699  -3.065
  533    H    GLY  69           H        GLY  69  12.137  -4.762  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.884  -3.301  -6.746
  535   2HA   GLY  69          1HA       GLY  69  14.459  -4.530  -7.883
  536    H    GLN  70           H        GLN  70  11.269  -4.687  -8.435
  537    HA   GLN  70           HA       GLN  70  11.691  -3.131 -10.840
  538   1HB   GLN  70          2HB       GLN  70  10.813  -5.488 -10.676
  539   2HB   GLN  70          1HB       GLN  70   9.325  -4.776 -10.035
  540   1HG   GLN  70          2HG       GLN  70   9.149  -3.445 -12.106
  541   2HG   GLN  70          1HG       GLN  70  10.538  -4.345 -12.742
  542   1HE2  GLN  70          2HE2      GLN  70   9.493  -7.239 -12.035
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.874 -11.427
  544    H    ARG  71           H        ARG  71  10.582  -1.587 -11.625
  545    HA   ARG  71           HA       ARG  71   8.696  -0.178  -9.844
  546   1HB   ARG  71          2HB       ARG  71  10.804   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.688   1.054 -11.765
  548   1HG   ARG  71          2HG       ARG  71   8.899   2.570 -11.794
  549   2HG   ARG  71          1HG       ARG  71   8.397   2.160 -10.145
  550   1HD   ARG  71          2HD       ARG  71  10.282   3.310  -9.214
  551   2HD   ARG  71          1HD       ARG  71  10.989   3.553 -10.820
  552    HE   ARG  71           HE       ARG  71   8.426   4.696 -10.781
  553   1HH1  ARG  71          2HH1      ARG  71  11.613   5.179  -9.288
  554   2HH1  ARG  71          1HH1      ARG  71  11.463   6.905  -9.285
  555   1HH2  ARG  71          1HH2      ARG  71   8.121   6.876 -10.464
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.985
  557    H    ALA  72           H        ALA  72   6.801  -0.069 -10.813
  558    HA   ALA  72           HA       ALA  72   6.469  -0.151 -13.714
  559   1HB   ALA  72          1HB       ALA  72   5.011  -2.006 -13.695
  560   2HB   ALA  72          2HB       ALA  72   4.895  -1.996 -11.936
  561   3HB   ALA  72          3HB       ALA  72   6.392  -2.504 -12.717
  562    H    LYS  73           H        LYS  73   4.461   0.425 -14.507
  563    HA   LYS  73           HA       LYS  73   2.806   2.084 -12.736
  564   1HB   LYS  73          2HB       LYS  73   3.831   3.035 -14.745
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.821 -15.723
  566   1HG   LYS  73          2HG       LYS  73   0.827   2.876 -14.911
  567   2HG   LYS  73          1HG       LYS  73   1.829   4.218 -14.335
  568   1HD   LYS  73          2HD       LYS  73   2.965   4.300 -16.495
  569   2HD   LYS  73          1HD       LYS  73   1.971   2.953 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.016   4.448 -16.678
  571   2HE   LYS  73          1HE       LYS  73   1.147   5.769 -16.499
  572   1HZ   LYS  73          1HZ       LYS  73   0.807   4.007 -18.847
  573   2HZ   LYS  73          2HZ       LYS  73   2.038   5.156 -18.683
  574   3HZ   LYS  73          3HZ       LYS  73   0.409   5.648 -18.752
  575    H    LEU  74           H        LEU  74   0.910   1.250 -12.075
  576    HA   LEU  74           HA       LEU  74  -0.136  -1.173 -13.368
  577   1HB   LEU  74          2HB       LEU  74   0.213  -0.093 -10.656
  578   2HB   LEU  74          1HB       LEU  74  -1.340  -0.881 -10.937
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.001 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.990  -3.482 -11.265
  581   2HD1  LEU  74          2HD1      LEU  74   2.323  -1.757 -11.425
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.587 -12.650
  583   1HD2  LEU  74          1HD2      LEU  74  -0.467  -1.889  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.230  -1.448  -9.036
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.145  -8.938
  586    H    THR  75           H        THR  75  -1.870  -0.573 -14.789
  587    HA   THR  75           HA       THR  75  -3.497   1.772 -14.022
  588    HB   THR  75           HB       THR  75  -3.434   0.122 -16.597
  589    HG1  THR  75           HG1      THR  75  -1.652   1.267 -16.761
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.968 -17.627
  591   2HG2  THR  75          2HG2      THR  75  -4.844   2.695 -16.037
  592   3HG2  THR  75          3HG2      THR  75  -5.575   1.134 -16.412
  593    H    ILE  76           H        ILE  76  -5.455   1.333 -12.989
  594    HA   ILE  76           HA       ILE  76  -6.290  -1.484 -12.781
  595    HB   ILE  76           HB       ILE  76  -6.389   0.674 -10.636
  596   1HG1  ILE  76          2HG1      ILE  76  -4.507  -1.672 -10.945
  597   2HG1  ILE  76          1HG1      ILE  76  -4.085   0.026 -11.221
  598   1HG2  ILE  76          1HG2      ILE  76  -7.209  -2.170 -10.634
  599   2HG2  ILE  76          2HG2      ILE  76  -8.130  -0.726 -10.214
  600   3HG2  ILE  76          3HG2      ILE  76  -6.834  -1.283  -9.156
  601   1HD1  ILE  76          1HD1      ILE  76  -4.413  -1.467  -8.691
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.221  -8.707
  603   3HD1  ILE  76          3HD1      ILE  76  -3.267  -0.200  -9.126
  604    H    SER  77           H        SER  77  -8.341  -1.763 -13.534
  605    HA   SER  77           HA       SER  77 -10.076   0.347 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.733  -1.397 -14.643
  607   2HB   SER  77          1HB       SER  77 -10.163  -1.887 -15.294
  608    HG   SER  77           HG       SER  77 -11.683  -3.015 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.059   1.322 -10.425
  610   1HB   PRO  78          2HB       PRO  78 -14.777   1.356 -11.227
  611   2HB   PRO  78          1HB       PRO  78 -13.688   2.733 -11.184
  612   1HG   PRO  78          2HG       PRO  78 -14.507   1.056 -13.514
  613   2HG   PRO  78          1HG       PRO  78 -14.013   2.740 -13.488
  614   1HD   PRO  78          1HD       PRO  78 -12.360   0.789 -14.398
  615   2HD   PRO  78          2HD       PRO  78 -11.741   2.211 -13.584
  616    H    ASP  79           H        ASP  79 -13.479  -1.462 -12.054
  617    HA   ASP  79           HA       ASP  79 -14.744  -2.335  -9.643
  618   1HB   ASP  79          2HB       ASP  79 -15.146  -4.411 -10.854
  619   2HB   ASP  79          1HB       ASP  79 -15.489  -3.031 -11.909
  620    H    TYR  80           H        TYR  80 -11.545  -2.401 -10.612
  621    HA   TYR  80           HA       TYR  80 -10.754  -4.457  -8.686
  622   1HB   TYR  80          2HB       TYR  80  -9.559  -3.183 -11.069
  623   2HB   TYR  80          1HB       TYR  80  -8.480  -3.757  -9.787
  624    HD1  TYR  80           HD1      TYR  80 -11.502  -4.892 -11.642
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.877
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.201 -12.484
  627    HE2  TYR  80           HE2      TYR  80  -7.919  -8.146 -10.691
  628    HH   TYR  80           HH       TYR  80  -8.976  -9.434 -12.228
  629    H    ALA  81           H        ALA  81 -11.562  -1.443  -8.397
  630    HA   ALA  81           HA       ALA  81  -9.392  -0.749  -6.537
  631   1HB   ALA  81          1HB       ALA  81  -9.043   0.365  -8.763
  632   2HB   ALA  81          2HB       ALA  81  -9.309   1.509  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.616   1.142  -8.574
  634    H    TYR  82           H        TYR  82 -11.706   1.776  -7.021
  635    HA   TYR  82           HA       TYR  82 -13.144   0.959  -4.576
  636   1HB   TYR  82          2HB       TYR  82 -12.503   3.642  -5.852
  637   2HB   TYR  82          1HB       TYR  82 -13.464   3.449  -4.376
  638    HD1  TYR  82           HD1      TYR  82 -12.315   2.134  -2.428
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.940  -5.710
  640    HE1  TYR  82           HE1      TYR  82 -10.207   2.035  -1.125
  641    HE2  TYR  82           HE2      TYR  82  -8.141   3.838  -4.422
  642    HH   TYR  82           HH       TYR  82  -7.555   3.779  -1.855
  643    H    GLY  83           H        GLY  83 -13.804   0.861  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.707   0.432  -8.896
  645   2HA   GLY  83          1HA       GLY  83 -16.440   0.098  -7.320
  646    H    ALA  84           H        ALA  84 -18.268   0.983  -7.433
  647    HA   ALA  84           HA       ALA  84 -18.706   3.584  -8.635
  648   1HB   ALA  84          1HB       ALA  84 -20.323   1.691  -8.791
  649   2HB   ALA  84          2HB       ALA  84 -21.024   3.180  -8.156
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.863  -7.058
  651    H    THR  85           H        THR  85 -18.020   2.429  -5.346
  652    HA   THR  85           HA       THR  85 -19.182   4.738  -4.103
  653    HB   THR  85           HB       THR  85 -16.855   3.115  -3.033
  654    HG1  THR  85           HG1      THR  85 -19.571   2.454  -2.689
  655   1HG2  THR  85          1HG2      THR  85 -19.158   4.617  -1.812
  656   2HG2  THR  85          2HG2      THR  85 -17.432   4.850  -1.533
  657   3HG2  THR  85          3HG2      THR  85 -18.237   3.409  -0.916
  658    H    GLY  86           H        GLY  86 -15.913   4.003  -5.319
  659   1HA   GLY  86          2HA       GLY  86 -14.099   5.462  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.215   6.806  -5.305
  661    H    HIS  87           H        HIS  87 -13.166   7.510  -3.886
  662    HA   HIS  87           HA       HIS  87 -13.464   6.202  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.189   6.025  -2.258
  664   2HB   HIS  87          1HB       HIS  87 -11.086   7.793  -2.211
  665    HD1  HIS  87           HD1      HIS  87 -10.927   8.796   0.417
  666    HD2  HIS  87           HD2      HIS  87 -10.711   4.670  -0.092
  667    HE1  HIS  87           HE1      HIS  87 -10.104   7.850   2.597
  668    HE2  HIS  87           HE2      HIS  87 -10.002   5.371   2.223
  669    HA   PRO  88           HA       PRO  88 -15.772  10.118  -0.977
  670   1HB   PRO  88          2HB       PRO  88 -15.861  10.505   1.732
  671   2HB   PRO  88          1HB       PRO  88 -16.875   9.331   0.912
  672   1HG   PRO  88          2HG       PRO  88 -14.225   8.865   2.306
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.495
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.987   0.829
  675   2HD   PRO  88          2HD       PRO  88 -15.540   6.972   0.308
  676    H    GLY  89           H        GLY  89 -15.167  11.874  -1.573
  677   1HA   GLY  89          2HA       GLY  89 -14.151  13.913  -1.651
  678   2HA   GLY  89          1HA       GLY  89 -13.216  13.473  -0.213
  679    H    ILE  90           H        ILE  90 -12.042  11.022  -1.771
  680    HA   ILE  90           HA       ILE  90  -9.979  12.656  -3.119
  681    HB   ILE  90           HB       ILE  90  -9.842   9.884  -1.826
  682   1HG1  ILE  90          2HG1      ILE  90  -8.445  12.389  -0.969
  683   2HG1  ILE  90          1HG1      ILE  90 -10.098  12.030  -0.442
  684   1HG2  ILE  90          1HG2      ILE  90  -7.309  10.385  -1.932
  685   2HG2  ILE  90          2HG2      ILE  90  -7.712  11.628  -3.117
  686   3HG2  ILE  90          3HG2      ILE  90  -8.067   9.933  -3.459
  687   1HD1  ILE  90          1HD1      ILE  90  -9.335  10.708   1.163
  688   2HD1  ILE  90          2HD1      ILE  90  -7.695  11.180   0.726
  689   3HD1  ILE  90          3HD1      ILE  90  -8.424   9.749  -0.002
  690    H    ILE  91           H        ILE  91 -11.665   9.563  -3.636
  691    HA   ILE  91           HA       ILE  91 -10.634   9.708  -6.404
  692    HB   ILE  91           HB       ILE  91 -11.717   7.252  -4.977
  693   1HG1  ILE  91          2HG1      ILE  91  -9.603   7.975  -3.972
  694   2HG1  ILE  91          1HG1      ILE  91  -9.413   6.461  -4.873
  695   1HG2  ILE  91          1HG2      ILE  91 -10.552   6.111  -6.910
  696   2HG2  ILE  91          2HG2      ILE  91 -10.440   7.707  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.019   7.012  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.509   7.968  -5.200
  699   2HD1  ILE  91          2HD1      ILE  91  -8.593   9.197  -5.853
  700   3HD1  ILE  91          3HD1      ILE  91  -8.369   7.672  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.250  10.299  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.682   9.827  -9.877
  703   2HB   PRO  92          1HB       PRO  92 -15.346  11.254  -9.101
  704   1HG   PRO  92          2HG       PRO  92 -12.861  11.317 -10.115
  705   2HG   PRO  92          1HG       PRO  92 -13.211  12.132  -8.600
  706   1HD   PRO  92          1HD       PRO  92 -12.060   9.356  -8.999
  707   2HD   PRO  92          2HD       PRO  92 -11.421  10.652  -8.011
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.868
  709   1HB   PRO  93          2HB       PRO  93 -18.920   7.282  -9.560
  710   2HB   PRO  93          1HB       PRO  93 -19.088   6.342  -8.086
  711   1HG   PRO  93          2HG       PRO  93 -19.619   9.035  -8.232
  712   2HG   PRO  93          1HG       PRO  93 -19.150   8.221  -6.750
  713   1HD   PRO  93          1HD       PRO  93 -17.515   9.977  -8.524
  714   2HD   PRO  93          2HD       PRO  93 -17.370   9.713  -6.800
  715    H    HIS  94           H        HIS  94 -16.501   4.744  -9.377
  716    HA   HIS  94           HA       HIS  94 -15.944   3.694 -11.309
  717   1HB   HIS  94          2HB       HIS  94 -17.265   6.170 -12.563
  718   2HB   HIS  94          1HB       HIS  94 -16.932   4.653 -13.416
  719    HD1  HIS  94           HD1      HIS  94 -18.295   2.487 -12.154
  720    HD2  HIS  94           HD2      HIS  94 -19.606   6.359 -11.436
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.310 -11.165
  722    HE2  HIS  94           HE2      HIS  94 -21.352   4.658 -10.759
  723    H    ALA  95           H        ALA  95 -13.895   5.539 -10.142
  724    HA   ALA  95           HA       ALA  95 -12.523   6.636 -12.450
  725   1HB   ALA  95          1HB       ALA  95 -12.629   7.329  -9.871
  726   2HB   ALA  95          2HB       ALA  95 -11.237   7.692 -10.891
  727   3HB   ALA  95          3HB       ALA  95 -11.203   6.293  -9.818
  728    H    THR  96           H        THR  96 -10.925   5.698 -13.745
  729    HA   THR  96           HA       THR  96  -9.715   3.198 -13.010
  730    HB   THR  96           HB       THR  96  -9.159   5.171 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.419   3.811 -16.394
  732   1HG2  THR  96          1HG2      THR  96  -7.731   2.634 -14.647
  733   2HG2  THR  96          2HG2      THR  96  -7.065   4.252 -14.874
  734   3HG2  THR  96          3HG2      THR  96  -7.753   3.381 -16.245
  735    H    LEU  97           H        LEU  97  -7.695   3.077 -11.872
  736    HA   LEU  97           HA       LEU  97  -6.463   5.644 -11.104
  737   1HB   LEU  97          2HB       LEU  97  -6.522   2.945  -9.733
  738   2HB   LEU  97          1HB       LEU  97  -5.732   4.393  -9.101
  739    HG   LEU  97           HG       LEU  97  -8.696   3.976  -9.443
  740   1HD1  LEU  97          1HD1      LEU  97  -8.707   3.954  -7.053
  741   2HD1  LEU  97          2HD1      LEU  97  -6.987   4.351  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.511   2.780  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.504   6.246  -9.826
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.406  -8.821
  745   3HD2  LEU  97          3HD2      LEU  97  -8.645   6.199  -8.069
  746    H    VAL  98           H        VAL  98  -4.208   5.848 -11.143
  747    HA   VAL  98           HA       VAL  98  -2.849   3.761 -12.690
  748    HB   VAL  98           HB       VAL  98  -2.520   6.781 -12.882
  749   1HG1  VAL  98          1HG1      VAL  98  -1.026   4.460 -14.104
  750   2HG1  VAL  98          2HG1      VAL  98  -0.380   5.705 -13.035
  751   3HG1  VAL  98          3HG1      VAL  98  -0.882   6.124 -14.673
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.908 -15.157
  753   2HG2  VAL  98          2HG2      VAL  98  -3.415   6.653 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.468   5.572 -14.149
  755    H    PHE  99           H        PHE  99  -1.240   2.911 -11.257
  756    HA   PHE  99           HA       PHE  99  -0.234   4.766  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.719   1.816  -9.168
  758   2HB   PHE  99          1HB       PHE  99   0.435   2.562  -8.052
  759    HD1  PHE  99           HD1      PHE  99  -3.099   2.161  -8.946
  760    HD2  PHE  99           HD2      PHE  99  -0.267   3.911  -6.251
  761    HE1  PHE  99           HE1      PHE  99  -4.903   2.660  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.089   4.403  -4.662
  763    HZ   PHE  99           HZ       PHE  99  -4.396   3.778  -5.219
  764    H    ASP 100           H        ASP 100   1.948   5.077  -9.152
  765    HA   ASP 100           HA       ASP 100   3.710   3.599 -10.964
  766   1HB   ASP 100          2HB       ASP 100   3.846   5.986 -11.157
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.149  -9.411
  768    H    VAL 101           H        VAL 101   4.563   1.928  -9.766
  769    HA   VAL 101           HA       VAL 101   4.827   2.054  -6.829
  770    HB   VAL 101           HB       VAL 101   3.653  -0.202  -8.531
  771   1HG1  VAL 101          1HG1      VAL 101   3.148  -1.243  -6.290
  772   2HG1  VAL 101          2HG1      VAL 101   4.248  -0.060  -5.580
  773   3HG1  VAL 101          3HG1      VAL 101   4.852  -1.234  -6.752
  774   1HG2  VAL 101          1HG2      VAL 101   1.644   0.199  -7.112
  775   2HG2  VAL 101          2HG2      VAL 101   2.123   1.753  -7.796
  776   3HG2  VAL 101          3HG2      VAL 101   2.550   1.352  -6.132
  777    H    GLU 102           H        GLU 102   6.714   1.361  -6.030
  778    HA   GLU 102           HA       GLU 102   8.509  -0.106  -7.838
  779   1HB   GLU 102          2HB       GLU 102   9.367   2.099  -7.492
  780   2HB   GLU 102          1HB       GLU 102   9.085   1.987  -5.750
  781   1HG   GLU 102          2HG       GLU 102  10.832   0.480  -5.436
  782   2HG   GLU 102          1HG       GLU 102  10.876   0.034  -7.150
  783    H    LEU 103           H        LEU 103   8.832  -2.172  -7.006
  784    HA   LEU 103           HA       LEU 103   8.027  -2.669  -4.241
  785   1HB   LEU 103          2HB       LEU 103   7.226  -4.249  -5.863
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.466  -6.530
  787    HG   LEU 103           HG       LEU 103   9.548  -5.664  -4.531
  788   1HD1  LEU 103          1HD1      LEU 103   6.782  -4.963  -3.524
  789   2HD1  LEU 103          2HD1      LEU 103   8.337  -4.624  -2.760
  790   3HD1  LEU 103          3HD1      LEU 103   7.733  -6.280  -2.835
  791   1HD2  LEU 103          1HD2      LEU 103   7.981  -7.615  -4.730
  792   2HD2  LEU 103          2HD2      LEU 103   8.589  -7.006  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.951  -6.610  -5.747
  794    H    LEU 104           H        LEU 104   9.457  -2.279  -2.765
  795    HA   LEU 104           HA       LEU 104  12.289  -2.023  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.808  -1.446  -0.822
  797   2HB   LEU 104          1HB       LEU 104  12.476  -0.998  -1.181
  798    HG   LEU 104           HG       LEU 104  10.040   0.191  -2.506
  799   1HD1  LEU 104          1HD1      LEU 104  10.369   0.799  -0.055
  800   2HD1  LEU 104          2HD1      LEU 104  10.327   2.140  -1.200
  801   3HD1  LEU 104          3HD1      LEU 104  11.870   1.579  -0.555
  802   1HD2  LEU 104          1HD2      LEU 104  12.274   0.035  -3.736
  803   2HD2  LEU 104          2HD2      LEU 104  12.923   1.104  -2.492
  804   3HD2  LEU 104          3HD2      LEU 104  11.621   1.662  -3.544
  805    H    LYS 105           H        LYS 105  10.328  -4.008  -1.312
  806    HA   LYS 105           HA       LYS 105  12.566  -5.750  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.825  -3.636   0.611
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.082   1.446
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.015   2.349
  810   2HG   LYS 105          1HG       LYS 105  13.833  -5.708   1.416
  811   1HD   LYS 105          2HD       LYS 105  14.217  -3.641   2.556
  812   2HD   LYS 105          1HD       LYS 105  12.615  -3.694   3.311
  813   1HE   LYS 105          2HE       LYS 105  13.276  -5.923   4.301
  814   2HE   LYS 105          1HE       LYS 105  14.923  -5.603   3.733
  815   1HZ   LYS 105          1HZ       LYS 105  13.453  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.253  -3.310   4.908
  817   3HZ   LYS 105          3HZ       LYS 105  15.123  -4.568   5.661
  818    H    LEU 106           H        LEU 106  11.794  -7.703   0.372
  819    HA   LEU 106           HA       LEU 106   8.921  -7.755   1.010
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.085   0.182
  821   2HB   LEU 106          1HB       LEU 106   8.990 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.869  -8.833  -1.808
  823   1HD1  LEU 106          1HD1      LEU 106   8.416 -11.424  -1.350
  824   2HD1  LEU 106          2HD1      LEU 106  10.120 -11.286  -1.776
  825   3HD1  LEU 106          3HD1      LEU 106   8.883 -10.734  -2.903
  826   1HD2  LEU 106          1HD2      LEU 106   7.567  -8.572  -2.322
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.673
  828   3HD2  LEU 106          3HD2      LEU 106   7.073  -9.577  -0.960
  829    H    GLU 107           HN       GLU 107   8.525  -8.269   3.052
  830    HA   GLU 107           HA       GLU 107  10.716  -9.187   4.801
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.228   5.415
  832   2HB   GLU 107          1HB       GLU 107   9.697  -7.831   6.579
  833   1HG   GLU 107          2HG       GLU 107  11.468  -6.821   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.234  -6.153   4.166
  835    H2   GPI 108           H2       GPI 108  -3.091   1.449  -2.326
  836   1H5   GPI 108          1H5       GPI 108  -1.899   4.482  -0.936
  837   2H5   GPI 108          2H5       GPI 108  -2.793   4.129   0.551
  838   1H3   GPI 108          1H3       GPI 108  -1.776   0.393  -0.565
  839   2H3   GPI 108          2H3       GPI 108  -2.871   0.960   0.708
  840   1H4   GPI 108          1H4       GPI 108  -0.709   2.453  -0.856
  841   2H4   GPI 108          2H4       GPI 108  -1.044   2.569   0.903
  842   1H14  GPI 108          1H14      GPI 108  -5.540   0.392   1.197
  843   2H14  GPI 108          2H14      GPI 108  -7.118   0.280   0.382
  844   1H15  GPI 108          1H15      GPI 108  -6.073   2.561   2.119
  845   2H15  GPI 108          2H15      GPI 108  -7.530   2.701   1.110
  846   1H16  GPI 108          1H16      GPI 108  -7.182   0.419   3.094
  847   2H16  GPI 108          2H16      GPI 108  -7.862   1.987   3.589
  848    H20  GPI 108           H20      GPI 108 -12.562  -0.163   0.749
  849    H21  GPI 108           H21      GPI 108 -11.231  -1.780   2.099
  850    H22  GPI 108           H22      GPI 108  -9.014  -1.103   3.011
  851    H18  GPI 108           H18      GPI 108  -9.452   2.797   1.227
  852   1H12  GPI 108          1H12      GPI 108  -3.640   7.233  -0.278
  853   2H12  GPI 108          2H12      GPI 108  -5.138   8.105  -0.107
  854   3H12  GPI 108          3H12      GPI 108  -4.512   7.169   1.238
  855   1H13  GPI 108          1H13      GPI 108  -4.733   4.202   0.696
  856   2H13  GPI 108          2H13      GPI 108  -5.378   5.465   1.761
  857   3H13  GPI 108          3H13      GPI 108  -6.491   4.480   0.770
  858   1H10  GPI 108          1H10      GPI 108  -7.359   5.566  -1.124
  859   2H10  GPI 108          2H10      GPI 108  -7.319   6.876   0.077
  860   1H11  GPI 108          1H11      GPI 108  -6.957   7.015  -2.831
  861   2H11  GPI 108          2H11      GPI 108  -7.358   8.278  -1.701
  862   3H11  GPI 108          3H11      GPI 108  -5.682   7.833  -1.958
  Start of MODEL    7
    1   1H    GLY   1          1H        GLY   1 -10.184  -5.719 -15.429
    2   2H    GLY   1          2H        GLY   1  -9.175  -4.435 -15.868
    3   3H    GLY   1          3H        GLY   1  -9.873  -4.486 -14.314
    4   1HA   GLY   1          1HA       GLY   1  -8.596  -6.397 -13.737
    5   2HA   GLY   1          2HA       GLY   1  -7.913  -6.426 -15.369
    6    H    VAL   2           H        VAL   2  -5.835  -6.109 -14.256
    7    HA   VAL   2           HA       VAL   2  -5.181  -3.271 -13.801
    8    HB   VAL   2           HB       VAL   2  -5.014  -4.370 -11.645
    9   1HG1  VAL   2          1HG1      VAL   2  -5.039  -6.651 -11.975
   10   2HG1  VAL   2          2HG1      VAL   2  -3.355  -6.388 -11.517
   11   3HG1  VAL   2          3HG1      VAL   2  -3.786  -6.592 -13.215
   12   1HG2  VAL   2          1HG2      VAL   2  -2.739  -3.984 -11.112
   13   2HG2  VAL   2          2HG2      VAL   2  -2.994  -2.998 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.185  -4.560 -12.685
   15    H    GLN   3           H        GLN   3  -3.402  -2.742 -15.042
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.697 -16.956
   17   1HB   GLN   3          2HB       GLN   3  -3.649  -3.062 -17.957
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.782 -16.984
   19   1HG   GLN   3          2HG       GLN   3  -0.839  -2.076 -18.217
   20   2HG   GLN   3          1HG       GLN   3  -1.635  -3.298 -19.223
   21   1HE2  GLN   3          1HE2      GLN   3  -0.895  -0.070 -19.216
   22   2HE2  GLN   3          2HE2      GLN   3  -2.172   0.476 -20.243
   23    H    VAL   4           H        VAL   4   0.028  -4.828 -16.596
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.552
   25    HB   VAL   4           HB       VAL   4   1.946  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.455  -5.606 -13.276
   27   2HG1  VAL   4          2HG1      VAL   4   3.339  -3.908 -13.738
   28   3HG1  VAL   4          3HG1      VAL   4   4.019  -5.084 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.752 -13.785
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.128 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.450  -5.692 -12.607
   32    H    GLU   5           H        GLU   5   2.590  -1.532 -15.721
   33    HA   GLU   5           HA       GLU   5   3.859  -2.504 -18.203
   34   1HB   GLU   5          2HB       GLU   5   3.407   0.409 -17.570
   35   2HB   GLU   5          1HB       GLU   5   3.765  -0.336 -19.133
   36   1HG   GLU   5          2HG       GLU   5   1.577  -0.579 -19.582
   37   2HG   GLU   5          1HG       GLU   5   1.316  -1.439 -18.055
   38    H    THR   6           H        THR   6   6.172  -2.559 -17.862
   39    HA   THR   6           HA       THR   6   7.248  -1.668 -15.326
   40    HB   THR   6           HB       THR   6   8.546  -2.886 -17.814
   41    HG1  THR   6           HG1      THR   6   7.714  -4.258 -15.467
   42   1HG2  THR   6          1HG2      THR   6  10.110  -3.769 -15.964
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.269 -15.172
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.222 -16.773
   45    H    ILE   7           H        ILE   7   8.484  -0.099 -14.755
   46    HA   ILE   7           HA       ILE   7   9.324   1.985 -16.649
   47    HB   ILE   7           HB       ILE   7   9.174   1.956 -13.593
   48   1HG1  ILE   7          2HG1      ILE   7   7.573   3.425 -15.705
   49   2HG1  ILE   7          1HG1      ILE   7   7.036   1.948 -14.883
   50   1HG2  ILE   7          1HG2      ILE   7  10.902   3.494 -13.979
   51   2HG2  ILE   7          2HG2      ILE   7   9.451   4.491 -13.872
   52   3HG2  ILE   7          3HG2      ILE   7  10.147   4.115 -15.448
   53   1HD1  ILE   7          1HD1      ILE   7   6.104   4.221 -14.094
   54   2HD1  ILE   7          2HD1      ILE   7   7.674   4.426 -13.317
   55   3HD1  ILE   7          3HD1      ILE   7   6.644   3.063 -12.878
   56    H    SER   8           H        SER   8  10.603  -0.023 -13.869
   57    HA   SER   8           HA       SER   8  13.149  -0.215 -15.312
   58   1HB   SER   8          2HB       SER   8  12.963   0.239 -12.319
   59   2HB   SER   8          1HB       SER   8  14.443   0.043 -13.266
   60    HG   SER   8           HG       SER   8  13.495   1.893 -14.558
   61    HA   PRO   9           HA       PRO   9  12.195  -4.487 -14.336
   62   1HB   PRO   9          2HB       PRO   9  15.067  -4.995 -14.688
   63   2HB   PRO   9          1HB       PRO   9  13.701  -5.633 -15.585
   64   1HG   PRO   9          2HG       PRO   9  15.267  -3.813 -16.725
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.706 -16.935
   66   1HD   PRO   9          1HD       PRO   9  15.270  -2.167 -14.992
   67   2HD   PRO   9          2HD       PRO   9  14.047  -1.540 -16.073
   68    H    GLY  10           H        GLY  10  12.403  -6.055 -12.856
   69   1HA   GLY  10          2HA       GLY  10  13.702  -5.350 -10.325
   70   2HA   GLY  10          1HA       GLY  10  12.398  -6.526 -10.541
   71    H    ASP  11           H        ASP  11  13.970  -8.174  -9.354
   72    HA   ASP  11           HA       ASP  11  16.402  -8.726 -10.874
   73   1HB   ASP  11          2HB       ASP  11  16.912 -10.364  -9.170
   74   2HB   ASP  11          1HB       ASP  11  16.352  -8.884  -8.382
   75    H    GLY  12           H        GLY  12  13.237  -9.675 -11.217
   76   1HA   GLY  12          2HA       GLY  12  12.273 -11.204 -12.649
   77   2HA   GLY  12          1HA       GLY  12  13.901 -11.646 -13.186
   78    H    ARG  13           H        ARG  13  13.568 -12.072  -9.752
   79    HA   ARG  13           HA       ARG  13  12.731 -14.857 -10.202
   80   1HB   ARG  13          2HB       ARG  13  15.050 -14.302  -8.384
   81   2HB   ARG  13          1HB       ARG  13  14.616 -15.801  -9.217
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.962 -11.269
   83   2HG   ARG  13          1HG       ARG  13  15.849 -13.397 -10.514
   84   1HD   ARG  13          2HD       ARG  13  17.938 -14.356 -10.544
   85   2HD   ARG  13          1HD       ARG  13  17.367 -14.840  -8.938
   86    HE   ARG  13           HE       ARG  13  16.907 -17.032  -9.825
   87   1HH1  ARG  13          1HH1      ARG  13  18.197 -15.234 -12.843
   88   2HH1  ARG  13          2HH1      ARG  13  19.703 -15.786 -12.189
   89   1HH2  ARG  13          1HH2      ARG  13  17.672 -18.713 -11.201
   90   2HH2  ARG  13          2HH2      ARG  13  18.635 -18.327 -12.588
   91    H    THR  14           H        THR  14  12.902 -12.177  -7.902
   92    HA   THR  14           HA       THR  14  11.727 -13.893  -5.805
   93    HB   THR  14           HB       THR  14  12.787 -11.053  -5.377
   94    HG1  THR  14           HG1      THR  14  14.552 -12.026  -6.114
   95   1HG2  THR  14          1HG2      THR  14  12.295 -13.321  -3.518
   96   2HG2  THR  14          2HG2      THR  14  11.881 -11.615  -3.352
   97   3HG2  THR  14          3HG2      THR  14  13.559 -12.136  -3.191
   98    H    PHE  15           H        PHE  15   9.638 -13.947  -6.443
   99    HA   PHE  15           HA       PHE  15   8.161 -11.405  -6.742
  100   1HB   PHE  15          2HB       PHE  15   7.407 -14.236  -7.451
  101   2HB   PHE  15          1HB       PHE  15   6.391 -12.807  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.944 -11.193  -9.435
  103    HD2  PHE  15           HD2      PHE  15   9.294 -14.723  -8.927
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.858 -11.648
  105    HE2  PHE  15           HE2      PHE  15  10.270 -14.358 -11.157
  106    HZ   PHE  15           HZ       PHE  15   9.599 -12.444 -12.505
  107    HA   PRO  16           HA       PRO  16   6.582 -11.998  -2.682
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.530  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.841  -9.829  -2.630
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.091  -5.201
  111   2HG   PRO  16          1HG       PRO  16   5.228  -8.736  -4.652
  112   1HD   PRO  16          1HD       PRO  16   6.217 -10.465  -6.438
  113   2HD   PRO  16          2HD       PRO  16   7.246  -9.796  -5.188
  114    H    LYS  17           H        LYS  17   5.299 -13.160  -1.504
  115    HA   LYS  17           HA       LYS  17   3.409 -14.927  -2.909
  116   1HB   LYS  17          2HB       LYS  17   5.300 -15.563  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.167 -16.702  -1.348
  118   1HG   LYS  17          2HG       LYS  17   6.218 -15.321  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.666 -16.743  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.454 -18.131  -3.362
  121   2HD   LYS  17          1HD       LYS  17   4.100 -16.993  -3.456
  122   1HE   LYS  17          2HE       LYS  17   6.460 -16.407  -5.139
  123   2HE   LYS  17          1HE       LYS  17   5.470 -17.803  -5.593
  124   1HZ   LYS  17          1HZ       LYS  17   4.772 -15.767  -6.650
  125   2HZ   LYS  17          2HZ       LYS  17   4.466 -15.075  -5.137
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.423  -5.663
  127    H    ARG  18           H        ARG  18   1.602 -15.579  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.733   0.104
  129   1HB   ARG  18          2HB       ARG  18  -0.556 -15.877  -0.970
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.688   0.494
  131   1HG   ARG  18          2HG       ARG  18  -1.228 -14.883   1.779
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.487   0.238
  133   1HD   ARG  18          2HD       ARG  18  -3.315 -15.945   1.819
  134   2HD   ARG  18          1HD       ARG  18  -3.128 -16.547   0.164
  135    HE   ARG  18           HE       ARG  18  -1.064 -17.633   1.569
  136   1HH1  ARG  18          2HH1      ARG  18  -4.657 -18.505   1.491
  137   2HH1  ARG  18          1HH1      ARG  18  -4.459 -18.842   3.179
  138   1HH2  ARG  18          2HH2      ARG  18  -1.542 -19.659   3.426
  139   2HH2  ARG  18          1HH2      ARG  18  -1.804 -20.427   1.896
  140    H    GLY  19           H        GLY  19   0.549 -13.147   2.149
  141   1HA   GLY  19          2HA       GLY  19   0.936 -13.449   4.428
  142   2HA   GLY  19          1HA       GLY  19   1.905 -14.879   4.045
  143    H    GLN  20           H        GLN  20   3.267 -12.975   1.914
  144    HA   GLN  20           HA       GLN  20   5.254 -11.989   3.783
  145   1HB   GLN  20          2HB       GLN  20   5.101 -11.878   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.432 -11.203   1.722
  147   1HG   GLN  20          2HG       GLN  20   6.843 -13.492   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.123   1.570
  149   1HE2  GLN  20          1HE2      GLN  20   8.885 -13.778   1.915
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.643   0.258
  151    H    THR  21           H        THR  21   5.899  -9.935   4.062
  152    HA   THR  21           HA       THR  21   3.948  -7.849   3.444
  153    HB   THR  21           HB       THR  21   6.487  -7.829   5.134
  154    HG1  THR  21           HG1      THR  21   5.082  -8.526   6.606
  155   1HG2  THR  21          1HG2      THR  21   4.528  -5.600   4.682
  156   2HG2  THR  21          2HG2      THR  21   6.268  -5.594   4.396
  157   3HG2  THR  21          3HG2      THR  21   5.647  -5.683   6.044
  158    H    CYS  22           H        CYS  22   4.053  -6.679   1.688
  159    HA   CYS  22           HA       CYS  22   6.560  -6.385   0.226
  160   1HB   CYS  22          2HB       CYS  22   3.813  -5.362  -0.485
  161   2HB   CYS  22          1HB       CYS  22   5.233  -5.434  -1.544
  162    HG   CYS  22           HG       CYS  22   4.729  -7.766  -2.075
  163    H    VAL  23           H        VAL  23   7.677  -4.552   0.161
  164    HA   VAL  23           HA       VAL  23   6.772  -2.298   1.836
  165    HB   VAL  23           HB       VAL  23   9.633  -3.181   1.169
  166   1HG1  VAL  23          1HG1      VAL  23   8.493  -0.919   2.757
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.948   1.693
  168   3HG1  VAL  23          3HG1      VAL  23   9.997  -1.664   3.302
  169   1HG2  VAL  23          1HG2      VAL  23   7.797  -3.856   3.414
  170   2HG2  VAL  23          2HG2      VAL  23   9.509  -3.641   3.772
  171   3HG2  VAL  23          3HG2      VAL  23   8.999  -4.855   2.599
  172    H    VAL  24           H        VAL  24   6.137  -0.647   0.303
  173    HA   VAL  24           HA       VAL  24   7.580  -0.658  -2.263
  174    HB   VAL  24           HB       VAL  24   5.483  -0.200  -3.508
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.631  -1.779
  176   2HG1  VAL  24          2HG1      VAL  24   6.178  -2.583  -3.106
  177   3HG1  VAL  24          3HG1      VAL  24   4.458  -2.363  -3.430
  178   1HG2  VAL  24          1HG2      VAL  24   3.268  -0.455  -2.326
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.958  -1.798
  180   3HG2  VAL  24          3HG2      VAL  24   4.142  -0.491  -0.793
  181    H    HIS  25           H        HIS  25   7.789   1.374  -3.359
  182    HA   HIS  25           HA       HIS  25   6.700   3.596  -1.767
  183   1HB   HIS  25          2HB       HIS  25   9.117   3.369  -3.380
  184   2HB   HIS  25          1HB       HIS  25   8.118   4.723  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.081   5.443  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.969   4.836  -2.109
  187    HE1  HIS  25           HE1      HIS  25   8.512   6.539   0.827
  188    HE2  HIS  25           HE2      HIS  25  10.844   6.126   0.050
  189    H    TYR  26           H        TYR  26   5.064   5.001  -2.881
  190    HA   TYR  26           HA       TYR  26   4.445   4.247  -5.634
  191   1HB   TYR  26          2HB       TYR  26   2.139   3.706  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.743  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.748   5.509  -4.440
  194    HD2  TYR  26           HD2      TYR  26   2.893   3.059  -1.679
  195    HE1  TYR  26           HE1      TYR  26  -0.613   6.408  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.550   3.981   0.195
  197    HH   TYR  26           HH       TYR  26  -0.127   6.681   0.103
  198    H    THR  27           H        THR  27   3.221   5.733  -6.796
  199    HA   THR  27           HA       THR  27   2.334   8.164  -5.406
  200    HB   THR  27           HB       THR  27   3.482   8.077  -8.195
  201    HG1  THR  27           HG1      THR  27   4.357   8.924  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.069   9.782  -8.527
  203   2HG2  THR  27          2HG2      THR  27   3.188  10.688  -7.507
  204   3HG2  THR  27          3HG2      THR  27   1.737   9.972  -6.806
  205    H    GLY  28           H        GLY  28   0.073   8.084  -5.750
  206   1HA   GLY  28          2HA       GLY  28  -1.090   6.460  -7.921
  207   2HA   GLY  28          1HA       GLY  28  -1.923   6.972  -6.446
  208    H    MET  29           H        MET  29  -2.117   7.366  -9.513
  209    HA   MET  29           HA       MET  29  -2.906  10.190  -9.488
  210   1HB   MET  29          2HB       MET  29  -1.481   8.726 -11.719
  211   2HB   MET  29          1HB       MET  29  -2.185  10.343 -11.858
  212   1HG   MET  29          2HG       MET  29  -0.600  11.287 -10.510
  213   2HG   MET  29          1HG       MET  29  -0.178   9.743  -9.751
  214   1HE   MET  29          1HE       MET  29   0.794   8.009 -10.619
  215   2HE   MET  29          2HE       MET  29   2.360   8.217 -11.404
  216   3HE   MET  29          3HE       MET  29   0.962   7.704 -12.349
  217    H    LEU  30           H        LEU  30  -4.550  10.703 -10.718
  218    HA   LEU  30           HA       LEU  30  -6.563   8.805 -11.486
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.615 -10.972
  220   2HB   LEU  30          1HB       LEU  30  -7.160  11.340 -12.384
  221    HG   LEU  30           HG       LEU  30  -8.958  10.997 -11.159
  222   1HD1  LEU  30          1HD1      LEU  30  -8.541   8.873 -10.285
  223   2HD1  LEU  30          2HD1      LEU  30  -8.874   9.873  -8.871
  224   3HD1  LEU  30          3HD1      LEU  30  -7.211   9.451  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.617  12.084  -8.843
  226   2HD2  LEU  30          2HD2      LEU  30  -8.463  13.011 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.019  12.446  -9.495
  228    H    GLU  31           H        GLU  31  -7.370   8.958 -13.976
  229    HA   GLU  31           HA       GLU  31  -5.215   8.503 -15.715
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.086 -16.064
  231   2HB   GLU  31          1HB       GLU  31  -7.057   8.987 -17.474
  232   1HG   GLU  31          2HG       GLU  31  -6.309   6.760 -16.613
  233   2HG   GLU  31          1HG       GLU  31  -7.627   6.865 -15.435
  234    H    ASP  32           H        ASP  32  -6.495  11.595 -14.899
  235    HA   ASP  32           HA       ASP  32  -5.307  12.763 -17.293
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.857 -16.414
  237   2HB   ASP  32          1HB       ASP  32  -7.439  13.611 -16.364
  238    H    GLY  33           H        GLY  33  -3.818  11.614 -14.624
  239   1HA   GLY  33          2HA       GLY  33  -1.527  11.886 -14.228
  240   2HA   GLY  33          1HA       GLY  33  -1.619  13.506 -14.936
  241    H    LYS  34           H        LYS  34  -4.145  13.640 -12.941
  242    HA   LYS  34           HA       LYS  34  -2.769  15.196 -11.018
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.189 -11.901
  244   2HB   LYS  34          1HB       LYS  34  -5.504  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.976  16.472  -9.967
  246   2HG   LYS  34          1HG       LYS  34  -5.697  16.691 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.721  14.717  -8.286
  248   2HD   LYS  34          1HD       LYS  34  -5.073  16.408  -7.891
  249   1HE   LYS  34          2HE       LYS  34  -7.008  14.532  -9.255
  250   2HE   LYS  34          1HE       LYS  34  -7.005  14.871  -7.518
  251   1HZ   LYS  34          1HZ       LYS  34  -8.074  16.371  -9.644
  252   2HZ   LYS  34          2HZ       LYS  34  -6.991  17.299  -8.737
  253   3HZ   LYS  34          3HZ       LYS  34  -8.312  16.536  -7.979
  254    H    LYS  35           H        LYS  35  -1.722  14.607  -9.322
  255    HA   LYS  35           HA       LYS  35  -1.546  11.907  -8.414
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.565  -8.492
  257   2HB   LYS  35          1HB       LYS  35  -0.489  14.442  -7.182
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.540  -5.702
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.725  -7.013
  260   1HD   LYS  35          2HD       LYS  35   2.379  12.752  -5.539
  261   2HD   LYS  35          1HD       LYS  35   2.365  13.635  -7.075
  262   1HE   LYS  35          2HE       LYS  35   0.921  15.362  -6.033
  263   2HE   LYS  35          1HE       LYS  35   1.033  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.281  14.954  -4.339
  265   2HZ   LYS  35          2HZ       LYS  35   2.541  16.412  -4.769
  266   3HZ   LYS  35          3HZ       LYS  35   3.382  15.499  -5.937
  267    H    PHE  36           H        PHE  36  -2.816  11.063  -6.760
  268    HA   PHE  36           HA       PHE  36  -4.246  13.051  -5.102
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.140  -4.493
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.610  -6.201
  271    HD1  PHE  36           HD1      PHE  36  -4.653   8.995  -3.835
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.541   6.621  -4.509
  274    HE2  PHE  36           HE2      PHE  36  -5.279   7.712  -8.564
  275    HZ   PHE  36           HZ       PHE  36  -4.859   5.986  -6.864
  276    H    ASP  37           H        ASP  37  -1.761  10.657  -4.990
  277    HA   ASP  37           HA       ASP  37  -1.054  11.468  -2.361
  278   1HB   ASP  37          2HB       ASP  37  -2.943   9.815  -1.834
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.557  -2.454
  280    H    SER  38           H        SER  38   0.978  10.467  -1.659
  281    HA   SER  38           HA       SER  38   2.320   8.515  -3.297
  282   1HB   SER  38          2HB       SER  38   2.764  10.583  -4.606
  283   2HB   SER  38          1HB       SER  38   3.449  11.333  -3.158
  284    HG   SER  38           HG       SER  38   5.034  10.353  -4.565
  285    H    SER  39           H        SER  39   3.581   7.305  -1.913
  286    HA   SER  39           HA       SER  39   4.091   8.271   0.752
  287   1HB   SER  39          2HB       SER  39   5.451   6.189   0.992
  288   2HB   SER  39          1HB       SER  39   3.790   5.894   0.458
  289    HG   SER  39           HG       SER  39   4.880   4.729  -0.966
  290    H    ARG  40           H        ARG  40   5.671   8.414  -2.310
  291    HA   ARG  40           HA       ARG  40   8.347   8.698  -1.494
  292   1HB   ARG  40          2HB       ARG  40   6.895   9.775  -3.938
  293   2HB   ARG  40          1HB       ARG  40   8.646   9.873  -3.705
  294   1HG   ARG  40          2HG       ARG  40   8.668   7.373  -3.552
  295   2HG   ARG  40          1HG       ARG  40   6.968   7.398  -4.046
  296   1HD   ARG  40          2HD       ARG  40   7.654   8.459  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.346   8.285  -5.688
  298    HE   ARG  40           HE       ARG  40   9.209   5.985  -6.101
  299   1HH1  ARG  40          1HH1      ARG  40   5.579   6.787  -6.201
  300   2HH1  ARG  40          2HH1      ARG  40   5.911   6.969  -7.893
  301   1HH2  ARG  40          1HH2      ARG  40   7.872   3.981  -6.855
  302   2HH2  ARG  40          2HH2      ARG  40   6.914   4.487  -8.209
  303    H    ASP  41           H        ASP  41   5.606  11.042  -1.765
  304    HA   ASP  41           HA       ASP  41   7.158  13.333  -1.091
  305   1HB   ASP  41          2HB       ASP  41   4.187  12.794  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.378  -0.522
  307    H    ARG  42           H        ARG  42   5.682  10.787   0.920
  308    HA   ARG  42           HA       ARG  42   6.301  12.309   3.321
  309   1HB   ARG  42          2HB       ARG  42   5.439   9.439   3.144
  310   2HB   ARG  42          1HB       ARG  42   5.373  10.508   4.550
  311   1HG   ARG  42          2HG       ARG  42   3.750  11.917   3.343
  312   2HG   ARG  42          1HG       ARG  42   3.759  10.732   2.025
  313   1HD   ARG  42          2HD       ARG  42   3.174  10.027   4.870
  314   2HD   ARG  42          1HD       ARG  42   1.918  10.548   3.736
  315    HE   ARG  42           HE       ARG  42   3.114   7.958   3.945
  316   1HH1  ARG  42          1HH1      ARG  42   0.345   9.704   2.080
  317   2HH1  ARG  42          2HH1      ARG  42   1.577   9.539   0.875
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.329   2.839
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.787   1.327
  320    H    ASN  43           H        ASN  43   7.996  10.294   1.243
  321    HA   ASN  43           HA       ASN  43   9.990   9.198   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.556  11.533   2.023
  323   2HB   ASN  43          1HB       ASN  43  10.442  10.969   3.696
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.103   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.587   9.744   1.390
  326    H    LYS  44           H        LYS  44   7.798   7.928   2.742
  327    HA   LYS  44           HA       LYS  44   9.468   6.181   4.410
  328   1HB   LYS  44          2HB       LYS  44   8.224   7.817   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.711   7.206   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.014   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.598   6.829
  332   1HD   LYS  44          2HD       LYS  44   7.583   7.120   8.278
  333   2HD   LYS  44          1HD       LYS  44   6.035   6.933   7.436
  334   1HE   LYS  44          2HE       LYS  44   7.386   4.698   8.961
  335   2HE   LYS  44          1HE       LYS  44   6.179   5.778   9.676
  336   1HZ   LYS  44          1HZ       LYS  44   5.865   3.724   7.645
  337   2HZ   LYS  44          2HZ       LYS  44   4.808   5.045   7.655
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.034   9.022
  339    HA   PRO  45           HA       PRO  45   7.453   3.619   1.208
  340   1HB   PRO  45          2HB       PRO  45   8.335   1.317   2.814
  341   2HB   PRO  45          1HB       PRO  45   8.652   1.688   1.129
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.990   2.947
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.161   1.650
  344   1HD   PRO  45          1HD       PRO  45   9.469   3.382   4.523
  345   2HD   PRO  45          2HD       PRO  45  10.320   4.576   3.570
  346    H    PHE  46           H        PHE  46   5.602   2.323   1.036
  347    HA   PHE  46           HA       PHE  46   3.982   2.332   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.006   3.314   1.482
  349   2HB   PHE  46          1HB       PHE  46   3.340   1.839   0.559
  350    HD1  PHE  46           HD1      PHE  46   1.391   3.118   3.442
  351    HD2  PHE  46           HD2      PHE  46   1.765   0.211   0.358
  352    HE1  PHE  46           HE1      PHE  46  -0.840   2.248   3.982
  353    HE2  PHE  46           HE2      PHE  46  -0.462  -0.653   0.916
  354    HZ   PHE  46           HZ       PHE  46  -1.778   0.358   2.731
  355    H    LYS  47           H        LYS  47   3.424   0.256   4.455
  356    HA   LYS  47           HA       LYS  47   4.541  -2.088   3.051
  357   1HB   LYS  47          2HB       LYS  47   3.966  -1.641   5.984
  358   2HB   LYS  47          1HB       LYS  47   4.454  -3.195   5.294
  359   1HG   LYS  47          2HG       LYS  47   6.483  -2.130   4.439
  360   2HG   LYS  47          1HG       LYS  47   6.001  -0.632   5.254
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.684   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.492  -3.262   6.666
  363   1HE   LYS  47          2HE       LYS  47   8.467  -2.421   5.552
  364   2HE   LYS  47          1HE       LYS  47   8.131  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.000   8.399
  366   2HZ   LYS  47          2HZ       LYS  47   9.622  -1.386   7.634
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.046   7.526
  368    H    PHE  48           H        PHE  48   3.032  -3.771   2.431
  369    HA   PHE  48           HA       PHE  48   0.643  -3.987   4.111
  370   1HB   PHE  48          2HB       PHE  48  -0.872  -4.237   2.307
  371   2HB   PHE  48          1HB       PHE  48   0.050  -2.759   1.981
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.773   0.222
  373    HD2  PHE  48           HD2      PHE  48  -0.909  -6.023   0.770
  374    HE1  PHE  48           HE1      PHE  48   2.259  -3.558  -2.054
  375    HE2  PHE  48           HE2      PHE  48  -0.438  -6.811  -1.534
  376    HZ   PHE  48           HZ       PHE  48   1.146  -5.556  -2.944
  377    H    MET  49           H        MET  49  -0.030  -6.289   4.274
  378    HA   MET  49           HA       MET  49   1.873  -8.238   3.221
  379   1HB   MET  49          2HB       MET  49   1.322  -8.654   5.477
  380   2HB   MET  49          1HB       MET  49  -0.401  -8.377   5.188
  381   1HG   MET  49          2HG       MET  49  -0.660 -10.502   4.182
  382   2HG   MET  49          1HG       MET  49   1.093 -10.765   4.147
  383   1HE   MET  49          1HE       MET  49   1.596 -10.935   8.133
  384   2HE   MET  49          2HE       MET  49   1.276  -9.411   7.306
  385   3HE   MET  49          3HE       MET  49   2.404 -10.574   6.606
  386    H    LEU  50           H        LEU  50   1.555  -9.321   1.510
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.100  -0.214
  388   1HB   LEU  50          2HB       LEU  50   1.838 -10.578  -0.103
  389   2HB   LEU  50          1HB       LEU  50   0.514 -11.618  -0.635
  390    HG   LEU  50           HG       LEU  50   1.996  -9.556  -2.080
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.296  -2.467
  392   2HD1  LEU  50          2HD1      LEU  50   2.461 -11.926  -2.291
  393   3HD1  LEU  50          3HD1      LEU  50   1.597 -11.431  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.266  -9.495  -3.780
  395   2HD2  LEU  50          2HD2      LEU  50  -0.225  -8.667  -2.301
  396   3HD2  LEU  50          3HD2      LEU  50  -0.849 -10.277  -2.660
  397    H    GLY  51           H        GLY  51  -2.499 -10.135  -0.243
  398   1HA   GLY  51          2HA       GLY  51  -3.966 -11.915  -0.223
  399   2HA   GLY  51          1HA       GLY  51  -2.817 -12.828   0.766
  400    H    LYS  52           H        LYS  52  -3.038  -9.957   2.331
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.123   4.260
  402   1HB   LYS  52          2HB       LYS  52  -2.634  -9.864   4.489
  403   2HB   LYS  52          1HB       LYS  52  -3.670  -8.436   4.367
  404   1HG   LYS  52          2HG       LYS  52  -4.948  -9.342   6.363
  405   2HG   LYS  52          1HG       LYS  52  -3.626 -10.506   6.556
  406   1HD   LYS  52          2HD       LYS  52  -2.030  -8.610   6.084
  407   2HD   LYS  52          1HD       LYS  52  -3.414  -7.508   6.197
  408   1HE   LYS  52          2HE       LYS  52  -3.789  -8.458   8.458
  409   2HE   LYS  52          1HE       LYS  52  -2.179  -9.179   8.302
  410   1HZ   LYS  52          1HZ       LYS  52  -2.522  -6.809   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.379   7.620
  412   3HZ   LYS  52          3HZ       LYS  52  -1.188  -7.186   8.286
  413    H    GLN  53           H        GLN  53  -5.464  -9.221   1.593
  414    HA   GLN  53           HA       GLN  53  -7.281  -8.072   0.876
  415   1HB   GLN  53          2HB       GLN  53  -8.463  -9.203   3.402
  416   2HB   GLN  53          1HB       GLN  53  -9.382  -8.293   2.195
  417   1HG   GLN  53          2HG       GLN  53  -9.299  -9.999   0.666
  418   2HG   GLN  53          1HG       GLN  53  -7.926 -10.784   1.471
  419   1HE2  GLN  53          1HE2      GLN  53  -9.752 -12.934   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.730   3.276
  421    H    GLU  54           H        GLU  54  -5.348  -6.568   2.309
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.584   3.518
  423   1HB   GLU  54          2HB       GLU  54  -5.240  -3.759   4.725
  424   2HB   GLU  54          1HB       GLU  54  -5.554  -5.464   5.078
  425   1HG   GLU  54          2HG       GLU  54  -3.732  -6.106   3.601
  426   2HG   GLU  54          1HG       GLU  54  -3.417  -4.399   3.249
  427    H    VAL  55           H        VAL  55  -5.459  -5.033   0.729
  428    HA   VAL  55           HA       VAL  55  -5.542  -2.134   0.239
  429    HB   VAL  55           HB       VAL  55  -3.881  -2.656  -1.664
  430   1HG1  VAL  55          1HG1      VAL  55  -3.276  -2.881   1.283
  431   2HG1  VAL  55          2HG1      VAL  55  -3.214  -1.440   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.006  -2.710   0.072
  433   1HG2  VAL  55          1HG2      VAL  55  -3.254  -5.154  -0.162
  434   2HG2  VAL  55          2HG2      VAL  55  -2.603  -4.582  -1.699
  435   3HG2  VAL  55          3HG2      VAL  55  -4.279  -5.125  -1.596
  436    H    ILE  56           H        ILE  56  -5.906  -1.830  -2.309
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.120  -2.876
  438    HB   ILE  56           HB       ILE  56  -8.229  -1.807  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.913  -0.390  -3.802
  440   2HG1  ILE  56          1HG1      ILE  56  -5.702  -1.648  -5.033
  441   1HG2  ILE  56          1HG2      ILE  56  -9.528  -0.597  -3.668
  442   2HG2  ILE  56          2HG2      ILE  56  -8.131   0.475  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.378  -0.754  -2.341
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.249  -6.672
  445   2HD1  ILE  56          2HD1      ILE  56  -5.491   0.606  -5.992
  446   3HD1  ILE  56          3HD1      ILE  56  -7.123   0.996  -5.448
  447    H    ARG  57           H        ARG  57  -8.929  -4.372  -4.685
  448    HA   ARG  57           HA       ARG  57  -7.301  -6.654  -4.956
  449   1HB   ARG  57          2HB       ARG  57  -9.778  -6.631  -5.312
  450   2HB   ARG  57          1HB       ARG  57  -9.543  -5.686  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.334  -7.514  -7.790
  452   2HG   ARG  57          1HG       ARG  57  -8.506  -8.460  -6.301
  453   1HD   ARG  57          2HD       ARG  57 -10.927  -8.587  -6.657
  454   2HD   ARG  57          1HD       ARG  57 -10.767  -7.626  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.911  -9.770  -8.134
  456   1HH1  ARG  57          1HH1      ARG  57 -12.265  -9.326  -9.730
  457   2HH1  ARG  57          2HH1      ARG  57 -12.630 -10.669  -8.700
  458   1HH2  ARG  57          1HH2      ARG  57  -9.483 -11.968  -9.049
  459   2HH2  ARG  57          2HH2      ARG  57 -10.210 -11.505 -10.551
  460    H    GLY  58           H        GLY  58  -7.319  -3.873  -7.249
  461   1HA   GLY  58          2HA       GLY  58  -5.786  -5.258  -9.176
  462   2HA   GLY  58          1HA       GLY  58  -5.914  -3.499  -9.003
  463    H    TRP  59           H        TRP  59  -4.853  -3.702  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.019  -3.684  -6.665
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.134  -4.344
  466   2HB   TRP  59          1HB       TRP  59  -2.167  -3.715  -3.948
  467    HD1  TRP  59           HD1      TRP  59  -3.604  -1.155  -6.511
  468    HE1  TRP  59           HE1      TRP  59  -2.119   0.903  -6.379
  469    HE3  TRP  59           HE3      TRP  59  -0.322  -2.655  -2.814
  470    HZ2  TRP  59           HZ2      TRP  59   0.090   1.800  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.153
  472    HH2  TRP  59           HH2      TRP  59   1.657   1.073  -3.214
  473    H    GLU  60           H        GLU  60  -3.998  -5.885  -4.553
  474    HA   GLU  60           HA       GLU  60  -2.181  -7.807  -3.913
  475   1HB   GLU  60          2HB       GLU  60  -4.937  -8.446  -4.978
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.489  -3.962
  477   1HG   GLU  60          2HG       GLU  60  -4.904  -6.876  -2.950
  478   2HG   GLU  60          1HG       GLU  60  -5.970  -8.292  -2.984
  479    H    GLU  61           H        GLU  61  -3.993  -7.515  -6.944
  480    HA   GLU  61           HA       GLU  61  -2.771  -9.827  -8.163
  481   1HB   GLU  61          2HB       GLU  61  -4.419  -7.607  -9.394
  482   2HB   GLU  61          1HB       GLU  61  -4.041  -9.165 -10.139
  483   1HG   GLU  61          2HG       GLU  61  -5.247  -9.498  -7.529
  484   2HG   GLU  61          1HG       GLU  61  -6.275  -8.537  -8.605
  485    H    GLY  62           H        GLY  62  -2.126  -6.340  -8.335
  486   1HA   GLY  62          2HA       GLY  62  -0.508  -6.786 -10.673
  487   2HA   GLY  62          1HA       GLY  62  -0.758  -5.249  -9.833
  488    H    VAL  63           H        VAL  63   0.133  -5.860  -7.306
  489    HA   VAL  63           HA       VAL  63   2.943  -5.682  -7.764
  490    HB   VAL  63           HB       VAL  63   1.302  -5.995  -5.198
  491   1HG1  VAL  63          1HG1      VAL  63   3.647  -6.695  -4.932
  492   2HG1  VAL  63          2HG1      VAL  63   3.349  -5.181  -4.083
  493   3HG1  VAL  63          3HG1      VAL  63   4.186  -5.171  -5.634
  494   1HG2  VAL  63          1HG2      VAL  63   0.933  -3.778  -6.427
  495   2HG2  VAL  63          2HG2      VAL  63   2.678  -3.532  -6.450
  496   3HG2  VAL  63          3HG2      VAL  63   1.807  -3.529  -4.916
  497    H    ALA  64           H        ALA  64   0.822  -8.472  -7.070
  498    HA   ALA  64           HA       ALA  64   2.871 -10.243  -6.295
  499   1HB   ALA  64          1HB       ALA  64   0.455 -10.983  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.405 -10.688  -6.179
  501   3HB   ALA  64          3HB       ALA  64   1.386 -12.007  -6.820
  502    H    GLN  65           H        GLN  65   2.108  -8.870  -9.375
  503    HA   GLN  65           HA       GLN  65   3.585 -10.842 -10.887
  504   1HB   GLN  65          2HB       GLN  65   2.246  -8.222 -11.564
  505   2HB   GLN  65          1HB       GLN  65   3.242  -9.099 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.822 -11.070 -12.541
  507   2HG   GLN  65          1HG       GLN  65   0.885 -10.308 -11.244
  508   1HE2  GLN  65          1HE2      GLN  65  -1.178  -9.486 -12.158
  509   2HE2  GLN  65          2HE2      GLN  65  -0.902  -8.128 -13.190
  510    H    MET  66           H        MET  66   4.751  -8.571  -8.816
  511    HA   MET  66           HA       MET  66   6.777  -7.620 -10.720
  512   1HB   MET  66          2HB       MET  66   5.985  -6.535  -8.024
  513   2HB   MET  66          1HB       MET  66   7.237  -5.864  -9.079
  514   1HG   MET  66          2HG       MET  66   5.597  -5.381 -10.782
  515   2HG   MET  66          1HG       MET  66   4.328  -6.153  -9.815
  516   1HE   MET  66          1HE       MET  66   7.230  -3.851  -8.685
  517   2HE   MET  66          2HE       MET  66   6.480  -2.254  -8.657
  518   3HE   MET  66          3HE       MET  66   6.730  -3.084 -10.192
  519    H    SER  67           H        SER  67   8.935  -7.974 -10.280
  520    HA   SER  67           HA       SER  67   9.649  -9.756  -8.078
  521   1HB   SER  67          2HB       SER  67  11.858  -9.704  -9.291
  522   2HB   SER  67          1HB       SER  67  10.495 -10.434 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.799 -11.555
  524    H    VAL  68           H        VAL  68  11.482  -9.147  -6.636
  525    HA   VAL  68           HA       VAL  68  11.309  -6.545  -5.629
  526    HB   VAL  68           HB       VAL  68  13.514  -8.620  -5.345
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.416  -3.309
  528   2HG1  VAL  68          2HG1      VAL  68  12.990  -6.166  -3.646
  529   3HG1  VAL  68          3HG1      VAL  68  14.360  -6.391  -4.732
  530   1HG2  VAL  68          1HG2      VAL  68  11.724  -9.651  -4.480
  531   2HG2  VAL  68          2HG2      VAL  68  10.883  -8.143  -4.130
  532   3HG2  VAL  68          3HG2      VAL  68  12.174  -8.699  -3.065
  533    H    GLY  69           H        GLY  69  12.137  -4.763  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.885  -3.301  -6.746
  535   2HA   GLY  69          1HA       GLY  69  14.459  -4.530  -7.883
  536    H    GLN  70           H        GLN  70  11.270  -4.686  -8.434
  537    HA   GLN  70           HA       GLN  70  11.690  -3.131 -10.841
  538   1HB   GLN  70          2HB       GLN  70  10.813  -5.488 -10.676
  539   2HB   GLN  70          1HB       GLN  70   9.325  -4.776 -10.035
  540   1HG   GLN  70          2HG       GLN  70   9.150  -3.444 -12.106
  541   2HG   GLN  70          1HG       GLN  70  10.538  -4.344 -12.742
  542   1HE2  GLN  70          2HE2      GLN  70   9.494  -7.239 -12.035
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.875 -11.427
  544    H    ARG  71           H        ARG  71  10.583  -1.587 -11.624
  545    HA   ARG  71           HA       ARG  71   8.697  -0.177  -9.845
  546   1HB   ARG  71          2HB       ARG  71  10.803   1.074 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.687   1.055 -11.765
  548   1HG   ARG  71          2HG       ARG  71   8.899   2.569 -11.794
  549   2HG   ARG  71          1HG       ARG  71   8.397   2.160 -10.145
  550   1HD   ARG  71          2HD       ARG  71  10.283   3.310  -9.214
  551   2HD   ARG  71          1HD       ARG  71  10.990   3.554 -10.820
  552    HE   ARG  71           HE       ARG  71   8.425   4.695 -10.780
  553   1HH1  ARG  71          2HH1      ARG  71  11.613   5.178  -9.290
  554   2HH1  ARG  71          1HH1      ARG  71  11.462   6.905  -9.285
  555   1HH2  ARG  71          1HH2      ARG  71   8.120   6.875 -10.464
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.882  -9.986
  557    H    ALA  72           H        ALA  72   6.801  -0.069 -10.812
  558    HA   ALA  72           HA       ALA  72   6.469  -0.150 -13.715
  559   1HB   ALA  72          1HB       ALA  72   5.011  -2.006 -13.695
  560   2HB   ALA  72          2HB       ALA  72   4.895  -1.997 -11.936
  561   3HB   ALA  72          3HB       ALA  72   6.392  -2.503 -12.718
  562    H    LYS  73           H        LYS  73   4.461   0.425 -14.506
  563    HA   LYS  73           HA       LYS  73   2.807   2.085 -12.736
  564   1HB   LYS  73          2HB       LYS  73   3.832   3.035 -14.745
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.822 -15.723
  566   1HG   LYS  73          2HG       LYS  73   0.828   2.876 -14.912
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.218 -14.336
  568   1HD   LYS  73          2HD       LYS  73   2.965   4.301 -16.496
  569   2HD   LYS  73          1HD       LYS  73   1.971   2.954 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.017   4.448 -16.678
  571   2HE   LYS  73          1HE       LYS  73   1.148   5.769 -16.499
  572   1HZ   LYS  73          1HZ       LYS  73   0.808   4.007 -18.847
  573   2HZ   LYS  73          2HZ       LYS  73   2.038   5.156 -18.683
  574   3HZ   LYS  73          3HZ       LYS  73   0.408   5.647 -18.751
  575    H    LEU  74           H        LEU  74   0.909   1.251 -12.075
  576    HA   LEU  74           HA       LEU  74  -0.136  -1.172 -13.369
  577   1HB   LEU  74          2HB       LEU  74   0.213  -0.093 -10.655
  578   2HB   LEU  74          1HB       LEU  74  -1.341  -0.881 -10.938
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.000 -11.004
  580   1HD1  LEU  74          1HD1      LEU  74   1.990  -3.482 -11.265
  581   2HD1  LEU  74          2HD1      LEU  74   2.322  -1.757 -11.424
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.587 -12.650
  583   1HD2  LEU  74          1HD2      LEU  74  -0.467  -1.889  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.230  -1.448  -9.035
  585   3HD2  LEU  74          3HD2      LEU  74   0.766  -3.147  -8.938
  586    H    THR  75           H        THR  75  -1.869  -0.573 -14.789
  587    HA   THR  75           HA       THR  75  -3.498   1.772 -14.023
  588    HB   THR  75           HB       THR  75  -3.435   0.123 -16.597
  589    HG1  THR  75           HG1      THR  75  -1.653   1.267 -16.760
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.967 -17.628
  591   2HG2  THR  75          2HG2      THR  75  -4.844   2.694 -16.038
  592   3HG2  THR  75          3HG2      THR  75  -5.576   1.134 -16.413
  593    H    ILE  76           H        ILE  76  -5.455   1.332 -12.988
  594    HA   ILE  76           HA       ILE  76  -6.290  -1.484 -12.781
  595    HB   ILE  76           HB       ILE  76  -6.388   0.673 -10.636
  596   1HG1  ILE  76          2HG1      ILE  76  -4.508  -1.673 -10.946
  597   2HG1  ILE  76          1HG1      ILE  76  -4.084   0.026 -11.221
  598   1HG2  ILE  76          1HG2      ILE  76  -7.210  -2.170 -10.634
  599   2HG2  ILE  76          2HG2      ILE  76  -8.131  -0.726 -10.215
  600   3HG2  ILE  76          3HG2      ILE  76  -6.833  -1.283  -9.156
  601   1HD1  ILE  76          1HD1      ILE  76  -4.414  -1.467  -8.692
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.220  -8.708
  603   3HD1  ILE  76          3HD1      ILE  76  -3.266  -0.199  -9.126
  604    H    SER  77           H        SER  77  -8.340  -1.762 -13.535
  605    HA   SER  77           HA       SER  77 -10.075   0.348 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.734  -1.397 -14.644
  607   2HB   SER  77          1HB       SER  77 -10.164  -1.886 -15.293
  608    HG   SER  77           HG       SER  77 -11.682  -3.015 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.059   1.321 -10.424
  610   1HB   PRO  78          2HB       PRO  78 -14.775   1.357 -11.227
  611   2HB   PRO  78          1HB       PRO  78 -13.689   2.734 -11.185
  612   1HG   PRO  78          2HG       PRO  78 -14.506   1.056 -13.514
  613   2HG   PRO  78          1HG       PRO  78 -14.013   2.741 -13.487
  614   1HD   PRO  78          1HD       PRO  78 -12.359   0.789 -14.397
  615   2HD   PRO  78          2HD       PRO  78 -11.741   2.212 -13.585
  616    H    ASP  79           H        ASP  79 -13.479  -1.462 -12.055
  617    HA   ASP  79           HA       ASP  79 -14.745  -2.335  -9.643
  618   1HB   ASP  79          2HB       ASP  79 -15.146  -4.410 -10.854
  619   2HB   ASP  79          1HB       ASP  79 -15.490  -3.031 -11.909
  620    H    TYR  80           H        TYR  80 -11.545  -2.401 -10.612
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.456  -8.686
  622   1HB   TYR  80          2HB       TYR  80  -9.559  -3.182 -11.070
  623   2HB   TYR  80          1HB       TYR  80  -8.480  -3.756  -9.788
  624    HD1  TYR  80           HD1      TYR  80 -11.503  -4.892 -11.641
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.878
  626    HE1  TYR  80           HE1      TYR  80 -11.700  -7.200 -12.484
  627    HE2  TYR  80           HE2      TYR  80  -7.919  -8.146 -10.691
  628    HH   TYR  80           HH       TYR  80  -8.976  -9.435 -12.229
  629    H    ALA  81           H        ALA  81 -11.563  -1.443  -8.396
  630    HA   ALA  81           HA       ALA  81  -9.392  -0.750  -6.537
  631   1HB   ALA  81          1HB       ALA  81  -9.044   0.365  -8.763
  632   2HB   ALA  81          2HB       ALA  81  -9.309   1.510  -7.447
  633   3HB   ALA  81          3HB       ALA  81 -10.616   1.141  -8.573
  634    H    TYR  82           H        TYR  82 -11.706   1.777  -7.022
  635    HA   TYR  82           HA       TYR  82 -13.144   0.957  -4.575
  636   1HB   TYR  82          2HB       TYR  82 -12.502   3.643  -5.851
  637   2HB   TYR  82          1HB       TYR  82 -13.463   3.449  -4.376
  638    HD1  TYR  82           HD1      TYR  82 -12.314   2.134  -2.428
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.941  -5.710
  640    HE1  TYR  82           HE1      TYR  82 -10.207   2.035  -1.126
  641    HE2  TYR  82           HE2      TYR  82  -8.142   3.838  -4.422
  642    HH   TYR  82           HH       TYR  82  -7.555   3.779  -1.856
  643    H    GLY  83           H        GLY  83 -13.805   0.862  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.708   0.432  -8.896
  645   2HA   GLY  83          1HA       GLY  83 -16.439   0.099  -7.320
  646    H    ALA  84           H        ALA  84 -18.268   0.982  -7.434
  647    HA   ALA  84           HA       ALA  84 -18.706   3.584  -8.634
  648   1HB   ALA  84          1HB       ALA  84 -20.323   1.692  -8.790
  649   2HB   ALA  84          2HB       ALA  84 -21.023   3.180  -8.157
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.863  -7.059
  651    H    THR  85           H        THR  85 -18.020   2.428  -5.346
  652    HA   THR  85           HA       THR  85 -19.182   4.738  -4.102
  653    HB   THR  85           HB       THR  85 -16.856   3.115  -3.033
  654    HG1  THR  85           HG1      THR  85 -19.571   2.454  -2.690
  655   1HG2  THR  85          1HG2      THR  85 -19.157   4.616  -1.812
  656   2HG2  THR  85          2HG2      THR  85 -17.431   4.851  -1.533
  657   3HG2  THR  85          3HG2      THR  85 -18.237   3.408  -0.915
  658    H    GLY  86           H        GLY  86 -15.914   4.003  -5.319
  659   1HA   GLY  86          2HA       GLY  86 -14.099   5.463  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.216   6.806  -5.306
  661    H    HIS  87           H        HIS  87 -13.165   7.511  -3.886
  662    HA   HIS  87           HA       HIS  87 -13.463   6.202  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.189   6.024  -2.258
  664   2HB   HIS  87          1HB       HIS  87 -11.086   7.793  -2.211
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.797   0.416
  666    HD2  HIS  87           HD2      HIS  87 -10.710   4.670  -0.091
  667    HE1  HIS  87           HE1      HIS  87 -10.103   7.851   2.598
  668    HE2  HIS  87           HE2      HIS  87 -10.002   5.371   2.223
  669    HA   PRO  88           HA       PRO  88 -15.772  10.119  -0.978
  670   1HB   PRO  88          2HB       PRO  88 -15.861  10.504   1.732
  671   2HB   PRO  88          1HB       PRO  88 -16.876   9.331   0.912
  672   1HG   PRO  88          2HG       PRO  88 -14.225   8.864   2.307
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.496
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.988   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.540   6.972   0.308
  676    H    GLY  89           H        GLY  89 -15.167  11.873  -1.573
  677   1HA   GLY  89          2HA       GLY  89 -14.150  13.913  -1.651
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.213
  679    H    ILE  90           H        ILE  90 -12.042  11.022  -1.770
  680    HA   ILE  90           HA       ILE  90  -9.978  12.655  -3.118
  681    HB   ILE  90           HB       ILE  90  -9.842   9.884  -1.827
  682   1HG1  ILE  90          2HG1      ILE  90  -8.445  12.389  -0.969
  683   2HG1  ILE  90          1HG1      ILE  90 -10.099  12.030  -0.442
  684   1HG2  ILE  90          1HG2      ILE  90  -7.308  10.385  -1.933
  685   2HG2  ILE  90          2HG2      ILE  90  -7.713  11.627  -3.117
  686   3HG2  ILE  90          3HG2      ILE  90  -8.067   9.933  -3.460
  687   1HD1  ILE  90          1HD1      ILE  90  -9.336  10.708   1.164
  688   2HD1  ILE  90          2HD1      ILE  90  -7.694  11.180   0.726
  689   3HD1  ILE  90          3HD1      ILE  90  -8.425   9.750  -0.003
  690    H    ILE  91           H        ILE  91 -11.666   9.563  -3.637
  691    HA   ILE  91           HA       ILE  91 -10.633   9.708  -6.402
  692    HB   ILE  91           HB       ILE  91 -11.716   7.253  -4.977
  693   1HG1  ILE  91          2HG1      ILE  91  -9.603   7.976  -3.972
  694   2HG1  ILE  91          1HG1      ILE  91  -9.414   6.461  -4.872
  695   1HG2  ILE  91          1HG2      ILE  91 -10.553   6.112  -6.910
  696   2HG2  ILE  91          2HG2      ILE  91 -10.440   7.708  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.021   7.012  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.508   7.969  -5.200
  699   2HD1  ILE  91          2HD1      ILE  91  -8.593   9.196  -5.853
  700   3HD1  ILE  91          3HD1      ILE  91  -8.369   7.672  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.250  10.299  -7.057
  702   1HB   PRO  92          2HB       PRO  92 -14.681   9.827  -9.876
  703   2HB   PRO  92          1HB       PRO  92 -15.347  11.254  -9.100
  704   1HG   PRO  92          2HG       PRO  92 -12.860  11.317 -10.115
  705   2HG   PRO  92          1HG       PRO  92 -13.210  12.133  -8.601
  706   1HD   PRO  92          1HD       PRO  92 -12.060   9.356  -8.998
  707   2HD   PRO  92          2HD       PRO  92 -11.420  10.653  -8.011
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.869
  709   1HB   PRO  93          2HB       PRO  93 -18.920   7.282  -9.559
  710   2HB   PRO  93          1HB       PRO  93 -19.087   6.342  -8.086
  711   1HG   PRO  93          2HG       PRO  93 -19.618   9.037  -8.232
  712   2HG   PRO  93          1HG       PRO  93 -19.150   8.220  -6.750
  713   1HD   PRO  93          1HD       PRO  93 -17.515   9.978  -8.525
  714   2HD   PRO  93          2HD       PRO  93 -17.370   9.713  -6.799
  715    H    HIS  94           H        HIS  94 -16.501   4.743  -9.378
  716    HA   HIS  94           HA       HIS  94 -15.945   3.694 -11.309
  717   1HB   HIS  94          2HB       HIS  94 -17.266   6.169 -12.563
  718   2HB   HIS  94          1HB       HIS  94 -16.932   4.652 -13.416
  719    HD1  HIS  94           HD1      HIS  94 -18.295   2.486 -12.154
  720    HD2  HIS  94           HD2      HIS  94 -19.607   6.359 -11.436
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.310 -11.165
  722    HE2  HIS  94           HE2      HIS  94 -21.352   4.658 -10.759
  723    H    ALA  95           H        ALA  95 -13.895   5.538 -10.142
  724    HA   ALA  95           HA       ALA  95 -12.523   6.636 -12.450
  725   1HB   ALA  95          1HB       ALA  95 -12.629   7.329  -9.871
  726   2HB   ALA  95          2HB       ALA  95 -11.237   7.693 -10.891
  727   3HB   ALA  95          3HB       ALA  95 -11.203   6.294  -9.819
  728    H    THR  96           H        THR  96 -10.925   5.699 -13.745
  729    HA   THR  96           HA       THR  96  -9.715   3.198 -13.010
  730    HB   THR  96           HB       THR  96  -9.160   5.171 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.420   3.812 -16.393
  732   1HG2  THR  96          1HG2      THR  96  -7.731   2.635 -14.646
  733   2HG2  THR  96          2HG2      THR  96  -7.064   4.252 -14.874
  734   3HG2  THR  96          3HG2      THR  96  -7.754   3.382 -16.244
  735    H    LEU  97           H        LEU  97  -7.696   3.077 -11.872
  736    HA   LEU  97           HA       LEU  97  -6.463   5.643 -11.104
  737   1HB   LEU  97          2HB       LEU  97  -6.522   2.946  -9.734
  738   2HB   LEU  97          1HB       LEU  97  -5.731   4.393  -9.103
  739    HG   LEU  97           HG       LEU  97  -8.695   3.976  -9.442
  740   1HD1  LEU  97          1HD1      LEU  97  -8.706   3.954  -7.053
  741   2HD1  LEU  97          2HD1      LEU  97  -6.988   4.351  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.511   2.781  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.504   6.246  -9.826
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.407  -8.822
  745   3HD2  LEU  97          3HD2      LEU  97  -8.644   6.199  -8.068
  746    H    VAL  98           H        VAL  98  -4.208   5.849 -11.143
  747    HA   VAL  98           HA       VAL  98  -2.849   3.761 -12.691
  748    HB   VAL  98           HB       VAL  98  -2.520   6.782 -12.881
  749   1HG1  VAL  98          1HG1      VAL  98  -1.025   4.460 -14.105
  750   2HG1  VAL  98          2HG1      VAL  98  -0.379   5.704 -13.035
  751   3HG1  VAL  98          3HG1      VAL  98  -0.882   6.124 -14.673
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.908 -15.158
  753   2HG2  VAL  98          2HG2      VAL  98  -3.416   6.653 -15.063
  754   3HG2  VAL  98          3HG2      VAL  98  -4.469   5.573 -14.149
  755    H    PHE  99           H        PHE  99  -1.241   2.912 -11.257
  756    HA   PHE  99           HA       PHE  99  -0.234   4.767  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.720   1.816  -9.169
  758   2HB   PHE  99          1HB       PHE  99   0.436   2.563  -8.052
  759    HD1  PHE  99           HD1      PHE  99  -3.098   2.161  -8.946
  760    HD2  PHE  99           HD2      PHE  99  -0.265   3.912  -6.250
  761    HE1  PHE  99           HE1      PHE  99  -4.903   2.660  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.088   4.403  -4.662
  763    HZ   PHE  99           HZ       PHE  99  -4.397   3.778  -5.220
  764    H    ASP 100           H        ASP 100   1.948   5.077  -9.151
  765    HA   ASP 100           HA       ASP 100   3.710   3.599 -10.964
  766   1HB   ASP 100          2HB       ASP 100   3.847   5.985 -11.158
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.148  -9.410
  768    H    VAL 101           H        VAL 101   4.563   1.928  -9.767
  769    HA   VAL 101           HA       VAL 101   4.828   2.054  -6.828
  770    HB   VAL 101           HB       VAL 101   3.653  -0.202  -8.531
  771   1HG1  VAL 101          1HG1      VAL 101   3.149  -1.242  -6.290
  772   2HG1  VAL 101          2HG1      VAL 101   4.248  -0.060  -5.580
  773   3HG1  VAL 101          3HG1      VAL 101   4.851  -1.233  -6.751
  774   1HG2  VAL 101          1HG2      VAL 101   1.644   0.199  -7.113
  775   2HG2  VAL 101          2HG2      VAL 101   2.123   1.754  -7.796
  776   3HG2  VAL 101          3HG2      VAL 101   2.550   1.352  -6.133
  777    H    GLU 102           H        GLU 102   6.714   1.361  -6.030
  778    HA   GLU 102           HA       GLU 102   8.510  -0.105  -7.838
  779   1HB   GLU 102          2HB       GLU 102   9.367   2.099  -7.493
  780   2HB   GLU 102          1HB       GLU 102   9.085   1.987  -5.749
  781   1HG   GLU 102          2HG       GLU 102  10.832   0.481  -5.436
  782   2HG   GLU 102          1HG       GLU 102  10.875   0.034  -7.151
  783    H    LEU 103           H        LEU 103   8.833  -2.172  -7.007
  784    HA   LEU 103           HA       LEU 103   8.027  -2.669  -4.240
  785   1HB   LEU 103          2HB       LEU 103   7.226  -4.249  -5.862
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.467  -6.530
  787    HG   LEU 103           HG       LEU 103   9.548  -5.664  -4.532
  788   1HD1  LEU 103          1HD1      LEU 103   6.782  -4.963  -3.524
  789   2HD1  LEU 103          2HD1      LEU 103   8.336  -4.624  -2.761
  790   3HD1  LEU 103          3HD1      LEU 103   7.734  -6.279  -2.837
  791   1HD2  LEU 103          1HD2      LEU 103   7.982  -7.615  -4.731
  792   2HD2  LEU 103          2HD2      LEU 103   8.588  -7.006  -6.270
  793   3HD2  LEU 103          3HD2      LEU 103   6.951  -6.610  -5.747
  794    H    LEU 104           H        LEU 104   9.457  -2.278  -2.766
  795    HA   LEU 104           HA       LEU 104  12.289  -2.024  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.806  -1.446  -0.821
  797   2HB   LEU 104          1HB       LEU 104  12.475  -0.996  -1.181
  798    HG   LEU 104           HG       LEU 104  10.041   0.191  -2.506
  799   1HD1  LEU 104          1HD1      LEU 104  10.369   0.799  -0.054
  800   2HD1  LEU 104          2HD1      LEU 104  10.327   2.141  -1.199
  801   3HD1  LEU 104          3HD1      LEU 104  11.870   1.578  -0.556
  802   1HD2  LEU 104          1HD2      LEU 104  12.275   0.035  -3.735
  803   2HD2  LEU 104          2HD2      LEU 104  12.924   1.104  -2.493
  804   3HD2  LEU 104          3HD2      LEU 104  11.621   1.661  -3.544
  805    H    LYS 105           H        LYS 105  10.328  -4.008  -1.312
  806    HA   LYS 105           HA       LYS 105  12.566  -5.750  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.825  -3.636   0.612
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.082   1.447
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.014   2.348
  810   2HG   LYS 105          1HG       LYS 105  13.833  -5.709   1.415
  811   1HD   LYS 105          2HD       LYS 105  14.217  -3.641   2.556
  812   2HD   LYS 105          1HD       LYS 105  12.614  -3.694   3.310
  813   1HE   LYS 105          2HE       LYS 105  13.276  -5.923   4.301
  814   2HE   LYS 105          1HE       LYS 105  14.924  -5.602   3.733
  815   1HZ   LYS 105          1HZ       LYS 105  13.454  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.253  -3.309   4.908
  817   3HZ   LYS 105          3HZ       LYS 105  15.123  -4.567   5.660
  818    H    LEU 106           H        LEU 106  11.794  -7.703   0.371
  819    HA   LEU 106           HA       LEU 106   8.922  -7.756   1.010
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.084   0.182
  821   2HB   LEU 106          1HB       LEU 106   8.991 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.870  -8.834  -1.808
  823   1HD1  LEU 106          1HD1      LEU 106   8.415 -11.425  -1.349
  824   2HD1  LEU 106          2HD1      LEU 106  10.120 -11.286  -1.775
  825   3HD1  LEU 106          3HD1      LEU 106   8.883 -10.734  -2.904
  826   1HD2  LEU 106          1HD2      LEU 106   7.567  -8.573  -2.322
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.674
  828   3HD2  LEU 106          3HD2      LEU 106   7.072  -9.577  -0.959
  829    H    GLU 107           HN       GLU 107   8.525  -8.269   3.051
  830    HA   GLU 107           HA       GLU 107  10.717  -9.186   4.800
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.228   5.416
  832   2HB   GLU 107          1HB       GLU 107   9.696  -7.832   6.579
  833   1HG   GLU 107          2HG       GLU 107  11.467  -6.821   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.234  -6.152   4.165
  835    H2   GPI 108           H2       GPI 108  -4.802   1.141  -1.348
  836   1H5   GPI 108          1H5       GPI 108  -3.394   3.555  -2.610
  837   2H5   GPI 108          2H5       GPI 108  -2.255   4.044  -1.341
  838   1H3   GPI 108          1H3       GPI 108  -2.674  -0.099  -1.492
  839   2H3   GPI 108          2H3       GPI 108  -2.014   0.725  -0.069
  840   1H4   GPI 108          1H4       GPI 108  -2.183   1.613  -2.948
  841   2H4   GPI 108          2H4       GPI 108  -0.987   2.133  -1.721
  842   1H14  GPI 108          1H14      GPI 108  -6.722   1.467   1.544
  843   2H14  GPI 108          2H14      GPI 108  -6.734   1.109  -0.197
  844   1H15  GPI 108          1H15      GPI 108  -8.338  -0.476   0.058
  845   2H15  GPI 108          2H15      GPI 108  -7.469  -1.239   1.408
  846   1H16  GPI 108          1H16      GPI 108  -9.081  -0.413   2.781
  847   2H16  GPI 108          2H16      GPI 108  -8.404   1.202   2.470
  848    H20  GPI 108           H20      GPI 108 -13.431   1.695  -0.585
  849    H21  GPI 108           H21      GPI 108 -12.342  -0.498  -1.052
  850    H22  GPI 108           H22      GPI 108 -10.235  -1.109   0.131
  851    H18  GPI 108           H18      GPI 108 -10.306   2.638   2.247
  852   1H12  GPI 108          1H12      GPI 108  -7.309   6.587   0.799
  853   2H12  GPI 108          2H12      GPI 108  -7.371   5.127  -0.146
  854   3H12  GPI 108          3H12      GPI 108  -6.469   5.159   1.357
  855   1H13  GPI 108          1H13      GPI 108  -6.815   5.798  -1.960
  856   2H13  GPI 108          2H13      GPI 108  -5.608   7.067  -2.239
  857   3H13  GPI 108          3H13      GPI 108  -5.116   5.349  -2.254
  858   1H10  GPI 108          1H10      GPI 108  -4.941   7.671   1.163
  859   2H10  GPI 108          2H10      GPI 108  -4.255   7.922  -0.460
  860   1H11  GPI 108          1H11      GPI 108  -6.982   8.040  -0.928
  861   2H11  GPI 108          2H11      GPI 108  -6.849   8.786   0.640
  862   3H11  GPI 108          3H11      GPI 108  -5.949   9.434  -0.718
  Start of MODEL    8
    1   1H    GLY   1          1H        GLY   1 -10.185  -5.720 -15.430
    2   2H    GLY   1          2H        GLY   1  -9.174  -4.435 -15.867
    3   3H    GLY   1          3H        GLY   1  -9.874  -4.486 -14.314
    4   1HA   GLY   1          1HA       GLY   1  -8.596  -6.396 -13.736
    5   2HA   GLY   1          2HA       GLY   1  -7.913  -6.427 -15.369
    6    H    VAL   2           H        VAL   2  -5.836  -6.109 -14.257
    7    HA   VAL   2           HA       VAL   2  -5.182  -3.271 -13.801
    8    HB   VAL   2           HB       VAL   2  -5.014  -4.369 -11.645
    9   1HG1  VAL   2          1HG1      VAL   2  -5.039  -6.652 -11.976
   10   2HG1  VAL   2          2HG1      VAL   2  -3.356  -6.387 -11.517
   11   3HG1  VAL   2          3HG1      VAL   2  -3.785  -6.591 -13.216
   12   1HG2  VAL   2          1HG2      VAL   2  -2.739  -3.983 -11.114
   13   2HG2  VAL   2          2HG2      VAL   2  -2.994  -2.999 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.184  -4.560 -12.685
   15    H    GLN   3           H        GLN   3  -3.403  -2.742 -15.042
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.697 -16.957
   17   1HB   GLN   3          2HB       GLN   3  -3.649  -3.062 -17.956
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.783 -16.985
   19   1HG   GLN   3          2HG       GLN   3  -0.839  -2.076 -18.217
   20   2HG   GLN   3          1HG       GLN   3  -1.636  -3.298 -19.224
   21   1HE2  GLN   3          1HE2      GLN   3  -0.895  -0.070 -19.216
   22   2HE2  GLN   3          2HE2      GLN   3  -2.174   0.476 -20.243
   23    H    VAL   4           H        VAL   4   0.027  -4.828 -16.596
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.552
   25    HB   VAL   4           HB       VAL   4   1.947  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.455  -5.606 -13.276
   27   2HG1  VAL   4          2HG1      VAL   4   3.338  -3.909 -13.739
   28   3HG1  VAL   4          3HG1      VAL   4   4.020  -5.085 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.680  -6.753 -13.786
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.128 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.452  -5.692 -12.607
   32    H    GLU   5           H        GLU   5   2.590  -1.532 -15.722
   33    HA   GLU   5           HA       GLU   5   3.858  -2.504 -18.205
   34   1HB   GLU   5          2HB       GLU   5   3.406   0.409 -17.571
   35   2HB   GLU   5          1HB       GLU   5   3.766  -0.336 -19.133
   36   1HG   GLU   5          2HG       GLU   5   1.576  -0.578 -19.581
   37   2HG   GLU   5          1HG       GLU   5   1.316  -1.439 -18.055
   38    H    THR   6           H        THR   6   6.172  -2.560 -17.862
   39    HA   THR   6           HA       THR   6   7.248  -1.666 -15.326
   40    HB   THR   6           HB       THR   6   8.546  -2.886 -17.813
   41    HG1  THR   6           HG1      THR   6   7.714  -4.259 -15.468
   42   1HG2  THR   6          1HG2      THR   6  10.110  -3.769 -15.964
   43   2HG2  THR   6          2HG2      THR   6   9.626  -2.270 -15.172
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.222 -16.772
   45    H    ILE   7           H        ILE   7   8.484  -0.099 -14.755
   46    HA   ILE   7           HA       ILE   7   9.325   1.985 -16.648
   47    HB   ILE   7           HB       ILE   7   9.174   1.956 -13.593
   48   1HG1  ILE   7          2HG1      ILE   7   7.572   3.424 -15.704
   49   2HG1  ILE   7          1HG1      ILE   7   7.037   1.948 -14.884
   50   1HG2  ILE   7          1HG2      ILE   7  10.901   3.493 -13.979
   51   2HG2  ILE   7          2HG2      ILE   7   9.450   4.491 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.147   4.116 -15.447
   53   1HD1  ILE   7          1HD1      ILE   7   6.104   4.220 -14.094
   54   2HD1  ILE   7          2HD1      ILE   7   7.674   4.426 -13.317
   55   3HD1  ILE   7          3HD1      ILE   7   6.645   3.063 -12.878
   56    H    SER   8           H        SER   8  10.603  -0.023 -13.868
   57    HA   SER   8           HA       SER   8  13.150  -0.215 -15.311
   58   1HB   SER   8          2HB       SER   8  12.963   0.239 -12.319
   59   2HB   SER   8          1HB       SER   8  14.444   0.043 -13.266
   60    HG   SER   8           HG       SER   8  13.494   1.891 -14.558
   61    HA   PRO   9           HA       PRO   9  12.195  -4.488 -14.335
   62   1HB   PRO   9          2HB       PRO   9  15.068  -4.994 -14.687
   63   2HB   PRO   9          1HB       PRO   9  13.701  -5.633 -15.584
   64   1HG   PRO   9          2HG       PRO   9  15.266  -3.814 -16.725
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.707 -16.934
   66   1HD   PRO   9          1HD       PRO   9  15.271  -2.167 -14.991
   67   2HD   PRO   9          2HD       PRO   9  14.047  -1.540 -16.074
   68    H    GLY  10           H        GLY  10  12.403  -6.054 -12.857
   69   1HA   GLY  10          2HA       GLY  10  13.702  -5.350 -10.325
   70   2HA   GLY  10          1HA       GLY  10  12.398  -6.526 -10.542
   71    H    ASP  11           H        ASP  11  13.970  -8.174  -9.354
   72    HA   ASP  11           HA       ASP  11  16.402  -8.727 -10.873
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.364  -9.171
   74   2HB   ASP  11          1HB       ASP  11  16.351  -8.883  -8.382
   75    H    GLY  12           H        GLY  12  13.238  -9.674 -11.217
   76   1HA   GLY  12          2HA       GLY  12  12.271 -11.204 -12.649
   77   2HA   GLY  12          1HA       GLY  12  13.901 -11.647 -13.185
   78    H    ARG  13           H        ARG  13  13.568 -12.072  -9.752
   79    HA   ARG  13           HA       ARG  13  12.730 -14.856 -10.202
   80   1HB   ARG  13          2HB       ARG  13  15.051 -14.303  -8.384
   81   2HB   ARG  13          1HB       ARG  13  14.617 -15.801  -9.217
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.962 -11.270
   83   2HG   ARG  13          1HG       ARG  13  15.849 -13.398 -10.515
   84   1HD   ARG  13          2HD       ARG  13  17.938 -14.356 -10.543
   85   2HD   ARG  13          1HD       ARG  13  17.368 -14.839  -8.939
   86    HE   ARG  13           HE       ARG  13  16.907 -17.032  -9.825
   87   1HH1  ARG  13          1HH1      ARG  13  18.197 -15.234 -12.844
   88   2HH1  ARG  13          2HH1      ARG  13  19.703 -15.786 -12.190
   89   1HH2  ARG  13          1HH2      ARG  13  17.672 -18.714 -11.201
   90   2HH2  ARG  13          2HH2      ARG  13  18.636 -18.327 -12.589
   91    H    THR  14           H        THR  14  12.902 -12.176  -7.902
   92    HA   THR  14           HA       THR  14  11.726 -13.894  -5.806
   93    HB   THR  14           HB       THR  14  12.787 -11.053  -5.377
   94    HG1  THR  14           HG1      THR  14  14.553 -12.027  -6.113
   95   1HG2  THR  14          1HG2      THR  14  12.295 -13.321  -3.517
   96   2HG2  THR  14          2HG2      THR  14  11.882 -11.615  -3.351
   97   3HG2  THR  14          3HG2      THR  14  13.559 -12.136  -3.191
   98    H    PHE  15           H        PHE  15   9.638 -13.948  -6.442
   99    HA   PHE  15           HA       PHE  15   8.162 -11.405  -6.743
  100   1HB   PHE  15          2HB       PHE  15   7.407 -14.235  -7.451
  101   2HB   PHE  15          1HB       PHE  15   6.392 -12.808  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.945 -11.192  -9.436
  103    HD2  PHE  15           HD2      PHE  15   9.293 -14.723  -8.926
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.859 -11.647
  105    HE2  PHE  15           HE2      PHE  15  10.270 -14.360 -11.158
  106    HZ   PHE  15           HZ       PHE  15   9.599 -12.445 -12.505
  107    HA   PRO  16           HA       PRO  16   6.582 -11.998  -2.683
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.531  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.840  -9.829  -2.629
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.092  -5.200
  111   2HG   PRO  16          1HG       PRO  16   5.229  -8.736  -4.652
  112   1HD   PRO  16          1HD       PRO  16   6.218 -10.465  -6.439
  113   2HD   PRO  16          2HD       PRO  16   7.246  -9.797  -5.189
  114    H    LYS  17           H        LYS  17   5.300 -13.161  -1.505
  115    HA   LYS  17           HA       LYS  17   3.409 -14.927  -2.910
  116   1HB   LYS  17          2HB       LYS  17   5.300 -15.563  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.167 -16.703  -1.348
  118   1HG   LYS  17          2HG       LYS  17   6.218 -15.321  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.667 -16.742  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.454 -18.131  -3.361
  121   2HD   LYS  17          1HD       LYS  17   4.100 -16.993  -3.457
  122   1HE   LYS  17          2HE       LYS  17   6.461 -16.407  -5.140
  123   2HE   LYS  17          1HE       LYS  17   5.470 -17.804  -5.593
  124   1HZ   LYS  17          1HZ       LYS  17   4.772 -15.768  -6.650
  125   2HZ   LYS  17          2HZ       LYS  17   4.466 -15.075  -5.138
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.424  -5.664
  127    H    ARG  18           H        ARG  18   1.602 -15.579  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.732   0.103
  129   1HB   ARG  18          2HB       ARG  18  -0.556 -15.878  -0.971
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.687   0.495
  131   1HG   ARG  18          2HG       ARG  18  -1.228 -14.883   1.777
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.488   0.238
  133   1HD   ARG  18          2HD       ARG  18  -3.316 -15.945   1.818
  134   2HD   ARG  18          1HD       ARG  18  -3.128 -16.548   0.164
  135    HE   ARG  18           HE       ARG  18  -1.063 -17.635   1.569
  136   1HH1  ARG  18          2HH1      ARG  18  -4.658 -18.505   1.492
  137   2HH1  ARG  18          1HH1      ARG  18  -4.458 -18.842   3.179
  138   1HH2  ARG  18          2HH2      ARG  18  -1.542 -19.659   3.426
  139   2HH2  ARG  18          1HH2      ARG  18  -1.805 -20.426   1.896
  140    H    GLY  19           H        GLY  19   0.549 -13.147   2.148
  141   1HA   GLY  19          2HA       GLY  19   0.935 -13.448   4.429
  142   2HA   GLY  19          1HA       GLY  19   1.905 -14.879   4.045
  143    H    GLN  20           H        GLN  20   3.267 -12.976   1.915
  144    HA   GLN  20           HA       GLN  20   5.253 -11.988   3.784
  145   1HB   GLN  20          2HB       GLN  20   5.101 -11.879   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.431 -11.204   1.722
  147   1HG   GLN  20          2HG       GLN  20   6.842 -13.491   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.124   1.569
  149   1HE2  GLN  20          1HE2      GLN  20   8.886 -13.777   1.915
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.643   0.258
  151    H    THR  21           H        THR  21   5.899  -9.935   4.063
  152    HA   THR  21           HA       THR  21   3.948  -7.848   3.443
  153    HB   THR  21           HB       THR  21   6.487  -7.829   5.133
  154    HG1  THR  21           HG1      THR  21   5.082  -8.527   6.606
  155   1HG2  THR  21          1HG2      THR  21   4.528  -5.600   4.682
  156   2HG2  THR  21          2HG2      THR  21   6.269  -5.594   4.395
  157   3HG2  THR  21          3HG2      THR  21   5.646  -5.683   6.043
  158    H    CYS  22           H        CYS  22   4.053  -6.679   1.689
  159    HA   CYS  22           HA       CYS  22   6.559  -6.385   0.225
  160   1HB   CYS  22          2HB       CYS  22   3.813  -5.362  -0.485
  161   2HB   CYS  22          1HB       CYS  22   5.233  -5.434  -1.545
  162    HG   CYS  22           HG       CYS  22   4.729  -7.766  -2.075
  163    H    VAL  23           H        VAL  23   7.677  -4.551   0.161
  164    HA   VAL  23           HA       VAL  23   6.772  -2.298   1.836
  165    HB   VAL  23           HB       VAL  23   9.632  -3.180   1.169
  166   1HG1  VAL  23          1HG1      VAL  23   8.492  -0.920   2.758
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.947   1.693
  168   3HG1  VAL  23          3HG1      VAL  23   9.997  -1.664   3.301
  169   1HG2  VAL  23          1HG2      VAL  23   7.797  -3.857   3.413
  170   2HG2  VAL  23          2HG2      VAL  23   9.510  -3.641   3.772
  171   3HG2  VAL  23          3HG2      VAL  23   9.000  -4.856   2.599
  172    H    VAL  24           H        VAL  24   6.137  -0.648   0.303
  173    HA   VAL  24           HA       VAL  24   7.580  -0.657  -2.262
  174    HB   VAL  24           HB       VAL  24   5.483  -0.200  -3.508
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.631  -1.779
  176   2HG1  VAL  24          2HG1      VAL  24   6.177  -2.583  -3.106
  177   3HG1  VAL  24          3HG1      VAL  24   4.459  -2.363  -3.429
  178   1HG2  VAL  24          1HG2      VAL  24   3.268  -0.454  -2.326
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.958  -1.798
  180   3HG2  VAL  24          3HG2      VAL  24   4.140  -0.490  -0.794
  181    H    HIS  25           H        HIS  25   7.789   1.373  -3.359
  182    HA   HIS  25           HA       HIS  25   6.700   3.596  -1.768
  183   1HB   HIS  25          2HB       HIS  25   9.117   3.369  -3.378
  184   2HB   HIS  25          1HB       HIS  25   8.118   4.723  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.080   5.443  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.969   4.836  -2.108
  187    HE1  HIS  25           HE1      HIS  25   8.512   6.539   0.827
  188    HE2  HIS  25           HE2      HIS  25  10.844   6.127   0.050
  189    H    TYR  26           H        TYR  26   5.065   5.001  -2.882
  190    HA   TYR  26           HA       TYR  26   4.445   4.247  -5.634
  191   1HB   TYR  26          2HB       TYR  26   2.139   3.707  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.742  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.748   5.510  -4.440
  194    HD2  TYR  26           HD2      TYR  26   2.894   3.061  -1.679
  195    HE1  TYR  26           HE1      TYR  26  -0.613   6.407  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.550   3.982   0.195
  197    HH   TYR  26           HH       TYR  26  -0.126   6.682   0.102
  198    H    THR  27           H        THR  27   3.220   5.734  -6.795
  199    HA   THR  27           HA       THR  27   2.335   8.163  -5.405
  200    HB   THR  27           HB       THR  27   3.481   8.077  -8.195
  201    HG1  THR  27           HG1      THR  27   4.356   8.924  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.782  -8.528
  203   2HG2  THR  27          2HG2      THR  27   3.188  10.688  -7.508
  204   3HG2  THR  27          3HG2      THR  27   1.738   9.972  -6.805
  205    H    GLY  28           H        GLY  28   0.074   8.085  -5.749
  206   1HA   GLY  28          2HA       GLY  28  -1.089   6.460  -7.920
  207   2HA   GLY  28          1HA       GLY  28  -1.922   6.972  -6.445
  208    H    MET  29           H        MET  29  -2.116   7.366  -9.514
  209    HA   MET  29           HA       MET  29  -2.906  10.189  -9.488
  210   1HB   MET  29          2HB       MET  29  -1.480   8.727 -11.720
  211   2HB   MET  29          1HB       MET  29  -2.184  10.342 -11.857
  212   1HG   MET  29          2HG       MET  29  -0.601  11.287 -10.510
  213   2HG   MET  29          1HG       MET  29  -0.178   9.743  -9.751
  214   1HE   MET  29          1HE       MET  29   0.794   8.009 -10.620
  215   2HE   MET  29          2HE       MET  29   2.360   8.218 -11.403
  216   3HE   MET  29          3HE       MET  29   0.962   7.703 -12.347
  217    H    LEU  30           H        LEU  30  -4.550  10.704 -10.717
  218    HA   LEU  30           HA       LEU  30  -6.563   8.805 -11.485
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.615 -10.972
  220   2HB   LEU  30          1HB       LEU  30  -7.161  11.340 -12.383
  221    HG   LEU  30           HG       LEU  30  -8.958  10.997 -11.160
  222   1HD1  LEU  30          1HD1      LEU  30  -8.539   8.873 -10.285
  223   2HD1  LEU  30          2HD1      LEU  30  -8.874   9.873  -8.871
  224   3HD1  LEU  30          3HD1      LEU  30  -7.212   9.451  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.616  12.083  -8.842
  226   2HD2  LEU  30          2HD2      LEU  30  -8.464  13.011 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.019  12.446  -9.496
  228    H    GLU  31           H        GLU  31  -7.371   8.958 -13.975
  229    HA   GLU  31           HA       GLU  31  -5.215   8.503 -15.715
  230   1HB   GLU  31          2HB       GLU  31  -8.120   9.086 -16.065
  231   2HB   GLU  31          1HB       GLU  31  -7.057   8.986 -17.475
  232   1HG   GLU  31          2HG       GLU  31  -6.309   6.760 -16.613
  233   2HG   GLU  31          1HG       GLU  31  -7.627   6.865 -15.434
  234    H    ASP  32           H        ASP  32  -6.495  11.596 -14.899
  235    HA   ASP  32           HA       ASP  32  -5.307  12.764 -17.294
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.857 -16.413
  237   2HB   ASP  32          1HB       ASP  32  -7.439  13.611 -16.364
  238    H    GLY  33           H        GLY  33  -3.817  11.613 -14.624
  239   1HA   GLY  33          2HA       GLY  33  -1.527  11.886 -14.228
  240   2HA   GLY  33          1HA       GLY  33  -1.619  13.506 -14.936
  241    H    LYS  34           H        LYS  34  -4.145  13.638 -12.942
  242    HA   LYS  34           HA       LYS  34  -2.768  15.197 -11.018
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.190 -11.901
  244   2HB   LYS  34          1HB       LYS  34  -5.505  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.975  16.471  -9.966
  246   2HG   LYS  34          1HG       LYS  34  -5.696  16.691 -10.325
  247   1HD   LYS  34          2HD       LYS  34  -4.721  14.717  -8.287
  248   2HD   LYS  34          1HD       LYS  34  -5.074  16.408  -7.891
  249   1HE   LYS  34          2HE       LYS  34  -7.008  14.532  -9.255
  250   2HE   LYS  34          1HE       LYS  34  -7.005  14.870  -7.517
  251   1HZ   LYS  34          1HZ       LYS  34  -8.074  16.370  -9.644
  252   2HZ   LYS  34          2HZ       LYS  34  -6.990  17.299  -8.737
  253   3HZ   LYS  34          3HZ       LYS  34  -8.312  16.536  -7.978
  254    H    LYS  35           H        LYS  35  -1.722  14.607  -9.323
  255    HA   LYS  35           HA       LYS  35  -1.545  11.907  -8.413
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.565  -8.492
  257   2HB   LYS  35          1HB       LYS  35  -0.487  14.442  -7.183
  258   1HG   LYS  35          2HG       LYS  35  -0.096  12.541  -5.702
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.725  -7.014
  260   1HD   LYS  35          2HD       LYS  35   2.378  12.751  -5.538
  261   2HD   LYS  35          1HD       LYS  35   2.366  13.635  -7.074
  262   1HE   LYS  35          2HE       LYS  35   0.923  15.362  -6.033
  263   2HE   LYS  35          1HE       LYS  35   1.032  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.281  14.954  -4.339
  265   2HZ   LYS  35          2HZ       LYS  35   2.540  16.413  -4.770
  266   3HZ   LYS  35          3HZ       LYS  35   3.381  15.500  -5.938
  267    H    PHE  36           H        PHE  36  -2.816  11.063  -6.760
  268    HA   PHE  36           HA       PHE  36  -4.245  13.051  -5.101
  269   1HB   PHE  36          2HB       PHE  36  -5.735  11.140  -4.494
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.610  -6.201
  271    HD1  PHE  36           HD1      PHE  36  -4.653   8.995  -3.835
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.919
  273    HE1  PHE  36           HE1      PHE  36  -4.541   6.620  -4.510
  274    HE2  PHE  36           HE2      PHE  36  -5.279   7.712  -8.564
  275    HZ   PHE  36           HZ       PHE  36  -4.858   5.985  -6.865
  276    H    ASP  37           H        ASP  37  -1.761  10.658  -4.990
  277    HA   ASP  37           HA       ASP  37  -1.054  11.468  -2.359
  278   1HB   ASP  37          2HB       ASP  37  -2.943   9.814  -1.833
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.555  -2.454
  280    H    SER  38           H        SER  38   0.978  10.468  -1.658
  281    HA   SER  38           HA       SER  38   2.321   8.514  -3.298
  282   1HB   SER  38          2HB       SER  38   2.765  10.582  -4.605
  283   2HB   SER  38          1HB       SER  38   3.450  11.334  -3.158
  284    HG   SER  38           HG       SER  38   5.033  10.353  -4.566
  285    H    SER  39           H        SER  39   3.580   7.306  -1.913
  286    HA   SER  39           HA       SER  39   4.091   8.271   0.752
  287   1HB   SER  39          2HB       SER  39   5.451   6.188   0.991
  288   2HB   SER  39          1HB       SER  39   3.790   5.895   0.457
  289    HG   SER  39           HG       SER  39   4.882   4.730  -0.966
  290    H    ARG  40           H        ARG  40   5.672   8.415  -2.311
  291    HA   ARG  40           HA       ARG  40   8.347   8.698  -1.495
  292   1HB   ARG  40          2HB       ARG  40   6.896   9.775  -3.939
  293   2HB   ARG  40          1HB       ARG  40   8.646   9.874  -3.706
  294   1HG   ARG  40          2HG       ARG  40   8.670   7.372  -3.553
  295   2HG   ARG  40          1HG       ARG  40   6.968   7.398  -4.047
  296   1HD   ARG  40          2HD       ARG  40   7.654   8.458  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.345   8.285  -5.687
  298    HE   ARG  40           HE       ARG  40   9.209   5.986  -6.101
  299   1HH1  ARG  40          1HH1      ARG  40   5.579   6.785  -6.201
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.969  -7.892
  301   1HH2  ARG  40          1HH2      ARG  40   7.873   3.981  -6.856
  302   2HH2  ARG  40          2HH2      ARG  40   6.915   4.487  -8.208
  303    H    ASP  41           H        ASP  41   5.606  11.042  -1.763
  304    HA   ASP  41           HA       ASP  41   7.159  13.334  -1.090
  305   1HB   ASP  41          2HB       ASP  41   4.187  12.794  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.378  -0.523
  307    H    ARG  42           H        ARG  42   5.682  10.787   0.920
  308    HA   ARG  42           HA       ARG  42   6.300  12.310   3.321
  309   1HB   ARG  42          2HB       ARG  42   5.438   9.438   3.145
  310   2HB   ARG  42          1HB       ARG  42   5.372  10.509   4.551
  311   1HG   ARG  42          2HG       ARG  42   3.751  11.916   3.344
  312   2HG   ARG  42          1HG       ARG  42   3.758  10.732   2.026
  313   1HD   ARG  42          2HD       ARG  42   3.173  10.027   4.869
  314   2HD   ARG  42          1HD       ARG  42   1.919  10.548   3.736
  315    HE   ARG  42           HE       ARG  42   3.113   7.958   3.945
  316   1HH1  ARG  42          1HH1      ARG  42   0.346   9.704   2.080
  317   2HH1  ARG  42          2HH1      ARG  42   1.577   9.540   0.875
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.329   2.839
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.787   1.326
  320    H    ASN  43           H        ASN  43   7.997  10.295   1.243
  321    HA   ASN  43           HA       ASN  43   9.990   9.199   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.556  11.533   2.023
  323   2HB   ASN  43          1HB       ASN  43  10.441  10.968   3.695
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.103   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.588   9.742   1.391
  326    H    LYS  44           H        LYS  44   7.798   7.928   2.743
  327    HA   LYS  44           HA       LYS  44   9.468   6.181   4.409
  328   1HB   LYS  44          2HB       LYS  44   8.224   7.816   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.710   7.205   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.126   5.013   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.598   6.829
  332   1HD   LYS  44          2HD       LYS  44   7.582   7.121   8.277
  333   2HD   LYS  44          1HD       LYS  44   6.034   6.934   7.435
  334   1HE   LYS  44          2HE       LYS  44   7.385   4.697   8.961
  335   2HE   LYS  44          1HE       LYS  44   6.179   5.778   9.676
  336   1HZ   LYS  44          1HZ       LYS  44   5.866   3.723   7.644
  337   2HZ   LYS  44          2HZ       LYS  44   4.809   5.045   7.654
  338   3HZ   LYS  44          3HZ       LYS  44   4.934   4.034   9.022
  339    HA   PRO  45           HA       PRO  45   7.452   3.618   1.207
  340   1HB   PRO  45          2HB       PRO  45   8.335   1.316   2.815
  341   2HB   PRO  45          1HB       PRO  45   8.652   1.688   1.129
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.989   2.947
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.161   1.650
  344   1HD   PRO  45          1HD       PRO  45   9.468   3.381   4.525
  345   2HD   PRO  45          2HD       PRO  45  10.321   4.575   3.570
  346    H    PHE  46           H        PHE  46   5.603   2.323   1.036
  347    HA   PHE  46           HA       PHE  46   3.982   2.332   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.006   3.313   1.482
  349   2HB   PHE  46          1HB       PHE  46   3.340   1.838   0.558
  350    HD1  PHE  46           HD1      PHE  46   1.391   3.118   3.441
  351    HD2  PHE  46           HD2      PHE  46   1.765   0.212   0.358
  352    HE1  PHE  46           HE1      PHE  46  -0.840   2.248   3.983
  353    HE2  PHE  46           HE2      PHE  46  -0.462  -0.654   0.916
  354    HZ   PHE  46           HZ       PHE  46  -1.778   0.358   2.732
  355    H    LYS  47           H        LYS  47   3.424   0.256   4.457
  356    HA   LYS  47           HA       LYS  47   4.540  -2.088   3.050
  357   1HB   LYS  47          2HB       LYS  47   3.967  -1.642   5.984
  358   2HB   LYS  47          1HB       LYS  47   4.454  -3.194   5.294
  359   1HG   LYS  47          2HG       LYS  47   6.483  -2.130   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.002  -0.632   5.255
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.683   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.492  -3.261   6.666
  363   1HE   LYS  47          2HE       LYS  47   8.467  -2.422   5.551
  364   2HE   LYS  47          1HE       LYS  47   8.132  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.001   8.400
  366   2HZ   LYS  47          2HZ       LYS  47   9.621  -1.385   7.635
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.046   7.526
  368    H    PHE  48           H        PHE  48   3.032  -3.771   2.431
  369    HA   PHE  48           HA       PHE  48   0.643  -3.988   4.111
  370   1HB   PHE  48          2HB       PHE  48  -0.873  -4.237   2.306
  371   2HB   PHE  48          1HB       PHE  48   0.050  -2.759   1.980
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.773   0.222
  373    HD2  PHE  48           HD2      PHE  48  -0.909  -6.023   0.770
  374    HE1  PHE  48           HE1      PHE  48   2.258  -3.557  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.438  -6.810  -1.534
  376    HZ   PHE  48           HZ       PHE  48   1.147  -5.556  -2.945
  377    H    MET  49           H        MET  49  -0.030  -6.290   4.274
  378    HA   MET  49           HA       MET  49   1.873  -8.239   3.221
  379   1HB   MET  49          2HB       MET  49   1.321  -8.654   5.478
  380   2HB   MET  49          1HB       MET  49  -0.402  -8.376   5.188
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.502   4.182
  382   2HG   MET  49          1HG       MET  49   1.092 -10.765   4.148
  383   1HE   MET  49          1HE       MET  49   1.596 -10.935   8.133
  384   2HE   MET  49          2HE       MET  49   1.276  -9.411   7.305
  385   3HE   MET  49          3HE       MET  49   2.404 -10.573   6.606
  386    H    LEU  50           H        LEU  50   1.555  -9.321   1.509
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.099  -0.213
  388   1HB   LEU  50          2HB       LEU  50   1.837 -10.578  -0.103
  389   2HB   LEU  50          1HB       LEU  50   0.515 -11.618  -0.634
  390    HG   LEU  50           HG       LEU  50   1.997  -9.555  -2.078
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.295  -2.468
  392   2HD1  LEU  50          2HD1      LEU  50   2.461 -11.927  -2.291
  393   3HD1  LEU  50          3HD1      LEU  50   1.597 -11.432  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.265  -9.494  -3.781
  395   2HD2  LEU  50          2HD2      LEU  50  -0.224  -8.667  -2.301
  396   3HD2  LEU  50          3HD2      LEU  50  -0.850 -10.278  -2.661
  397    H    GLY  51           H        GLY  51  -2.500 -10.135  -0.244
  398   1HA   GLY  51          2HA       GLY  51  -3.965 -11.914  -0.222
  399   2HA   GLY  51          1HA       GLY  51  -2.817 -12.828   0.767
  400    H    LYS  52           H        LYS  52  -3.038  -9.957   2.332
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.122   4.259
  402   1HB   LYS  52          2HB       LYS  52  -2.633  -9.864   4.490
  403   2HB   LYS  52          1HB       LYS  52  -3.669  -8.436   4.367
  404   1HG   LYS  52          2HG       LYS  52  -4.948  -9.341   6.364
  405   2HG   LYS  52          1HG       LYS  52  -3.627 -10.505   6.557
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.611   6.084
  407   2HD   LYS  52          1HD       LYS  52  -3.413  -7.509   6.196
  408   1HE   LYS  52          2HE       LYS  52  -3.789  -8.458   8.458
  409   2HE   LYS  52          1HE       LYS  52  -2.179  -9.180   8.302
  410   1HZ   LYS  52          1HZ       LYS  52  -2.522  -6.810   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.381   7.619
  412   3HZ   LYS  52          3HZ       LYS  52  -1.187  -7.186   8.286
  413    H    GLN  53           H        GLN  53  -5.463  -9.221   1.592
  414    HA   GLN  53           HA       GLN  53  -7.282  -8.072   0.877
  415   1HB   GLN  53          2HB       GLN  53  -8.463  -9.203   3.402
  416   2HB   GLN  53          1HB       GLN  53  -9.382  -8.293   2.195
  417   1HG   GLN  53          2HG       GLN  53  -9.298  -9.999   0.667
  418   2HG   GLN  53          1HG       GLN  53  -7.927 -10.783   1.470
  419   1HE2  GLN  53          1HE2      GLN  53  -9.752 -12.936   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.731   3.276
  421    H    GLU  54           H        GLU  54  -5.348  -6.568   2.308
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.585   3.518
  423   1HB   GLU  54          2HB       GLU  54  -5.239  -3.760   4.725
  424   2HB   GLU  54          1HB       GLU  54  -5.554  -5.463   5.077
  425   1HG   GLU  54          2HG       GLU  54  -3.733  -6.108   3.601
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.398   3.248
  427    H    VAL  55           H        VAL  55  -5.457  -5.032   0.730
  428    HA   VAL  55           HA       VAL  55  -5.542  -2.136   0.239
  429    HB   VAL  55           HB       VAL  55  -3.881  -2.656  -1.664
  430   1HG1  VAL  55          1HG1      VAL  55  -3.275  -2.881   1.283
  431   2HG1  VAL  55          2HG1      VAL  55  -3.215  -1.440   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.005  -2.710   0.073
  433   1HG2  VAL  55          1HG2      VAL  55  -3.253  -5.155  -0.162
  434   2HG2  VAL  55          2HG2      VAL  55  -2.604  -4.582  -1.699
  435   3HG2  VAL  55          3HG2      VAL  55  -4.278  -5.125  -1.596
  436    H    ILE  56           H        ILE  56  -5.905  -1.830  -2.310
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.119  -2.876
  438    HB   ILE  56           HB       ILE  56  -8.229  -1.808  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.913  -0.389  -3.802
  440   2HG1  ILE  56          1HG1      ILE  56  -5.703  -1.647  -5.033
  441   1HG2  ILE  56          1HG2      ILE  56  -9.529  -0.598  -3.668
  442   2HG2  ILE  56          2HG2      ILE  56  -8.131   0.476  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.379  -0.755  -2.342
  444   1HD1  ILE  56          1HD1      ILE  56  -6.877  -0.249  -6.672
  445   2HD1  ILE  56          2HD1      ILE  56  -5.492   0.605  -5.993
  446   3HD1  ILE  56          3HD1      ILE  56  -7.123   0.996  -5.448
  447    H    ARG  57           H        ARG  57  -8.930  -4.372  -4.685
  448    HA   ARG  57           HA       ARG  57  -7.302  -6.655  -4.956
  449   1HB   ARG  57          2HB       ARG  57  -9.779  -6.632  -5.312
  450   2HB   ARG  57          1HB       ARG  57  -9.544  -5.687  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.335  -7.515  -7.791
  452   2HG   ARG  57          1HG       ARG  57  -8.505  -8.459  -6.301
  453   1HD   ARG  57          2HD       ARG  57 -10.927  -8.588  -6.657
  454   2HD   ARG  57          1HD       ARG  57 -10.767  -7.626  -8.133
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.770  -8.134
  456   1HH1  ARG  57          1HH1      ARG  57 -12.265  -9.327  -9.730
  457   2HH1  ARG  57          2HH1      ARG  57 -12.631 -10.668  -8.699
  458   1HH2  ARG  57          1HH2      ARG  57  -9.482 -11.967  -9.049
  459   2HH2  ARG  57          2HH2      ARG  57 -10.209 -11.505 -10.551
  460    H    GLY  58           H        GLY  58  -7.318  -3.874  -7.248
  461   1HA   GLY  58          2HA       GLY  58  -5.787  -5.258  -9.175
  462   2HA   GLY  58          1HA       GLY  58  -5.913  -3.500  -9.003
  463    H    TRP  59           H        TRP  59  -4.853  -3.702  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.019  -3.685  -6.666
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.133  -4.344
  466   2HB   TRP  59          1HB       TRP  59  -2.167  -3.716  -3.949
  467    HD1  TRP  59           HD1      TRP  59  -3.605  -1.156  -6.511
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.903  -6.379
  469    HE3  TRP  59           HE3      TRP  59  -0.321  -2.655  -2.814
  470    HZ2  TRP  59           HZ2      TRP  59   0.090   1.800  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.155
  472    HH2  TRP  59           HH2      TRP  59   1.657   1.074  -3.214
  473    H    GLU  60           H        GLU  60  -3.998  -5.884  -4.553
  474    HA   GLU  60           HA       GLU  60  -2.182  -7.807  -3.914
  475   1HB   GLU  60          2HB       GLU  60  -4.936  -8.446  -4.979
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.488  -3.962
  477   1HG   GLU  60          2HG       GLU  60  -4.905  -6.875  -2.951
  478   2HG   GLU  60          1HG       GLU  60  -5.969  -8.292  -2.984
  479    H    GLU  61           H        GLU  61  -3.992  -7.515  -6.943
  480    HA   GLU  61           HA       GLU  61  -2.771  -9.827  -8.164
  481   1HB   GLU  61          2HB       GLU  61  -4.418  -7.607  -9.393
  482   2HB   GLU  61          1HB       GLU  61  -4.042  -9.166 -10.140
  483   1HG   GLU  61          2HG       GLU  61  -5.247  -9.498  -7.529
  484   2HG   GLU  61          1HG       GLU  61  -6.275  -8.537  -8.605
  485    H    GLY  62           H        GLY  62  -2.125  -6.341  -8.334
  486   1HA   GLY  62          2HA       GLY  62  -0.507  -6.786 -10.674
  487   2HA   GLY  62          1HA       GLY  62  -0.757  -5.248  -9.834
  488    H    VAL  63           H        VAL  63   0.135  -5.860  -7.305
  489    HA   VAL  63           HA       VAL  63   2.942  -5.684  -7.765
  490    HB   VAL  63           HB       VAL  63   1.301  -5.995  -5.199
  491   1HG1  VAL  63          1HG1      VAL  63   3.647  -6.696  -4.933
  492   2HG1  VAL  63          2HG1      VAL  63   3.349  -5.181  -4.083
  493   3HG1  VAL  63          3HG1      VAL  63   4.186  -5.170  -5.634
  494   1HG2  VAL  63          1HG2      VAL  63   0.933  -3.780  -6.427
  495   2HG2  VAL  63          2HG2      VAL  63   2.678  -3.534  -6.448
  496   3HG2  VAL  63          3HG2      VAL  63   1.807  -3.530  -4.916
  497    H    ALA  64           H        ALA  64   0.822  -8.472  -7.069
  498    HA   ALA  64           HA       ALA  64   2.870 -10.243  -6.295
  499   1HB   ALA  64          1HB       ALA  64   0.456 -10.983  -7.915
  500   2HB   ALA  64          2HB       ALA  64   0.405 -10.690  -6.178
  501   3HB   ALA  64          3HB       ALA  64   1.385 -12.007  -6.821
  502    H    GLN  65           H        GLN  65   2.108  -8.870  -9.375
  503    HA   GLN  65           HA       GLN  65   3.584 -10.843 -10.889
  504   1HB   GLN  65          2HB       GLN  65   2.247  -8.222 -11.563
  505   2HB   GLN  65          1HB       GLN  65   3.243  -9.099 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.821 -11.070 -12.541
  507   2HG   GLN  65          1HG       GLN  65   0.885 -10.309 -11.244
  508   1HE2  GLN  65          1HE2      GLN  65  -1.179  -9.486 -12.158
  509   2HE2  GLN  65          2HE2      GLN  65  -0.903  -8.129 -13.191
  510    H    MET  66           H        MET  66   4.751  -8.572  -8.817
  511    HA   MET  66           HA       MET  66   6.777  -7.620 -10.720
  512   1HB   MET  66          2HB       MET  66   5.986  -6.535  -8.024
  513   2HB   MET  66          1HB       MET  66   7.237  -5.864  -9.079
  514   1HG   MET  66          2HG       MET  66   5.598  -5.381 -10.782
  515   2HG   MET  66          1HG       MET  66   4.328  -6.152  -9.815
  516   1HE   MET  66          1HE       MET  66   7.230  -3.851  -8.685
  517   2HE   MET  66          2HE       MET  66   6.481  -2.254  -8.657
  518   3HE   MET  66          3HE       MET  66   6.731  -3.084 -10.192
  519    H    SER  67           H        SER  67   8.935  -7.976 -10.279
  520    HA   SER  67           HA       SER  67   9.649  -9.756  -8.078
  521   1HB   SER  67          2HB       SER  67  11.857  -9.703  -9.291
  522   2HB   SER  67          1HB       SER  67  10.496 -10.435 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.798 -11.554
  524    H    VAL  68           H        VAL  68  11.481  -9.147  -6.638
  525    HA   VAL  68           HA       VAL  68  11.309  -6.545  -5.628
  526    HB   VAL  68           HB       VAL  68  13.513  -8.620  -5.346
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.416  -3.307
  528   2HG1  VAL  68          2HG1      VAL  68  12.989  -6.166  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.360  -6.391  -4.731
  530   1HG2  VAL  68          1HG2      VAL  68  11.724  -9.652  -4.480
  531   2HG2  VAL  68          2HG2      VAL  68  10.883  -8.142  -4.130
  532   3HG2  VAL  68          3HG2      VAL  68  12.174  -8.700  -3.065
  533    H    GLY  69           H        GLY  69  12.138  -4.763  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.884  -3.301  -6.745
  535   2HA   GLY  69          1HA       GLY  69  14.458  -4.530  -7.883
  536    H    GLN  70           H        GLN  70  11.269  -4.686  -8.435
  537    HA   GLN  70           HA       GLN  70  11.691  -3.130 -10.841
  538   1HB   GLN  70          2HB       GLN  70  10.814  -5.487 -10.676
  539   2HB   GLN  70          1HB       GLN  70   9.326  -4.776 -10.036
  540   1HG   GLN  70          2HG       GLN  70   9.150  -3.445 -12.106
  541   2HG   GLN  70          1HG       GLN  70  10.537  -4.344 -12.742
  542   1HE2  GLN  70          2HE2      GLN  70   9.494  -7.238 -12.036
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.874 -11.427
  544    H    ARG  71           H        ARG  71  10.582  -1.587 -11.625
  545    HA   ARG  71           HA       ARG  71   8.697  -0.178  -9.844
  546   1HB   ARG  71          2HB       ARG  71  10.803   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.687   1.054 -11.764
  548   1HG   ARG  71          2HG       ARG  71   8.898   2.569 -11.793
  549   2HG   ARG  71          1HG       ARG  71   8.396   2.159 -10.146
  550   1HD   ARG  71          2HD       ARG  71  10.284   3.311  -9.215
  551   2HD   ARG  71          1HD       ARG  71  10.989   3.554 -10.820
  552    HE   ARG  71           HE       ARG  71   8.425   4.695 -10.780
  553   1HH1  ARG  71          2HH1      ARG  71  11.613   5.178  -9.289
  554   2HH1  ARG  71          1HH1      ARG  71  11.463   6.904  -9.285
  555   1HH2  ARG  71          1HH2      ARG  71   8.121   6.875 -10.465
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.986
  557    H    ALA  72           H        ALA  72   6.801  -0.068 -10.813
  558    HA   ALA  72           HA       ALA  72   6.470  -0.150 -13.715
  559   1HB   ALA  72          1HB       ALA  72   5.012  -2.005 -13.696
  560   2HB   ALA  72          2HB       ALA  72   4.895  -1.997 -11.936
  561   3HB   ALA  72          3HB       ALA  72   6.393  -2.503 -12.717
  562    H    LYS  73           H        LYS  73   4.461   0.425 -14.508
  563    HA   LYS  73           HA       LYS  73   2.807   2.084 -12.735
  564   1HB   LYS  73          2HB       LYS  73   3.831   3.035 -14.744
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.820 -15.722
  566   1HG   LYS  73          2HG       LYS  73   0.827   2.875 -14.911
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.217 -14.335
  568   1HD   LYS  73          2HD       LYS  73   2.965   4.302 -16.496
  569   2HD   LYS  73          1HD       LYS  73   1.971   2.953 -17.074
  570   1HE   LYS  73          2HE       LYS  73  -0.017   4.447 -16.678
  571   2HE   LYS  73          1HE       LYS  73   1.147   5.769 -16.498
  572   1HZ   LYS  73          1HZ       LYS  73   0.807   4.007 -18.847
  573   2HZ   LYS  73          2HZ       LYS  73   2.039   5.156 -18.682
  574   3HZ   LYS  73          3HZ       LYS  73   0.409   5.647 -18.751
  575    H    LEU  74           H        LEU  74   0.909   1.251 -12.075
  576    HA   LEU  74           HA       LEU  74  -0.135  -1.172 -13.368
  577   1HB   LEU  74          2HB       LEU  74   0.214  -0.094 -10.656
  578   2HB   LEU  74          1HB       LEU  74  -1.340  -0.882 -10.938
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.000 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.990  -3.482 -11.265
  581   2HD1  LEU  74          2HD1      LEU  74   2.322  -1.758 -11.424
  582   3HD1  LEU  74          3HD1      LEU  74   1.365  -2.587 -12.649
  583   1HD2  LEU  74          1HD2      LEU  74  -0.468  -1.889  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.231  -1.449  -9.036
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.146  -8.938
  586    H    THR  75           H        THR  75  -1.869  -0.573 -14.790
  587    HA   THR  75           HA       THR  75  -3.497   1.773 -14.022
  588    HB   THR  75           HB       THR  75  -3.435   0.122 -16.596
  589    HG1  THR  75           HG1      THR  75  -1.654   1.266 -16.760
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.967 -17.628
  591   2HG2  THR  75          2HG2      THR  75  -4.845   2.695 -16.037
  592   3HG2  THR  75          3HG2      THR  75  -5.575   1.134 -16.412
  593    H    ILE  76           H        ILE  76  -5.454   1.333 -12.988
  594    HA   ILE  76           HA       ILE  76  -6.291  -1.483 -12.782
  595    HB   ILE  76           HB       ILE  76  -6.388   0.673 -10.635
  596   1HG1  ILE  76          2HG1      ILE  76  -4.507  -1.673 -10.946
  597   2HG1  ILE  76          1HG1      ILE  76  -4.084   0.026 -11.222
  598   1HG2  ILE  76          1HG2      ILE  76  -7.209  -2.171 -10.634
  599   2HG2  ILE  76          2HG2      ILE  76  -8.130  -0.725 -10.213
  600   3HG2  ILE  76          3HG2      ILE  76  -6.833  -1.283  -9.156
  601   1HD1  ILE  76          1HD1      ILE  76  -4.413  -1.467  -8.692
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.219  -8.707
  603   3HD1  ILE  76          3HD1      ILE  76  -3.266  -0.200  -9.127
  604    H    SER  77           H        SER  77  -8.341  -1.762 -13.534
  605    HA   SER  77           HA       SER  77 -10.074   0.347 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.733  -1.397 -14.643
  607   2HB   SER  77          1HB       SER  77 -10.163  -1.886 -15.294
  608    HG   SER  77           HG       SER  77 -11.683  -3.015 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.060   1.321 -10.424
  610   1HB   PRO  78          2HB       PRO  78 -14.776   1.357 -11.227
  611   2HB   PRO  78          1HB       PRO  78 -13.688   2.734 -11.185
  612   1HG   PRO  78          2HG       PRO  78 -14.506   1.056 -13.514
  613   2HG   PRO  78          1HG       PRO  78 -14.012   2.740 -13.488
  614   1HD   PRO  78          1HD       PRO  78 -12.360   0.789 -14.398
  615   2HD   PRO  78          2HD       PRO  78 -11.741   2.211 -13.585
  616    H    ASP  79           H        ASP  79 -13.479  -1.462 -12.055
  617    HA   ASP  79           HA       ASP  79 -14.744  -2.335  -9.644
  618   1HB   ASP  79          2HB       ASP  79 -15.147  -4.410 -10.854
  619   2HB   ASP  79          1HB       ASP  79 -15.489  -3.031 -11.909
  620    H    TYR  80           H        TYR  80 -11.546  -2.401 -10.613
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.456  -8.686
  622   1HB   TYR  80          2HB       TYR  80  -9.560  -3.182 -11.069
  623   2HB   TYR  80          1HB       TYR  80  -8.480  -3.757  -9.788
  624    HD1  TYR  80           HD1      TYR  80 -11.503  -4.892 -11.641
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.877
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.200 -12.483
  627    HE2  TYR  80           HE2      TYR  80  -7.918  -8.145 -10.692
  628    HH   TYR  80           HH       TYR  80  -8.975  -9.435 -12.229
  629    H    ALA  81           H        ALA  81 -11.563  -1.443  -8.397
  630    HA   ALA  81           HA       ALA  81  -9.391  -0.749  -6.538
  631   1HB   ALA  81          1HB       ALA  81  -9.044   0.364  -8.763
  632   2HB   ALA  81          2HB       ALA  81  -9.310   1.510  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.615   1.140  -8.574
  634    H    TYR  82           H        TYR  82 -11.705   1.777  -7.022
  635    HA   TYR  82           HA       TYR  82 -13.144   0.958  -4.577
  636   1HB   TYR  82          2HB       TYR  82 -12.503   3.642  -5.851
  637   2HB   TYR  82          1HB       TYR  82 -13.464   3.449  -4.377
  638    HD1  TYR  82           HD1      TYR  82 -12.314   2.135  -2.428
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.941  -5.711
  640    HE1  TYR  82           HE1      TYR  82 -10.206   2.036  -1.125
  641    HE2  TYR  82           HE2      TYR  82  -8.141   3.837  -4.423
  642    HH   TYR  82           HH       TYR  82  -7.556   3.778  -1.856
  643    H    GLY  83           H        GLY  83 -13.806   0.861  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.708   0.433  -8.896
  645   2HA   GLY  83          1HA       GLY  83 -16.440   0.098  -7.319
  646    H    ALA  84           H        ALA  84 -18.269   0.983  -7.433
  647    HA   ALA  84           HA       ALA  84 -18.706   3.583  -8.634
  648   1HB   ALA  84          1HB       ALA  84 -20.323   1.691  -8.791
  649   2HB   ALA  84          2HB       ALA  84 -21.023   3.180  -8.157
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.862  -7.058
  651    H    THR  85           H        THR  85 -18.019   2.428  -5.346
  652    HA   THR  85           HA       THR  85 -19.182   4.738  -4.102
  653    HB   THR  85           HB       THR  85 -16.855   3.115  -3.033
  654    HG1  THR  85           HG1      THR  85 -19.571   2.454  -2.689
  655   1HG2  THR  85          1HG2      THR  85 -19.157   4.617  -1.812
  656   2HG2  THR  85          2HG2      THR  85 -17.432   4.850  -1.534
  657   3HG2  THR  85          3HG2      THR  85 -18.237   3.408  -0.916
  658    H    GLY  86           H        GLY  86 -15.913   4.002  -5.320
  659   1HA   GLY  86          2HA       GLY  86 -14.098   5.462  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.215   6.806  -5.306
  661    H    HIS  87           H        HIS  87 -13.164   7.511  -3.886
  662    HA   HIS  87           HA       HIS  87 -13.463   6.202  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.189   6.024  -2.259
  664   2HB   HIS  87          1HB       HIS  87 -11.086   7.793  -2.210
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.797   0.416
  666    HD2  HIS  87           HD2      HIS  87 -10.711   4.670  -0.091
  667    HE1  HIS  87           HE1      HIS  87 -10.104   7.851   2.598
  668    HE2  HIS  87           HE2      HIS  87 -10.002   5.372   2.224
  669    HA   PRO  88           HA       PRO  88 -15.771  10.118  -0.978
  670   1HB   PRO  88          2HB       PRO  88 -15.861  10.506   1.732
  671   2HB   PRO  88          1HB       PRO  88 -16.875   9.331   0.911
  672   1HG   PRO  88          2HG       PRO  88 -14.226   8.864   2.307
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.495
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.987   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.540   6.973   0.309
  676    H    GLY  89           H        GLY  89 -15.167  11.873  -1.572
  677   1HA   GLY  89          2HA       GLY  89 -14.150  13.914  -1.651
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.214
  679    H    ILE  90           H        ILE  90 -12.041  11.021  -1.770
  680    HA   ILE  90           HA       ILE  90  -9.979  12.656  -3.118
  681    HB   ILE  90           HB       ILE  90  -9.843   9.885  -1.827
  682   1HG1  ILE  90          2HG1      ILE  90  -8.445  12.389  -0.968
  683   2HG1  ILE  90          1HG1      ILE  90 -10.098  12.030  -0.442
  684   1HG2  ILE  90          1HG2      ILE  90  -7.308  10.385  -1.931
  685   2HG2  ILE  90          2HG2      ILE  90  -7.713  11.629  -3.116
  686   3HG2  ILE  90          3HG2      ILE  90  -8.066   9.933  -3.460
  687   1HD1  ILE  90          1HD1      ILE  90  -9.336  10.708   1.163
  688   2HD1  ILE  90          2HD1      ILE  90  -7.694  11.180   0.726
  689   3HD1  ILE  90          3HD1      ILE  90  -8.424   9.750  -0.002
  690    H    ILE  91           H        ILE  91 -11.665   9.562  -3.637
  691    HA   ILE  91           HA       ILE  91 -10.634   9.708  -6.402
  692    HB   ILE  91           HB       ILE  91 -11.716   7.253  -4.978
  693   1HG1  ILE  91          2HG1      ILE  91  -9.603   7.975  -3.973
  694   2HG1  ILE  91          1HG1      ILE  91  -9.414   6.461  -4.873
  695   1HG2  ILE  91          1HG2      ILE  91 -10.552   6.111  -6.910
  696   2HG2  ILE  91          2HG2      ILE  91 -10.440   7.708  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.020   7.012  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.509   7.969  -5.199
  699   2HD1  ILE  91          2HD1      ILE  91  -8.593   9.197  -5.853
  700   3HD1  ILE  91          3HD1      ILE  91  -8.369   7.672  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.250  10.298  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.682   9.827  -9.876
  703   2HB   PRO  92          1HB       PRO  92 -15.345  11.254  -9.101
  704   1HG   PRO  92          2HG       PRO  92 -12.861  11.317 -10.114
  705   2HG   PRO  92          1HG       PRO  92 -13.211  12.132  -8.601
  706   1HD   PRO  92          1HD       PRO  92 -12.059   9.357  -8.999
  707   2HD   PRO  92          2HD       PRO  92 -11.419  10.652  -8.012
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.868
  709   1HB   PRO  93          2HB       PRO  93 -18.921   7.282  -9.559
  710   2HB   PRO  93          1HB       PRO  93 -19.088   6.343  -8.086
  711   1HG   PRO  93          2HG       PRO  93 -19.618   9.036  -8.232
  712   2HG   PRO  93          1HG       PRO  93 -19.151   8.221  -6.750
  713   1HD   PRO  93          1HD       PRO  93 -17.516   9.977  -8.524
  714   2HD   PRO  93          2HD       PRO  93 -17.369   9.713  -6.799
  715    H    HIS  94           H        HIS  94 -16.500   4.744  -9.377
  716    HA   HIS  94           HA       HIS  94 -15.945   3.694 -11.309
  717   1HB   HIS  94          2HB       HIS  94 -17.264   6.169 -12.563
  718   2HB   HIS  94          1HB       HIS  94 -16.932   4.652 -13.415
  719    HD1  HIS  94           HD1      HIS  94 -18.294   2.487 -12.154
  720    HD2  HIS  94           HD2      HIS  94 -19.608   6.359 -11.437
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.310 -11.165
  722    HE2  HIS  94           HE2      HIS  94 -21.352   4.657 -10.759
  723    H    ALA  95           H        ALA  95 -13.895   5.537 -10.143
  724    HA   ALA  95           HA       ALA  95 -12.524   6.635 -12.450
  725   1HB   ALA  95          1HB       ALA  95 -12.630   7.329  -9.872
  726   2HB   ALA  95          2HB       ALA  95 -11.237   7.693 -10.892
  727   3HB   ALA  95          3HB       ALA  95 -11.202   6.293  -9.819
  728    H    THR  96           H        THR  96 -10.925   5.698 -13.745
  729    HA   THR  96           HA       THR  96  -9.714   3.198 -13.010
  730    HB   THR  96           HB       THR  96  -9.160   5.171 -15.275
  731    HG1  THR  96           HG1      THR  96 -10.420   3.811 -16.393
  732   1HG2  THR  96          1HG2      THR  96  -7.731   2.635 -14.647
  733   2HG2  THR  96          2HG2      THR  96  -7.064   4.253 -14.874
  734   3HG2  THR  96          3HG2      THR  96  -7.754   3.382 -16.244
  735    H    LEU  97           H        LEU  97  -7.696   3.076 -11.871
  736    HA   LEU  97           HA       LEU  97  -6.463   5.644 -11.105
  737   1HB   LEU  97          2HB       LEU  97  -6.522   2.946  -9.733
  738   2HB   LEU  97          1HB       LEU  97  -5.731   4.392  -9.102
  739    HG   LEU  97           HG       LEU  97  -8.696   3.976  -9.442
  740   1HD1  LEU  97          1HD1      LEU  97  -8.707   3.954  -7.052
  741   2HD1  LEU  97          2HD1      LEU  97  -6.989   4.350  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.510   2.781  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.505   6.246  -9.827
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.406  -8.821
  745   3HD2  LEU  97          3HD2      LEU  97  -8.645   6.198  -8.069
  746    H    VAL  98           H        VAL  98  -4.207   5.848 -11.143
  747    HA   VAL  98           HA       VAL  98  -2.848   3.761 -12.691
  748    HB   VAL  98           HB       VAL  98  -2.520   6.781 -12.882
  749   1HG1  VAL  98          1HG1      VAL  98  -1.026   4.461 -14.106
  750   2HG1  VAL  98          2HG1      VAL  98  -0.379   5.704 -13.035
  751   3HG1  VAL  98          3HG1      VAL  98  -0.881   6.124 -14.674
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.909 -15.158
  753   2HG2  VAL  98          2HG2      VAL  98  -3.415   6.654 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.468   5.572 -14.149
  755    H    PHE  99           H        PHE  99  -1.239   2.912 -11.259
  756    HA   PHE  99           HA       PHE  99  -0.234   4.767  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.719   1.815  -9.169
  758   2HB   PHE  99          1HB       PHE  99   0.436   2.563  -8.052
  759    HD1  PHE  99           HD1      PHE  99  -3.100   2.160  -8.946
  760    HD2  PHE  99           HD2      PHE  99  -0.266   3.912  -6.250
  761    HE1  PHE  99           HE1      PHE  99  -4.903   2.660  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.089   4.402  -4.662
  763    HZ   PHE  99           HZ       PHE  99  -4.396   3.779  -5.220
  764    H    ASP 100           H        ASP 100   1.949   5.077  -9.151
  765    HA   ASP 100           HA       ASP 100   3.709   3.599 -10.963
  766   1HB   ASP 100          2HB       ASP 100   3.847   5.986 -11.157
  767   2HB   ASP 100          1HB       ASP 100   4.086   6.148  -9.411
  768    H    VAL 101           H        VAL 101   4.562   1.927  -9.766
  769    HA   VAL 101           HA       VAL 101   4.827   2.053  -6.828
  770    HB   VAL 101           HB       VAL 101   3.653  -0.202  -8.532
  771   1HG1  VAL 101          1HG1      VAL 101   3.150  -1.244  -6.291
  772   2HG1  VAL 101          2HG1      VAL 101   4.248  -0.059  -5.581
  773   3HG1  VAL 101          3HG1      VAL 101   4.852  -1.234  -6.752
  774   1HG2  VAL 101          1HG2      VAL 101   1.644   0.199  -7.113
  775   2HG2  VAL 101          2HG2      VAL 101   2.123   1.752  -7.796
  776   3HG2  VAL 101          3HG2      VAL 101   2.550   1.352  -6.133
  777    H    GLU 102           H        GLU 102   6.715   1.361  -6.030
  778    HA   GLU 102           HA       GLU 102   8.510  -0.105  -7.837
  779   1HB   GLU 102          2HB       GLU 102   9.366   2.100  -7.493
  780   2HB   GLU 102          1HB       GLU 102   9.086   1.987  -5.748
  781   1HG   GLU 102          2HG       GLU 102  10.833   0.480  -5.435
  782   2HG   GLU 102          1HG       GLU 102  10.875   0.034  -7.150
  783    H    LEU 103           H        LEU 103   8.833  -2.173  -7.007
  784    HA   LEU 103           HA       LEU 103   8.028  -2.669  -4.240
  785   1HB   LEU 103          2HB       LEU 103   7.227  -4.249  -5.862
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.466  -6.530
  787    HG   LEU 103           HG       LEU 103   9.547  -5.665  -4.532
  788   1HD1  LEU 103          1HD1      LEU 103   6.782  -4.963  -3.524
  789   2HD1  LEU 103          2HD1      LEU 103   8.335  -4.625  -2.761
  790   3HD1  LEU 103          3HD1      LEU 103   7.733  -6.279  -2.836
  791   1HD2  LEU 103          1HD2      LEU 103   7.982  -7.615  -4.730
  792   2HD2  LEU 103          2HD2      LEU 103   8.589  -7.006  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.950  -6.610  -5.747
  794    H    LEU 104           H        LEU 104   9.457  -2.279  -2.765
  795    HA   LEU 104           HA       LEU 104  12.289  -2.024  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.807  -1.447  -0.821
  797   2HB   LEU 104          1HB       LEU 104  12.476  -0.998  -1.180
  798    HG   LEU 104           HG       LEU 104  10.041   0.190  -2.507
  799   1HD1  LEU 104          1HD1      LEU 104  10.369   0.799  -0.055
  800   2HD1  LEU 104          2HD1      LEU 104  10.326   2.141  -1.199
  801   3HD1  LEU 104          3HD1      LEU 104  11.870   1.579  -0.556
  802   1HD2  LEU 104          1HD2      LEU 104  12.275   0.034  -3.735
  803   2HD2  LEU 104          2HD2      LEU 104  12.922   1.104  -2.493
  804   3HD2  LEU 104          3HD2      LEU 104  11.621   1.661  -3.544
  805    H    LYS 105           H        LYS 105  10.327  -4.008  -1.313
  806    HA   LYS 105           HA       LYS 105  12.566  -5.750  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.826  -3.635   0.612
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.082   1.446
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.016   2.349
  810   2HG   LYS 105          1HG       LYS 105  13.833  -5.708   1.416
  811   1HD   LYS 105          2HD       LYS 105  14.217  -3.641   2.557
  812   2HD   LYS 105          1HD       LYS 105  12.614  -3.694   3.309
  813   1HE   LYS 105          2HE       LYS 105  13.277  -5.922   4.300
  814   2HE   LYS 105          1HE       LYS 105  14.922  -5.602   3.734
  815   1HZ   LYS 105          1HZ       LYS 105  13.453  -4.431   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.254  -3.309   4.908
  817   3HZ   LYS 105          3HZ       LYS 105  15.124  -4.567   5.660
  818    H    LEU 106           H        LEU 106  11.794  -7.704   0.372
  819    HA   LEU 106           HA       LEU 106   8.922  -7.755   1.009
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.085   0.182
  821   2HB   LEU 106          1HB       LEU 106   8.990 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.870  -8.834  -1.808
  823   1HD1  LEU 106          1HD1      LEU 106   8.414 -11.424  -1.350
  824   2HD1  LEU 106          2HD1      LEU 106  10.120 -11.285  -1.776
  825   3HD1  LEU 106          3HD1      LEU 106   8.882 -10.734  -2.904
  826   1HD2  LEU 106          1HD2      LEU 106   7.566  -8.573  -2.323
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.674
  828   3HD2  LEU 106          3HD2      LEU 106   7.073  -9.578  -0.959
  829    H    GLU 107           HN       GLU 107   8.525  -8.269   3.051
  830    HA   GLU 107           HA       GLU 107  10.716  -9.187   4.801
  831   1HB   GLU 107          2HB       GLU 107   8.510  -7.227   5.415
  832   2HB   GLU 107          1HB       GLU 107   9.696  -7.831   6.579
  833   1HG   GLU 107          2HG       GLU 107  11.468  -6.821   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.234  -6.152   4.164
  835    H2   GPI 108           H2       GPI 108  -4.158   1.881  -1.691
  836   1H5   GPI 108          1H5       GPI 108  -2.193   4.714  -0.910
  837   2H5   GPI 108          2H5       GPI 108  -2.190   4.228   0.794
  838   1H3   GPI 108          1H3       GPI 108  -2.195   0.613  -1.003
  839   2H3   GPI 108          2H3       GPI 108  -2.412   1.044   0.702
  840   1H4   GPI 108          1H4       GPI 108  -1.281   2.670  -1.625
  841   2H4   GPI 108          2H4       GPI 108  -0.646   2.597   0.050
  842   1H14  GPI 108          1H14      GPI 108  -7.103   0.502   1.076
  843   2H14  GPI 108          2H14      GPI 108  -7.360   2.020   0.183
  844   1H15  GPI 108          1H15      GPI 108  -8.463   2.888   1.963
  845   2H15  GPI 108          2H15      GPI 108  -7.018   2.663   2.977
  846   1H16  GPI 108          1H16      GPI 108  -7.693   0.310   3.419
  847   2H16  GPI 108          2H16      GPI 108  -8.968   1.446   3.924
  848    H20  GPI 108           H20      GPI 108 -11.952  -1.456  -0.260
  849    H21  GPI 108           H21      GPI 108  -9.829  -2.593   0.382
  850    H22  GPI 108           H22      GPI 108  -8.225  -1.452   1.908
  851    H18  GPI 108           H18      GPI 108 -10.853   1.958   2.149
  852   1H12  GPI 108          1H12      GPI 108  -5.368   8.258   2.308
  853   2H12  GPI 108          2H12      GPI 108  -3.968   7.252   2.549
  854   3H12  GPI 108          3H12      GPI 108  -4.221   8.042   1.004
  855   1H13  GPI 108          1H13      GPI 108  -5.773   5.829   3.433
  856   2H13  GPI 108          2H13      GPI 108  -6.441   4.647   2.290
  857   3H13  GPI 108          3H13      GPI 108  -4.676   4.733   2.553
  858   1H10  GPI 108          1H10      GPI 108  -7.456   5.905   0.562
  859   2H10  GPI 108          2H10      GPI 108  -7.425   7.211   1.770
  860   1H11  GPI 108          1H11      GPI 108  -7.747   7.926  -0.683
  861   2H11  GPI 108          2H11      GPI 108  -6.506   8.758   0.214
  862   3H11  GPI 108          3H11      GPI 108  -6.069   7.500  -0.926
  Start of MODEL    9
    1   1H    GLY   1          1H        GLY   1 -10.185  -5.720 -15.429
    2   2H    GLY   1          2H        GLY   1  -9.174  -4.435 -15.868
    3   3H    GLY   1          3H        GLY   1  -9.874  -4.486 -14.314
    4   1HA   GLY   1          1HA       GLY   1  -8.596  -6.397 -13.736
    5   2HA   GLY   1          2HA       GLY   1  -7.914  -6.427 -15.370
    6    H    VAL   2           H        VAL   2  -5.835  -6.109 -14.258
    7    HA   VAL   2           HA       VAL   2  -5.182  -3.271 -13.801
    8    HB   VAL   2           HB       VAL   2  -5.014  -4.370 -11.645
    9   1HG1  VAL   2          1HG1      VAL   2  -5.039  -6.651 -11.975
   10   2HG1  VAL   2          2HG1      VAL   2  -3.355  -6.388 -11.518
   11   3HG1  VAL   2          3HG1      VAL   2  -3.786  -6.591 -13.216
   12   1HG2  VAL   2          1HG2      VAL   2  -2.739  -3.984 -11.113
   13   2HG2  VAL   2          2HG2      VAL   2  -2.994  -2.998 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.185  -4.560 -12.686
   15    H    GLN   3           H        GLN   3  -3.402  -2.741 -15.042
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.697 -16.956
   17   1HB   GLN   3          2HB       GLN   3  -3.650  -3.062 -17.956
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.783 -16.985
   19   1HG   GLN   3          2HG       GLN   3  -0.839  -2.076 -18.216
   20   2HG   GLN   3          1HG       GLN   3  -1.636  -3.298 -19.223
   21   1HE2  GLN   3          1HE2      GLN   3  -0.895  -0.070 -19.216
   22   2HE2  GLN   3          2HE2      GLN   3  -2.174   0.476 -20.243
   23    H    VAL   4           H        VAL   4   0.028  -4.829 -16.595
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.552
   25    HB   VAL   4           HB       VAL   4   1.946  -5.945 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.454  -5.606 -13.275
   27   2HG1  VAL   4          2HG1      VAL   4   3.338  -3.909 -13.739
   28   3HG1  VAL   4          3HG1      VAL   4   4.019  -5.085 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.752 -13.785
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.128 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.451  -5.692 -12.607
   32    H    GLU   5           H        GLU   5   2.589  -1.532 -15.721
   33    HA   GLU   5           HA       GLU   5   3.858  -2.504 -18.203
   34   1HB   GLU   5          2HB       GLU   5   3.406   0.408 -17.570
   35   2HB   GLU   5          1HB       GLU   5   3.766  -0.337 -19.133
   36   1HG   GLU   5          2HG       GLU   5   1.576  -0.579 -19.582
   37   2HG   GLU   5          1HG       GLU   5   1.315  -1.438 -18.055
   38    H    THR   6           H        THR   6   6.172  -2.560 -17.862
   39    HA   THR   6           HA       THR   6   7.248  -1.667 -15.326
   40    HB   THR   6           HB       THR   6   8.547  -2.886 -17.813
   41    HG1  THR   6           HG1      THR   6   7.714  -4.259 -15.467
   42   1HG2  THR   6          1HG2      THR   6  10.110  -3.769 -15.963
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.270 -15.171
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.222 -16.773
   45    H    ILE   7           H        ILE   7   8.485  -0.099 -14.755
   46    HA   ILE   7           HA       ILE   7   9.325   1.984 -16.649
   47    HB   ILE   7           HB       ILE   7   9.174   1.956 -13.592
   48   1HG1  ILE   7          2HG1      ILE   7   7.572   3.424 -15.705
   49   2HG1  ILE   7          1HG1      ILE   7   7.036   1.949 -14.884
   50   1HG2  ILE   7          1HG2      ILE   7  10.902   3.493 -13.979
   51   2HG2  ILE   7          2HG2      ILE   7   9.451   4.491 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.148   4.115 -15.447
   53   1HD1  ILE   7          1HD1      ILE   7   6.104   4.220 -14.095
   54   2HD1  ILE   7          2HD1      ILE   7   7.674   4.426 -13.318
   55   3HD1  ILE   7          3HD1      ILE   7   6.645   3.063 -12.878
   56    H    SER   8           H        SER   8  10.603  -0.023 -13.869
   57    HA   SER   8           HA       SER   8  13.149  -0.214 -15.311
   58   1HB   SER   8          2HB       SER   8  12.963   0.238 -12.319
   59   2HB   SER   8          1HB       SER   8  14.444   0.042 -13.266
   60    HG   SER   8           HG       SER   8  13.494   1.892 -14.558
   61    HA   PRO   9           HA       PRO   9  12.196  -4.488 -14.336
   62   1HB   PRO   9          2HB       PRO   9  15.067  -4.994 -14.686
   63   2HB   PRO   9          1HB       PRO   9  13.701  -5.632 -15.585
   64   1HG   PRO   9          2HG       PRO   9  15.267  -3.813 -16.724
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.706 -16.935
   66   1HD   PRO   9          1HD       PRO   9  15.270  -2.167 -14.990
   67   2HD   PRO   9          2HD       PRO   9  14.047  -1.540 -16.074
   68    H    GLY  10           H        GLY  10  12.403  -6.055 -12.856
   69   1HA   GLY  10          2HA       GLY  10  13.703  -5.350 -10.325
   70   2HA   GLY  10          1HA       GLY  10  12.398  -6.526 -10.542
   71    H    ASP  11           H        ASP  11  13.970  -8.174  -9.355
   72    HA   ASP  11           HA       ASP  11  16.402  -8.727 -10.873
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.364  -9.171
   74   2HB   ASP  11          1HB       ASP  11  16.352  -8.884  -8.381
   75    H    GLY  12           H        GLY  12  13.237  -9.675 -11.217
   76   1HA   GLY  12          2HA       GLY  12  12.273 -11.204 -12.649
   77   2HA   GLY  12          1HA       GLY  12  13.900 -11.646 -13.186
   78    H    ARG  13           H        ARG  13  13.568 -12.073  -9.752
   79    HA   ARG  13           HA       ARG  13  12.730 -14.857 -10.203
   80   1HB   ARG  13          2HB       ARG  13  15.050 -14.302  -8.384
   81   2HB   ARG  13          1HB       ARG  13  14.616 -15.800  -9.217
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.963 -11.270
   83   2HG   ARG  13          1HG       ARG  13  15.850 -13.397 -10.514
   84   1HD   ARG  13          2HD       ARG  13  17.938 -14.356 -10.543
   85   2HD   ARG  13          1HD       ARG  13  17.368 -14.839  -8.938
   86    HE   ARG  13           HE       ARG  13  16.907 -17.033  -9.825
   87   1HH1  ARG  13          1HH1      ARG  13  18.198 -15.233 -12.843
   88   2HH1  ARG  13          2HH1      ARG  13  19.703 -15.785 -12.189
   89   1HH2  ARG  13          1HH2      ARG  13  17.672 -18.713 -11.202
   90   2HH2  ARG  13          2HH2      ARG  13  18.635 -18.328 -12.589
   91    H    THR  14           H        THR  14  12.902 -12.177  -7.903
   92    HA   THR  14           HA       THR  14  11.727 -13.893  -5.805
   93    HB   THR  14           HB       THR  14  12.787 -11.053  -5.376
   94    HG1  THR  14           HG1      THR  14  14.553 -12.026  -6.113
   95   1HG2  THR  14          1HG2      THR  14  12.296 -13.321  -3.519
   96   2HG2  THR  14          2HG2      THR  14  11.882 -11.615  -3.351
   97   3HG2  THR  14          3HG2      THR  14  13.559 -12.136  -3.192
   98    H    PHE  15           H        PHE  15   9.637 -13.947  -6.444
   99    HA   PHE  15           HA       PHE  15   8.161 -11.405  -6.743
  100   1HB   PHE  15          2HB       PHE  15   7.407 -14.235  -7.451
  101   2HB   PHE  15          1HB       PHE  15   6.391 -12.808  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.945 -11.193  -9.435
  103    HD2  PHE  15           HD2      PHE  15   9.293 -14.723  -8.927
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.858 -11.648
  105    HE2  PHE  15           HE2      PHE  15  10.270 -14.359 -11.157
  106    HZ   PHE  15           HZ       PHE  15   9.599 -12.444 -12.504
  107    HA   PRO  16           HA       PRO  16   6.582 -11.998  -2.682
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.531  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.841  -9.830  -2.629
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.092  -5.200
  111   2HG   PRO  16          1HG       PRO  16   5.229  -8.736  -4.652
  112   1HD   PRO  16          1HD       PRO  16   6.217 -10.464  -6.439
  113   2HD   PRO  16          2HD       PRO  16   7.247  -9.796  -5.189
  114    H    LYS  17           H        LYS  17   5.299 -13.160  -1.504
  115    HA   LYS  17           HA       LYS  17   3.409 -14.926  -2.909
  116   1HB   LYS  17          2HB       LYS  17   5.300 -15.564  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.167 -16.702  -1.347
  118   1HG   LYS  17          2HG       LYS  17   6.217 -15.321  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.666 -16.743  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.454 -18.131  -3.362
  121   2HD   LYS  17          1HD       LYS  17   4.099 -16.993  -3.456
  122   1HE   LYS  17          2HE       LYS  17   6.460 -16.407  -5.140
  123   2HE   LYS  17          1HE       LYS  17   5.470 -17.804  -5.592
  124   1HZ   LYS  17          1HZ       LYS  17   4.771 -15.767  -6.650
  125   2HZ   LYS  17          2HZ       LYS  17   4.466 -15.075  -5.137
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.423  -5.664
  127    H    ARG  18           H        ARG  18   1.602 -15.579  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.733   0.104
  129   1HB   ARG  18          2HB       ARG  18  -0.556 -15.877  -0.970
  130   2HB   ARG  18          1HB       ARG  18   0.018 -16.687   0.494
  131   1HG   ARG  18          2HG       ARG  18  -1.228 -14.883   1.779
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.487   0.238
  133   1HD   ARG  18          2HD       ARG  18  -3.315 -15.945   1.818
  134   2HD   ARG  18          1HD       ARG  18  -3.128 -16.547   0.164
  135    HE   ARG  18           HE       ARG  18  -1.064 -17.633   1.570
  136   1HH1  ARG  18          2HH1      ARG  18  -4.657 -18.504   1.492
  137   2HH1  ARG  18          1HH1      ARG  18  -4.458 -18.842   3.179
  138   1HH2  ARG  18          2HH2      ARG  18  -1.543 -19.659   3.426
  139   2HH2  ARG  18          1HH2      ARG  18  -1.805 -20.427   1.896
  140    H    GLY  19           H        GLY  19   0.549 -13.147   2.148
  141   1HA   GLY  19          2HA       GLY  19   0.936 -13.448   4.429
  142   2HA   GLY  19          1HA       GLY  19   1.904 -14.879   4.045
  143    H    GLN  20           H        GLN  20   3.267 -12.975   1.914
  144    HA   GLN  20           HA       GLN  20   5.254 -11.989   3.784
  145   1HB   GLN  20          2HB       GLN  20   5.102 -11.879   0.770
  146   2HB   GLN  20          1HB       GLN  20   6.431 -11.203   1.722
  147   1HG   GLN  20          2HG       GLN  20   6.842 -13.492   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.124   1.569
  149   1HE2  GLN  20          1HE2      GLN  20   8.884 -13.777   1.915
  150   2HE2  GLN  20          2HE2      GLN  20   9.357 -13.643   0.258
  151    H    THR  21           H        THR  21   5.899  -9.935   4.063
  152    HA   THR  21           HA       THR  21   3.949  -7.849   3.443
  153    HB   THR  21           HB       THR  21   6.487  -7.829   5.134
  154    HG1  THR  21           HG1      THR  21   5.081  -8.526   6.605
  155   1HG2  THR  21          1HG2      THR  21   4.528  -5.600   4.683
  156   2HG2  THR  21          2HG2      THR  21   6.269  -5.594   4.396
  157   3HG2  THR  21          3HG2      THR  21   5.646  -5.683   6.044
  158    H    CYS  22           H        CYS  22   4.053  -6.679   1.688
  159    HA   CYS  22           HA       CYS  22   6.559  -6.386   0.226
  160   1HB   CYS  22          2HB       CYS  22   3.812  -5.362  -0.486
  161   2HB   CYS  22          1HB       CYS  22   5.234  -5.434  -1.544
  162    HG   CYS  22           HG       CYS  22   4.729  -7.766  -2.075
  163    H    VAL  23           H        VAL  23   7.677  -4.551   0.161
  164    HA   VAL  23           HA       VAL  23   6.772  -2.297   1.836
  165    HB   VAL  23           HB       VAL  23   9.633  -3.181   1.169
  166   1HG1  VAL  23          1HG1      VAL  23   8.493  -0.919   2.758
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.947   1.693
  168   3HG1  VAL  23          3HG1      VAL  23   9.996  -1.663   3.302
  169   1HG2  VAL  23          1HG2      VAL  23   7.797  -3.857   3.414
  170   2HG2  VAL  23          2HG2      VAL  23   9.509  -3.641   3.772
  171   3HG2  VAL  23          3HG2      VAL  23   9.000  -4.855   2.599
  172    H    VAL  24           H        VAL  24   6.137  -0.648   0.303
  173    HA   VAL  24           HA       VAL  24   7.581  -0.658  -2.263
  174    HB   VAL  24           HB       VAL  24   5.483  -0.200  -3.508
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.631  -1.779
  176   2HG1  VAL  24          2HG1      VAL  24   6.177  -2.583  -3.106
  177   3HG1  VAL  24          3HG1      VAL  24   4.458  -2.363  -3.429
  178   1HG2  VAL  24          1HG2      VAL  24   3.268  -0.455  -2.325
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.958  -1.798
  180   3HG2  VAL  24          3HG2      VAL  24   4.142  -0.490  -0.794
  181    H    HIS  25           H        HIS  25   7.790   1.373  -3.359
  182    HA   HIS  25           HA       HIS  25   6.700   3.595  -1.768
  183   1HB   HIS  25          2HB       HIS  25   9.116   3.369  -3.379
  184   2HB   HIS  25          1HB       HIS  25   8.118   4.724  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.082   5.443  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.969   4.836  -2.108
  187    HE1  HIS  25           HE1      HIS  25   8.512   6.539   0.827
  188    HE2  HIS  25           HE2      HIS  25  10.844   6.126   0.050
  189    H    TYR  26           H        TYR  26   5.064   5.001  -2.882
  190    HA   TYR  26           HA       TYR  26   4.445   4.246  -5.633
  191   1HB   TYR  26          2HB       TYR  26   2.139   3.707  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.742  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.748   5.509  -4.440
  194    HD2  TYR  26           HD2      TYR  26   2.893   3.060  -1.678
  195    HE1  TYR  26           HE1      TYR  26  -0.613   6.407  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.550   3.982   0.195
  197    HH   TYR  26           HH       TYR  26  -0.127   6.683   0.102
  198    H    THR  27           H        THR  27   3.221   5.734  -6.796
  199    HA   THR  27           HA       THR  27   2.334   8.164  -5.406
  200    HB   THR  27           HB       THR  27   3.483   8.077  -8.195
  201    HG1  THR  27           HG1      THR  27   4.357   8.924  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.782  -8.527
  203   2HG2  THR  27          2HG2      THR  27   3.189  10.688  -7.507
  204   3HG2  THR  27          3HG2      THR  27   1.738   9.972  -6.806
  205    H    GLY  28           H        GLY  28   0.073   8.085  -5.749
  206   1HA   GLY  28          2HA       GLY  28  -1.089   6.460  -7.921
  207   2HA   GLY  28          1HA       GLY  28  -1.922   6.971  -6.446
  208    H    MET  29           H        MET  29  -2.117   7.366  -9.513
  209    HA   MET  29           HA       MET  29  -2.905  10.190  -9.487
  210   1HB   MET  29          2HB       MET  29  -1.480   8.726 -11.720
  211   2HB   MET  29          1HB       MET  29  -2.184  10.343 -11.857
  212   1HG   MET  29          2HG       MET  29  -0.600  11.288 -10.509
  213   2HG   MET  29          1HG       MET  29  -0.178   9.743  -9.751
  214   1HE   MET  29          1HE       MET  29   0.793   8.008 -10.619
  215   2HE   MET  29          2HE       MET  29   2.360   8.218 -11.403
  216   3HE   MET  29          3HE       MET  29   0.961   7.703 -12.348
  217    H    LEU  30           H        LEU  30  -4.550  10.704 -10.718
  218    HA   LEU  30           HA       LEU  30  -6.563   8.805 -11.485
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.615 -10.971
  220   2HB   LEU  30          1HB       LEU  30  -7.161  11.340 -12.384
  221    HG   LEU  30           HG       LEU  30  -8.959  10.998 -11.159
  222   1HD1  LEU  30          1HD1      LEU  30  -8.540   8.873 -10.285
  223   2HD1  LEU  30          2HD1      LEU  30  -8.874   9.873  -8.871
  224   3HD1  LEU  30          3HD1      LEU  30  -7.211   9.450  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.617  12.083  -8.843
  226   2HD2  LEU  30          2HD2      LEU  30  -8.463  13.011 -10.336
  227   3HD2  LEU  30          3HD2      LEU  30  -7.018  12.446  -9.496
  228    H    GLU  31           H        GLU  31  -7.369   8.958 -13.976
  229    HA   GLU  31           HA       GLU  31  -5.216   8.503 -15.716
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.086 -16.064
  231   2HB   GLU  31          1HB       GLU  31  -7.057   8.987 -17.474
  232   1HG   GLU  31          2HG       GLU  31  -6.309   6.760 -16.613
  233   2HG   GLU  31          1HG       GLU  31  -7.627   6.865 -15.434
  234    H    ASP  32           H        ASP  32  -6.496  11.596 -14.899
  235    HA   ASP  32           HA       ASP  32  -5.306  12.764 -17.294
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.857 -16.413
  237   2HB   ASP  32          1HB       ASP  32  -7.439  13.612 -16.365
  238    H    GLY  33           H        GLY  33  -3.818  11.613 -14.623
  239   1HA   GLY  33          2HA       GLY  33  -1.526  11.886 -14.229
  240   2HA   GLY  33          1HA       GLY  33  -1.619  13.506 -14.937
  241    H    LYS  34           H        LYS  34  -4.145  13.640 -12.941
  242    HA   LYS  34           HA       LYS  34  -2.768  15.196 -11.018
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.190 -11.901
  244   2HB   LYS  34          1HB       LYS  34  -5.505  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.976  16.472  -9.966
  246   2HG   LYS  34          1HG       LYS  34  -5.697  16.690 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.722  14.717  -8.286
  248   2HD   LYS  34          1HD       LYS  34  -5.073  16.407  -7.890
  249   1HE   LYS  34          2HE       LYS  34  -7.008  14.532  -9.256
  250   2HE   LYS  34          1HE       LYS  34  -7.005  14.871  -7.518
  251   1HZ   LYS  34          1HZ       LYS  34  -8.074  16.371  -9.645
  252   2HZ   LYS  34          2HZ       LYS  34  -6.991  17.299  -8.737
  253   3HZ   LYS  34          3HZ       LYS  34  -8.312  16.535  -7.978
  254    H    LYS  35           H        LYS  35  -1.722  14.606  -9.322
  255    HA   LYS  35           HA       LYS  35  -1.546  11.907  -8.413
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.565  -8.492
  257   2HB   LYS  35          1HB       LYS  35  -0.488  14.442  -7.183
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.540  -5.702
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.724  -7.013
  260   1HD   LYS  35          2HD       LYS  35   2.379  12.751  -5.539
  261   2HD   LYS  35          1HD       LYS  35   2.366  13.635  -7.075
  262   1HE   LYS  35          2HE       LYS  35   0.922  15.362  -6.034
  263   2HE   LYS  35          1HE       LYS  35   1.033  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.282  14.954  -4.340
  265   2HZ   LYS  35          2HZ       LYS  35   2.541  16.413  -4.770
  266   3HZ   LYS  35          3HZ       LYS  35   3.382  15.499  -5.938
  267    H    PHE  36           H        PHE  36  -2.815  11.064  -6.760
  268    HA   PHE  36           HA       PHE  36  -4.246  13.051  -5.101
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.140  -4.493
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.610  -6.201
  271    HD1  PHE  36           HD1      PHE  36  -4.653   8.995  -3.835
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.541   6.621  -4.509
  274    HE2  PHE  36           HE2      PHE  36  -5.280   7.712  -8.564
  275    HZ   PHE  36           HZ       PHE  36  -4.859   5.986  -6.865
  276    H    ASP  37           H        ASP  37  -1.761  10.658  -4.990
  277    HA   ASP  37           HA       ASP  37  -1.055  11.467  -2.360
  278   1HB   ASP  37          2HB       ASP  37  -2.944   9.814  -1.833
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.556  -2.454
  280    H    SER  38           H        SER  38   0.978  10.467  -1.659
  281    HA   SER  38           HA       SER  38   2.321   8.514  -3.297
  282   1HB   SER  38          2HB       SER  38   2.764  10.583  -4.606
  283   2HB   SER  38          1HB       SER  38   3.450  11.333  -3.158
  284    HG   SER  38           HG       SER  38   5.034  10.354  -4.565
  285    H    SER  39           H        SER  39   3.580   7.305  -1.913
  286    HA   SER  39           HA       SER  39   4.091   8.271   0.752
  287   1HB   SER  39          2HB       SER  39   5.451   6.188   0.992
  288   2HB   SER  39          1HB       SER  39   3.791   5.895   0.458
  289    HG   SER  39           HG       SER  39   4.881   4.729  -0.965
  290    H    ARG  40           H        ARG  40   5.672   8.414  -2.310
  291    HA   ARG  40           HA       ARG  40   8.347   8.699  -1.495
  292   1HB   ARG  40          2HB       ARG  40   6.895   9.774  -3.938
  293   2HB   ARG  40          1HB       ARG  40   8.645   9.874  -3.706
  294   1HG   ARG  40          2HG       ARG  40   8.669   7.372  -3.552
  295   2HG   ARG  40          1HG       ARG  40   6.968   7.397  -4.046
  296   1HD   ARG  40          2HD       ARG  40   7.655   8.458  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.346   8.285  -5.688
  298    HE   ARG  40           HE       ARG  40   9.209   5.986  -6.101
  299   1HH1  ARG  40          1HH1      ARG  40   5.579   6.786  -6.202
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.969  -7.892
  301   1HH2  ARG  40          1HH2      ARG  40   7.872   3.981  -6.856
  302   2HH2  ARG  40          2HH2      ARG  40   6.915   4.487  -8.209
  303    H    ASP  41           H        ASP  41   5.606  11.042  -1.764
  304    HA   ASP  41           HA       ASP  41   7.158  13.334  -1.091
  305   1HB   ASP  41          2HB       ASP  41   4.188  12.793  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.378  -0.522
  307    H    ARG  42           H        ARG  42   5.682  10.788   0.920
  308    HA   ARG  42           HA       ARG  42   6.301  12.310   3.320
  309   1HB   ARG  42          2HB       ARG  42   5.438   9.439   3.145
  310   2HB   ARG  42          1HB       ARG  42   5.372  10.509   4.551
  311   1HG   ARG  42          2HG       ARG  42   3.750  11.917   3.344
  312   2HG   ARG  42          1HG       ARG  42   3.758  10.733   2.026
  313   1HD   ARG  42          2HD       ARG  42   3.174  10.027   4.870
  314   2HD   ARG  42          1HD       ARG  42   1.919  10.548   3.735
  315    HE   ARG  42           HE       ARG  42   3.115   7.957   3.944
  316   1HH1  ARG  42          1HH1      ARG  42   0.345   9.703   2.080
  317   2HH1  ARG  42          2HH1      ARG  42   1.578   9.539   0.876
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.328   2.839
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.787   1.328
  320    H    ASN  43           H        ASN  43   7.997  10.295   1.243
  321    HA   ASN  43           HA       ASN  43   9.991   9.198   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.556  11.533   2.023
  323   2HB   ASN  43          1HB       ASN  43  10.441  10.969   3.696
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.103   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.588   9.743   1.391
  326    H    LYS  44           H        LYS  44   7.797   7.928   2.742
  327    HA   LYS  44           HA       LYS  44   9.468   6.182   4.409
  328   1HB   LYS  44          2HB       LYS  44   8.223   7.816   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.711   7.205   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.014   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.598   6.830
  332   1HD   LYS  44          2HD       LYS  44   7.583   7.121   8.278
  333   2HD   LYS  44          1HD       LYS  44   6.034   6.934   7.435
  334   1HE   LYS  44          2HE       LYS  44   7.385   4.698   8.961
  335   2HE   LYS  44          1HE       LYS  44   6.178   5.779   9.676
  336   1HZ   LYS  44          1HZ       LYS  44   5.866   3.723   7.645
  337   2HZ   LYS  44          2HZ       LYS  44   4.809   5.044   7.655
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.034   9.022
  339    HA   PRO  45           HA       PRO  45   7.453   3.619   1.208
  340   1HB   PRO  45          2HB       PRO  45   8.336   1.316   2.815
  341   2HB   PRO  45          1HB       PRO  45   8.652   1.689   1.129
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.990   2.946
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.160   1.650
  344   1HD   PRO  45          1HD       PRO  45   9.468   3.381   4.524
  345   2HD   PRO  45          2HD       PRO  45  10.320   4.576   3.570
  346    H    PHE  46           H        PHE  46   5.602   2.323   1.036
  347    HA   PHE  46           HA       PHE  46   3.982   2.332   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.005   3.313   1.482
  349   2HB   PHE  46          1HB       PHE  46   3.340   1.839   0.559
  350    HD1  PHE  46           HD1      PHE  46   1.391   3.118   3.441
  351    HD2  PHE  46           HD2      PHE  46   1.765   0.211   0.359
  352    HE1  PHE  46           HE1      PHE  46  -0.840   2.247   3.983
  353    HE2  PHE  46           HE2      PHE  46  -0.462  -0.654   0.917
  354    HZ   PHE  46           HZ       PHE  46  -1.779   0.358   2.731
  355    H    LYS  47           H        LYS  47   3.424   0.256   4.456
  356    HA   LYS  47           HA       LYS  47   4.540  -2.088   3.050
  357   1HB   LYS  47          2HB       LYS  47   3.966  -1.641   5.984
  358   2HB   LYS  47          1HB       LYS  47   4.455  -3.195   5.294
  359   1HG   LYS  47          2HG       LYS  47   6.483  -2.131   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.001  -0.633   5.254
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.684   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.492  -3.262   6.666
  363   1HE   LYS  47          2HE       LYS  47   8.467  -2.421   5.552
  364   2HE   LYS  47          1HE       LYS  47   8.132  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.000   8.399
  366   2HZ   LYS  47          2HZ       LYS  47   9.621  -1.385   7.634
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.045   7.526
  368    H    PHE  48           H        PHE  48   3.031  -3.771   2.432
  369    HA   PHE  48           HA       PHE  48   0.643  -3.986   4.111
  370   1HB   PHE  48          2HB       PHE  48  -0.871  -4.237   2.306
  371   2HB   PHE  48          1HB       PHE  48   0.050  -2.759   1.981
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.774   0.223
  373    HD2  PHE  48           HD2      PHE  48  -0.910  -6.024   0.771
  374    HE1  PHE  48           HE1      PHE  48   2.258  -3.558  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.439  -6.811  -1.534
  376    HZ   PHE  48           HZ       PHE  48   1.146  -5.556  -2.945
  377    H    MET  49           H        MET  49  -0.031  -6.291   4.274
  378    HA   MET  49           HA       MET  49   1.873  -8.238   3.220
  379   1HB   MET  49          2HB       MET  49   1.322  -8.654   5.477
  380   2HB   MET  49          1HB       MET  49  -0.401  -8.376   5.188
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.502   4.182
  382   2HG   MET  49          1HG       MET  49   1.092 -10.766   4.147
  383   1HE   MET  49          1HE       MET  49   1.595 -10.935   8.133
  384   2HE   MET  49          2HE       MET  49   1.276  -9.410   7.306
  385   3HE   MET  49          3HE       MET  49   2.403 -10.573   6.607
  386    H    LEU  50           H        LEU  50   1.555  -9.321   1.511
  387    HA   LEU  50           HA       LEU  50  -0.591  -9.100  -0.213
  388   1HB   LEU  50          2HB       LEU  50   1.837 -10.577  -0.103
  389   2HB   LEU  50          1HB       LEU  50   0.514 -11.617  -0.634
  390    HG   LEU  50           HG       LEU  50   1.997  -9.556  -2.079
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.296  -2.467
  392   2HD1  LEU  50          2HD1      LEU  50   2.461 -11.927  -2.292
  393   3HD1  LEU  50          3HD1      LEU  50   1.597 -11.431  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.265  -9.495  -3.780
  395   2HD2  LEU  50          2HD2      LEU  50  -0.225  -8.668  -2.301
  396   3HD2  LEU  50          3HD2      LEU  50  -0.850 -10.276  -2.660
  397    H    GLY  51           H        GLY  51  -2.500 -10.135  -0.243
  398   1HA   GLY  51          2HA       GLY  51  -3.966 -11.915  -0.223
  399   2HA   GLY  51          1HA       GLY  51  -2.816 -12.828   0.767
  400    H    LYS  52           H        LYS  52  -3.037  -9.957   2.332
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.123   4.259
  402   1HB   LYS  52          2HB       LYS  52  -2.633  -9.864   4.490
  403   2HB   LYS  52          1HB       LYS  52  -3.670  -8.436   4.367
  404   1HG   LYS  52          2HG       LYS  52  -4.948  -9.342   6.363
  405   2HG   LYS  52          1HG       LYS  52  -3.626 -10.505   6.556
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.610   6.084
  407   2HD   LYS  52          1HD       LYS  52  -3.414  -7.508   6.196
  408   1HE   LYS  52          2HE       LYS  52  -3.790  -8.459   8.458
  409   2HE   LYS  52          1HE       LYS  52  -2.180  -9.179   8.302
  410   1HZ   LYS  52          1HZ       LYS  52  -2.521  -6.809   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.380   7.620
  412   3HZ   LYS  52          3HZ       LYS  52  -1.188  -7.185   8.286
  413    H    GLN  53           H        GLN  53  -5.463  -9.221   1.593
  414    HA   GLN  53           HA       GLN  53  -7.281  -8.072   0.877
  415   1HB   GLN  53          2HB       GLN  53  -8.464  -9.202   3.402
  416   2HB   GLN  53          1HB       GLN  53  -9.382  -8.293   2.195
  417   1HG   GLN  53          2HG       GLN  53  -9.298  -9.999   0.666
  418   2HG   GLN  53          1HG       GLN  53  -7.927 -10.783   1.470
  419   1HE2  GLN  53          1HE2      GLN  53  -9.753 -12.935   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.731   3.276
  421    H    GLU  54           H        GLU  54  -5.348  -6.569   2.308
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.585   3.519
  423   1HB   GLU  54          2HB       GLU  54  -5.240  -3.759   4.725
  424   2HB   GLU  54          1HB       GLU  54  -5.553  -5.464   5.078
  425   1HG   GLU  54          2HG       GLU  54  -3.732  -6.107   3.601
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.399   3.248
  427    H    VAL  55           H        VAL  55  -5.458  -5.033   0.730
  428    HA   VAL  55           HA       VAL  55  -5.543  -2.135   0.239
  429    HB   VAL  55           HB       VAL  55  -3.881  -2.656  -1.664
  430   1HG1  VAL  55          1HG1      VAL  55  -3.276  -2.882   1.283
  431   2HG1  VAL  55          2HG1      VAL  55  -3.214  -1.440   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.006  -2.710   0.073
  433   1HG2  VAL  55          1HG2      VAL  55  -3.254  -5.155  -0.162
  434   2HG2  VAL  55          2HG2      VAL  55  -2.604  -4.582  -1.698
  435   3HG2  VAL  55          3HG2      VAL  55  -4.278  -5.125  -1.596
  436    H    ILE  56           H        ILE  56  -5.905  -1.831  -2.310
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.119  -2.876
  438    HB   ILE  56           HB       ILE  56  -8.229  -1.807  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.913  -0.390  -3.802
  440   2HG1  ILE  56          1HG1      ILE  56  -5.702  -1.648  -5.033
  441   1HG2  ILE  56          1HG2      ILE  56  -9.528  -0.597  -3.669
  442   2HG2  ILE  56          2HG2      ILE  56  -8.132   0.475  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.379  -0.755  -2.341
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.249  -6.672
  445   2HD1  ILE  56          2HD1      ILE  56  -5.492   0.605  -5.992
  446   3HD1  ILE  56          3HD1      ILE  56  -7.123   0.996  -5.448
  447    H    ARG  57           H        ARG  57  -8.929  -4.373  -4.685
  448    HA   ARG  57           HA       ARG  57  -7.301  -6.655  -4.956
  449   1HB   ARG  57          2HB       ARG  57  -9.778  -6.631  -5.312
  450   2HB   ARG  57          1HB       ARG  57  -9.544  -5.686  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.334  -7.515  -7.790
  452   2HG   ARG  57          1HG       ARG  57  -8.506  -8.459  -6.301
  453   1HD   ARG  57          2HD       ARG  57 -10.926  -8.588  -6.656
  454   2HD   ARG  57          1HD       ARG  57 -10.767  -7.626  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.771  -8.134
  456   1HH1  ARG  57          1HH1      ARG  57 -12.265  -9.325  -9.730
  457   2HH1  ARG  57          2HH1      ARG  57 -12.630 -10.669  -8.699
  458   1HH2  ARG  57          1HH2      ARG  57  -9.483 -11.967  -9.049
  459   2HH2  ARG  57          2HH2      ARG  57 -10.209 -11.505 -10.551
  460    H    GLY  58           H        GLY  58  -7.318  -3.874  -7.249
  461   1HA   GLY  58          2HA       GLY  58  -5.786  -5.258  -9.176
  462   2HA   GLY  58          1HA       GLY  58  -5.913  -3.500  -9.004
  463    H    TRP  59           H        TRP  59  -4.853  -3.702  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.018  -3.685  -6.666
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.134  -4.344
  466   2HB   TRP  59          1HB       TRP  59  -2.168  -3.716  -3.948
  467    HD1  TRP  59           HD1      TRP  59  -3.604  -1.156  -6.510
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.903  -6.379
  469    HE3  TRP  59           HE3      TRP  59  -0.322  -2.655  -2.814
  470    HZ2  TRP  59           HZ2      TRP  59   0.089   1.799  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.154
  472    HH2  TRP  59           HH2      TRP  59   1.658   1.074  -3.214
  473    H    GLU  60           H        GLU  60  -3.997  -5.885  -4.553
  474    HA   GLU  60           HA       GLU  60  -2.182  -7.808  -3.914
  475   1HB   GLU  60          2HB       GLU  60  -4.937  -8.446  -4.979
  476   2HB   GLU  60          1HB       GLU  60  -3.932  -9.488  -3.961
  477   1HG   GLU  60          2HG       GLU  60  -4.905  -6.875  -2.950
  478   2HG   GLU  60          1HG       GLU  60  -5.970  -8.291  -2.984
  479    H    GLU  61           H        GLU  61  -3.992  -7.515  -6.943
  480    HA   GLU  61           HA       GLU  61  -2.771  -9.827  -8.164
  481   1HB   GLU  61          2HB       GLU  61  -4.418  -7.607  -9.393
  482   2HB   GLU  61          1HB       GLU  61  -4.041  -9.165 -10.139
  483   1HG   GLU  61          2HG       GLU  61  -5.246  -9.499  -7.529
  484   2HG   GLU  61          1HG       GLU  61  -6.276  -8.538  -8.605
  485    H    GLY  62           H        GLY  62  -2.125  -6.342  -8.335
  486   1HA   GLY  62          2HA       GLY  62  -0.508  -6.786 -10.674
  487   2HA   GLY  62          1HA       GLY  62  -0.757  -5.248  -9.833
  488    H    VAL  63           H        VAL  63   0.134  -5.861  -7.306
  489    HA   VAL  63           HA       VAL  63   2.942  -5.683  -7.764
  490    HB   VAL  63           HB       VAL  63   1.302  -5.995  -5.199
  491   1HG1  VAL  63          1HG1      VAL  63   3.647  -6.696  -4.932
  492   2HG1  VAL  63          2HG1      VAL  63   3.349  -5.180  -4.082
  493   3HG1  VAL  63          3HG1      VAL  63   4.186  -5.171  -5.634
  494   1HG2  VAL  63          1HG2      VAL  63   0.932  -3.779  -6.426
  495   2HG2  VAL  63          2HG2      VAL  63   2.679  -3.533  -6.449
  496   3HG2  VAL  63          3HG2      VAL  63   1.807  -3.530  -4.917
  497    H    ALA  64           H        ALA  64   0.822  -8.473  -7.070
  498    HA   ALA  64           HA       ALA  64   2.871 -10.243  -6.295
  499   1HB   ALA  64          1HB       ALA  64   0.455 -10.984  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.405 -10.689  -6.178
  501   3HB   ALA  64          3HB       ALA  64   1.385 -12.007  -6.820
  502    H    GLN  65           H        GLN  65   2.108  -8.870  -9.375
  503    HA   GLN  65           HA       GLN  65   3.584 -10.841 -10.888
  504   1HB   GLN  65          2HB       GLN  65   2.247  -8.222 -11.564
  505   2HB   GLN  65          1HB       GLN  65   3.243  -9.099 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.821 -11.071 -12.541
  507   2HG   GLN  65          1HG       GLN  65   0.884 -10.309 -11.243
  508   1HE2  GLN  65          1HE2      GLN  65  -1.178  -9.486 -12.159
  509   2HE2  GLN  65          2HE2      GLN  65  -0.902  -8.128 -13.192
  510    H    MET  66           H        MET  66   4.752  -8.571  -8.816
  511    HA   MET  66           HA       MET  66   6.777  -7.620 -10.720
  512   1HB   MET  66          2HB       MET  66   5.986  -6.535  -8.024
  513   2HB   MET  66          1HB       MET  66   7.237  -5.863  -9.079
  514   1HG   MET  66          2HG       MET  66   5.598  -5.381 -10.782
  515   2HG   MET  66          1HG       MET  66   4.329  -6.153  -9.815
  516   1HE   MET  66          1HE       MET  66   7.230  -3.850  -8.685
  517   2HE   MET  66          2HE       MET  66   6.480  -2.254  -8.657
  518   3HE   MET  66          3HE       MET  66   6.731  -3.084 -10.192
  519    H    SER  67           H        SER  67   8.936  -7.975 -10.280
  520    HA   SER  67           HA       SER  67   9.649  -9.756  -8.079
  521   1HB   SER  67          2HB       SER  67  11.858  -9.704  -9.290
  522   2HB   SER  67          1HB       SER  67  10.496 -10.435 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.799 -11.555
  524    H    VAL  68           H        VAL  68  11.482  -9.147  -6.637
  525    HA   VAL  68           HA       VAL  68  11.309  -6.546  -5.628
  526    HB   VAL  68           HB       VAL  68  13.514  -8.620  -5.346
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.416  -3.308
  528   2HG1  VAL  68          2HG1      VAL  68  12.990  -6.167  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.360  -6.390  -4.731
  530   1HG2  VAL  68          1HG2      VAL  68  11.724  -9.651  -4.480
  531   2HG2  VAL  68          2HG2      VAL  68  10.882  -8.142  -4.130
  532   3HG2  VAL  68          3HG2      VAL  68  12.174  -8.699  -3.065
  533    H    GLY  69           H        GLY  69  12.137  -4.762  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.884  -3.301  -6.745
  535   2HA   GLY  69          1HA       GLY  69  14.458  -4.530  -7.883
  536    H    GLN  70           H        GLN  70  11.269  -4.686  -8.434
  537    HA   GLN  70           HA       GLN  70  11.690  -3.131 -10.841
  538   1HB   GLN  70          2HB       GLN  70  10.813  -5.488 -10.677
  539   2HB   GLN  70          1HB       GLN  70   9.325  -4.777 -10.035
  540   1HG   GLN  70          2HG       GLN  70   9.150  -3.445 -12.106
  541   2HG   GLN  70          1HG       GLN  70  10.537  -4.345 -12.742
  542   1HE2  GLN  70          2HE2      GLN  70   9.493  -7.238 -12.035
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.875 -11.426
  544    H    ARG  71           H        ARG  71  10.582  -1.587 -11.624
  545    HA   ARG  71           HA       ARG  71   8.697  -0.178  -9.845
  546   1HB   ARG  71          2HB       ARG  71  10.803   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.687   1.054 -11.765
  548   1HG   ARG  71          2HG       ARG  71   8.899   2.570 -11.793
  549   2HG   ARG  71          1HG       ARG  71   8.396   2.159 -10.146
  550   1HD   ARG  71          2HD       ARG  71  10.283   3.311  -9.214
  551   2HD   ARG  71          1HD       ARG  71  10.989   3.553 -10.820
  552    HE   ARG  71           HE       ARG  71   8.425   4.695 -10.780
  553   1HH1  ARG  71          2HH1      ARG  71  11.612   5.179  -9.289
  554   2HH1  ARG  71          1HH1      ARG  71  11.463   6.905  -9.285
  555   1HH2  ARG  71          1HH2      ARG  71   8.120   6.876 -10.465
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.986
  557    H    ALA  72           H        ALA  72   6.801  -0.069 -10.813
  558    HA   ALA  72           HA       ALA  72   6.469  -0.150 -13.715
  559   1HB   ALA  72          1HB       ALA  72   5.011  -2.005 -13.696
  560   2HB   ALA  72          2HB       ALA  72   4.895  -1.996 -11.936
  561   3HB   ALA  72          3HB       ALA  72   6.392  -2.503 -12.718
  562    H    LYS  73           H        LYS  73   4.461   0.425 -14.506
  563    HA   LYS  73           HA       LYS  73   2.807   2.084 -12.737
  564   1HB   LYS  73          2HB       LYS  73   3.831   3.035 -14.744
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.821 -15.724
  566   1HG   LYS  73          2HG       LYS  73   0.828   2.876 -14.912
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.218 -14.335
  568   1HD   LYS  73          2HD       LYS  73   2.965   4.301 -16.495
  569   2HD   LYS  73          1HD       LYS  73   1.971   2.953 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.016   4.448 -16.677
  571   2HE   LYS  73          1HE       LYS  73   1.147   5.770 -16.499
  572   1HZ   LYS  73          1HZ       LYS  73   0.808   4.007 -18.848
  573   2HZ   LYS  73          2HZ       LYS  73   2.039   5.156 -18.682
  574   3HZ   LYS  73          3HZ       LYS  73   0.408   5.648 -18.751
  575    H    LEU  74           H        LEU  74   0.909   1.251 -12.075
  576    HA   LEU  74           HA       LEU  74  -0.135  -1.172 -13.368
  577   1HB   LEU  74          2HB       LEU  74   0.212  -0.093 -10.655
  578   2HB   LEU  74          1HB       LEU  74  -1.340  -0.881 -10.938
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.000 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.990  -3.482 -11.266
  581   2HD1  LEU  74          2HD1      LEU  74   2.322  -1.757 -11.424
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.588 -12.650
  583   1HD2  LEU  74          1HD2      LEU  74  -0.467  -1.888  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.230  -1.448  -9.035
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.146  -8.938
  586    H    THR  75           H        THR  75  -1.870  -0.574 -14.790
  587    HA   THR  75           HA       THR  75  -3.497   1.772 -14.022
  588    HB   THR  75           HB       THR  75  -3.435   0.122 -16.597
  589    HG1  THR  75           HG1      THR  75  -1.653   1.267 -16.760
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.968 -17.628
  591   2HG2  THR  75          2HG2      THR  75  -4.844   2.694 -16.037
  592   3HG2  THR  75          3HG2      THR  75  -5.576   1.134 -16.412
  593    H    ILE  76           H        ILE  76  -5.454   1.333 -12.988
  594    HA   ILE  76           HA       ILE  76  -6.291  -1.483 -12.782
  595    HB   ILE  76           HB       ILE  76  -6.389   0.673 -10.636
  596   1HG1  ILE  76          2HG1      ILE  76  -4.508  -1.672 -10.945
  597   2HG1  ILE  76          1HG1      ILE  76  -4.084   0.026 -11.221
  598   1HG2  ILE  76          1HG2      ILE  76  -7.210  -2.170 -10.634
  599   2HG2  ILE  76          2HG2      ILE  76  -8.130  -0.726 -10.214
  600   3HG2  ILE  76          3HG2      ILE  76  -6.833  -1.283  -9.157
  601   1HD1  ILE  76          1HD1      ILE  76  -4.414  -1.467  -8.691
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.220  -8.708
  603   3HD1  ILE  76          3HD1      ILE  76  -3.266  -0.200  -9.126
  604    H    SER  77           H        SER  77  -8.340  -1.762 -13.535
  605    HA   SER  77           HA       SER  77 -10.074   0.347 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.733  -1.397 -14.643
  607   2HB   SER  77          1HB       SER  77 -10.163  -1.886 -15.294
  608    HG   SER  77           HG       SER  77 -11.683  -3.015 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.060   1.321 -10.425
  610   1HB   PRO  78          2HB       PRO  78 -14.776   1.357 -11.227
  611   2HB   PRO  78          1HB       PRO  78 -13.688   2.734 -11.185
  612   1HG   PRO  78          2HG       PRO  78 -14.507   1.056 -13.515
  613   2HG   PRO  78          1HG       PRO  78 -14.012   2.740 -13.488
  614   1HD   PRO  78          1HD       PRO  78 -12.360   0.788 -14.398
  615   2HD   PRO  78          2HD       PRO  78 -11.741   2.211 -13.585
  616    H    ASP  79           H        ASP  79 -13.478  -1.462 -12.055
  617    HA   ASP  79           HA       ASP  79 -14.744  -2.336  -9.643
  618   1HB   ASP  79          2HB       ASP  79 -15.147  -4.410 -10.854
  619   2HB   ASP  79          1HB       ASP  79 -15.490  -3.031 -11.909
  620    H    TYR  80           H        TYR  80 -11.546  -2.401 -10.612
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.457  -8.686
  622   1HB   TYR  80          2HB       TYR  80  -9.560  -3.182 -11.069
  623   2HB   TYR  80          1HB       TYR  80  -8.480  -3.757  -9.788
  624    HD1  TYR  80           HD1      TYR  80 -11.503  -4.892 -11.641
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.878
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.200 -12.484
  627    HE2  TYR  80           HE2      TYR  80  -7.919  -8.146 -10.692
  628    HH   TYR  80           HH       TYR  80  -8.975  -9.435 -12.229
  629    H    ALA  81           H        ALA  81 -11.563  -1.443  -8.396
  630    HA   ALA  81           HA       ALA  81  -9.392  -0.749  -6.537
  631   1HB   ALA  81          1HB       ALA  81  -9.043   0.365  -8.764
  632   2HB   ALA  81          2HB       ALA  81  -9.310   1.510  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.616   1.142  -8.573
  634    H    TYR  82           H        TYR  82 -11.705   1.776  -7.022
  635    HA   TYR  82           HA       TYR  82 -13.144   0.958  -4.576
  636   1HB   TYR  82          2HB       TYR  82 -12.503   3.643  -5.852
  637   2HB   TYR  82          1HB       TYR  82 -13.463   3.449  -4.376
  638    HD1  TYR  82           HD1      TYR  82 -12.315   2.135  -2.428
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.941  -5.711
  640    HE1  TYR  82           HE1      TYR  82 -10.207   2.036  -1.125
  641    HE2  TYR  82           HE2      TYR  82  -8.141   3.838  -4.422
  642    HH   TYR  82           HH       TYR  82  -7.555   3.779  -1.856
  643    H    GLY  83           H        GLY  83 -13.805   0.861  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.708   0.433  -8.896
  645   2HA   GLY  83          1HA       GLY  83 -16.439   0.099  -7.320
  646    H    ALA  84           H        ALA  84 -18.268   0.983  -7.434
  647    HA   ALA  84           HA       ALA  84 -18.706   3.583  -8.634
  648   1HB   ALA  84          1HB       ALA  84 -20.324   1.691  -8.790
  649   2HB   ALA  84          2HB       ALA  84 -21.024   3.181  -8.157
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.863  -7.059
  651    H    THR  85           H        THR  85 -18.019   2.428  -5.346
  652    HA   THR  85           HA       THR  85 -19.182   4.739  -4.103
  653    HB   THR  85           HB       THR  85 -16.856   3.115  -3.033
  654    HG1  THR  85           HG1      THR  85 -19.570   2.454  -2.690
  655   1HG2  THR  85          1HG2      THR  85 -19.157   4.616  -1.812
  656   2HG2  THR  85          2HG2      THR  85 -17.432   4.850  -1.533
  657   3HG2  THR  85          3HG2      THR  85 -18.237   3.409  -0.915
  658    H    GLY  86           H        GLY  86 -15.913   4.003  -5.319
  659   1HA   GLY  86          2HA       GLY  86 -14.099   5.463  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.216   6.806  -5.305
  661    H    HIS  87           H        HIS  87 -13.165   7.511  -3.886
  662    HA   HIS  87           HA       HIS  87 -13.464   6.202  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.189   6.025  -2.258
  664   2HB   HIS  87          1HB       HIS  87 -11.086   7.793  -2.210
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.797   0.417
  666    HD2  HIS  87           HD2      HIS  87 -10.711   4.669  -0.091
  667    HE1  HIS  87           HE1      HIS  87 -10.104   7.851   2.598
  668    HE2  HIS  87           HE2      HIS  87 -10.002   5.372   2.224
  669    HA   PRO  88           HA       PRO  88 -15.772  10.119  -0.978
  670   1HB   PRO  88          2HB       PRO  88 -15.861  10.505   1.732
  671   2HB   PRO  88          1HB       PRO  88 -16.875   9.331   0.912
  672   1HG   PRO  88          2HG       PRO  88 -14.225   8.864   2.307
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.495
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.987   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.539   6.972   0.308
  676    H    GLY  89           H        GLY  89 -15.167  11.873  -1.572
  677   1HA   GLY  89          2HA       GLY  89 -14.150  13.914  -1.650
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.213
  679    H    ILE  90           H        ILE  90 -12.042  11.021  -1.770
  680    HA   ILE  90           HA       ILE  90  -9.978  12.655  -3.118
  681    HB   ILE  90           HB       ILE  90  -9.842   9.884  -1.827
  682   1HG1  ILE  90          2HG1      ILE  90  -8.445  12.390  -0.968
  683   2HG1  ILE  90          1HG1      ILE  90 -10.099  12.030  -0.441
  684   1HG2  ILE  90          1HG2      ILE  90  -7.309  10.386  -1.933
  685   2HG2  ILE  90          2HG2      ILE  90  -7.712  11.627  -3.116
  686   3HG2  ILE  90          3HG2      ILE  90  -8.066   9.934  -3.459
  687   1HD1  ILE  90          1HD1      ILE  90  -9.336  10.708   1.163
  688   2HD1  ILE  90          2HD1      ILE  90  -7.695  11.180   0.727
  689   3HD1  ILE  90          3HD1      ILE  90  -8.424   9.749  -0.003
  690    H    ILE  91           H        ILE  91 -11.665   9.563  -3.637
  691    HA   ILE  91           HA       ILE  91 -10.634   9.708  -6.403
  692    HB   ILE  91           HB       ILE  91 -11.716   7.252  -4.977
  693   1HG1  ILE  91          2HG1      ILE  91  -9.604   7.977  -3.972
  694   2HG1  ILE  91          1HG1      ILE  91  -9.414   6.462  -4.872
  695   1HG2  ILE  91          1HG2      ILE  91 -10.552   6.111  -6.910
  696   2HG2  ILE  91          2HG2      ILE  91 -10.440   7.708  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.020   7.012  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.508   7.969  -5.199
  699   2HD1  ILE  91          2HD1      ILE  91  -8.592   9.197  -5.853
  700   3HD1  ILE  91          3HD1      ILE  91  -8.369   7.672  -6.711
  701    HA   PRO  92           HA       PRO  92 -15.250  10.299  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.682   9.826  -9.877
  703   2HB   PRO  92          1HB       PRO  92 -15.346  11.254  -9.101
  704   1HG   PRO  92          2HG       PRO  92 -12.862  11.317 -10.115
  705   2HG   PRO  92          1HG       PRO  92 -13.211  12.133  -8.600
  706   1HD   PRO  92          1HD       PRO  92 -12.060   9.356  -8.998
  707   2HD   PRO  92          2HD       PRO  92 -11.420  10.652  -8.011
  708    HA   PRO  93           HA       PRO  93 -16.846   6.125  -7.869
  709   1HB   PRO  93          2HB       PRO  93 -18.920   7.281  -9.560
  710   2HB   PRO  93          1HB       PRO  93 -19.088   6.342  -8.087
  711   1HG   PRO  93          2HG       PRO  93 -19.618   9.036  -8.232
  712   2HG   PRO  93          1HG       PRO  93 -19.150   8.221  -6.749
  713   1HD   PRO  93          1HD       PRO  93 -17.516   9.977  -8.525
  714   2HD   PRO  93          2HD       PRO  93 -17.369   9.712  -6.800
  715    H    HIS  94           H        HIS  94 -16.500   4.744  -9.377
  716    HA   HIS  94           HA       HIS  94 -15.944   3.693 -11.308
  717   1HB   HIS  94          2HB       HIS  94 -17.265   6.169 -12.562
  718   2HB   HIS  94          1HB       HIS  94 -16.932   4.652 -13.416
  719    HD1  HIS  94           HD1      HIS  94 -18.295   2.487 -12.155
  720    HD2  HIS  94           HD2      HIS  94 -19.607   6.360 -11.436
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.311 -11.164
  722    HE2  HIS  94           HE2      HIS  94 -21.351   4.657 -10.759
  723    H    ALA  95           H        ALA  95 -13.894   5.538 -10.142
  724    HA   ALA  95           HA       ALA  95 -12.523   6.635 -12.450
  725   1HB   ALA  95          1HB       ALA  95 -12.630   7.329  -9.872
  726   2HB   ALA  95          2HB       ALA  95 -11.237   7.692 -10.891
  727   3HB   ALA  95          3HB       ALA  95 -11.203   6.294  -9.819
  728    H    THR  96           H        THR  96 -10.925   5.699 -13.745
  729    HA   THR  96           HA       THR  96  -9.715   3.198 -13.010
  730    HB   THR  96           HB       THR  96  -9.159   5.172 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.420   3.811 -16.393
  732   1HG2  THR  96          1HG2      THR  96  -7.730   2.634 -14.647
  733   2HG2  THR  96          2HG2      THR  96  -7.064   4.252 -14.874
  734   3HG2  THR  96          3HG2      THR  96  -7.753   3.381 -16.245
  735    H    LEU  97           H        LEU  97  -7.695   3.076 -11.872
  736    HA   LEU  97           HA       LEU  97  -6.462   5.644 -11.105
  737   1HB   LEU  97          2HB       LEU  97  -6.523   2.946  -9.734
  738   2HB   LEU  97          1HB       LEU  97  -5.731   4.393  -9.102
  739    HG   LEU  97           HG       LEU  97  -8.696   3.975  -9.442
  740   1HD1  LEU  97          1HD1      LEU  97  -8.706   3.955  -7.053
  741   2HD1  LEU  97          2HD1      LEU  97  -6.988   4.352  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.510   2.781  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.505   6.246  -9.826
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.407  -8.822
  745   3HD2  LEU  97          3HD2      LEU  97  -8.645   6.198  -8.069
  746    H    VAL  98           H        VAL  98  -4.208   5.848 -11.143
  747    HA   VAL  98           HA       VAL  98  -2.849   3.762 -12.691
  748    HB   VAL  98           HB       VAL  98  -2.520   6.782 -12.883
  749   1HG1  VAL  98          1HG1      VAL  98  -1.026   4.460 -14.105
  750   2HG1  VAL  98          2HG1      VAL  98  -0.379   5.705 -13.035
  751   3HG1  VAL  98          3HG1      VAL  98  -0.881   6.124 -14.673
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.908 -15.158
  753   2HG2  VAL  98          2HG2      VAL  98  -3.415   6.653 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.467   5.573 -14.149
  755    H    PHE  99           H        PHE  99  -1.239   2.911 -11.259
  756    HA   PHE  99           HA       PHE  99  -0.234   4.766  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.719   1.816  -9.169
  758   2HB   PHE  99          1HB       PHE  99   0.435   2.563  -8.052
  759    HD1  PHE  99           HD1      PHE  99  -3.098   2.160  -8.947
  760    HD2  PHE  99           HD2      PHE  99  -0.266   3.912  -6.251
  761    HE1  PHE  99           HE1      PHE  99  -4.902   2.661  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.089   4.403  -4.662
  763    HZ   PHE  99           HZ       PHE  99  -4.397   3.778  -5.220
  764    H    ASP 100           H        ASP 100   1.947   5.076  -9.152
  765    HA   ASP 100           HA       ASP 100   3.709   3.600 -10.964
  766   1HB   ASP 100          2HB       ASP 100   3.847   5.986 -11.157
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.148  -9.411
  768    H    VAL 101           H        VAL 101   4.564   1.928  -9.766
  769    HA   VAL 101           HA       VAL 101   4.828   2.053  -6.829
  770    HB   VAL 101           HB       VAL 101   3.653  -0.202  -8.532
  771   1HG1  VAL 101          1HG1      VAL 101   3.149  -1.243  -6.291
  772   2HG1  VAL 101          2HG1      VAL 101   4.248  -0.060  -5.580
  773   3HG1  VAL 101          3HG1      VAL 101   4.852  -1.234  -6.751
  774   1HG2  VAL 101          1HG2      VAL 101   1.644   0.199  -7.113
  775   2HG2  VAL 101          2HG2      VAL 101   2.123   1.753  -7.797
  776   3HG2  VAL 101          3HG2      VAL 101   2.550   1.353  -6.132
  777    H    GLU 102           H        GLU 102   6.714   1.360  -6.030
  778    HA   GLU 102           HA       GLU 102   8.511  -0.105  -7.838
  779   1HB   GLU 102          2HB       GLU 102   9.366   2.099  -7.492
  780   2HB   GLU 102          1HB       GLU 102   9.086   1.987  -5.749
  781   1HG   GLU 102          2HG       GLU 102  10.832   0.480  -5.436
  782   2HG   GLU 102          1HG       GLU 102  10.875   0.034  -7.151
  783    H    LEU 103           H        LEU 103   8.833  -2.173  -7.006
  784    HA   LEU 103           HA       LEU 103   8.027  -2.669  -4.241
  785   1HB   LEU 103          2HB       LEU 103   7.227  -4.249  -5.863
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.467  -6.530
  787    HG   LEU 103           HG       LEU 103   9.548  -5.664  -4.531
  788   1HD1  LEU 103          1HD1      LEU 103   6.783  -4.963  -3.523
  789   2HD1  LEU 103          2HD1      LEU 103   8.336  -4.624  -2.761
  790   3HD1  LEU 103          3HD1      LEU 103   7.733  -6.280  -2.836
  791   1HD2  LEU 103          1HD2      LEU 103   7.981  -7.616  -4.730
  792   2HD2  LEU 103          2HD2      LEU 103   8.589  -7.006  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.951  -6.609  -5.747
  794    H    LEU 104           H        LEU 104   9.457  -2.278  -2.766
  795    HA   LEU 104           HA       LEU 104  12.289  -2.024  -3.405
  796   1HB   LEU 104          2HB       LEU 104  10.807  -1.447  -0.821
  797   2HB   LEU 104          1HB       LEU 104  12.476  -0.997  -1.180
  798    HG   LEU 104           HG       LEU 104  10.041   0.191  -2.506
  799   1HD1  LEU 104          1HD1      LEU 104  10.370   0.798  -0.055
  800   2HD1  LEU 104          2HD1      LEU 104  10.327   2.140  -1.199
  801   3HD1  LEU 104          3HD1      LEU 104  11.869   1.579  -0.556
  802   1HD2  LEU 104          1HD2      LEU 104  12.274   0.035  -3.736
  803   2HD2  LEU 104          2HD2      LEU 104  12.923   1.104  -2.492
  804   3HD2  LEU 104          3HD2      LEU 104  11.621   1.662  -3.543
  805    H    LYS 105           H        LYS 105  10.327  -4.008  -1.312
  806    HA   LYS 105           HA       LYS 105  12.566  -5.749  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.825  -3.636   0.611
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.082   1.447
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.015   2.349
  810   2HG   LYS 105          1HG       LYS 105  13.834  -5.708   1.415
  811   1HD   LYS 105          2HD       LYS 105  14.217  -3.641   2.556
  812   2HD   LYS 105          1HD       LYS 105  12.615  -3.695   3.311
  813   1HE   LYS 105          2HE       LYS 105  13.276  -5.923   4.301
  814   2HE   LYS 105          1HE       LYS 105  14.923  -5.603   3.733
  815   1HZ   LYS 105          1HZ       LYS 105  13.453  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.253  -3.309   4.907
  817   3HZ   LYS 105          3HZ       LYS 105  15.123  -4.567   5.660
  818    H    LEU 106           H        LEU 106  11.794  -7.704   0.372
  819    HA   LEU 106           HA       LEU 106   8.922  -7.755   1.009
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.085   0.182
  821   2HB   LEU 106          1HB       LEU 106   8.990 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.870  -8.833  -1.808
  823   1HD1  LEU 106          1HD1      LEU 106   8.415 -11.424  -1.350
  824   2HD1  LEU 106          2HD1      LEU 106  10.121 -11.286  -1.775
  825   3HD1  LEU 106          3HD1      LEU 106   8.883 -10.735  -2.904
  826   1HD2  LEU 106          1HD2      LEU 106   7.567  -8.573  -2.323
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.673
  828   3HD2  LEU 106          3HD2      LEU 106   7.072  -9.577  -0.960
  829    H    GLU 107           HN       GLU 107   8.525  -8.269   3.051
  830    HA   GLU 107           HA       GLU 107  10.716  -9.186   4.800
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.228   5.416
  832   2HB   GLU 107          1HB       GLU 107   9.697  -7.831   6.579
  833   1HG   GLU 107          2HG       GLU 107  11.468  -6.821   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.234  -6.152   4.164
  835    H2   GPI 108           H2       GPI 108  -3.723   1.698  -2.146
  836   1H5   GPI 108          1H5       GPI 108  -2.211   4.370  -1.725
  837   2H5   GPI 108          2H5       GPI 108  -2.228   4.519   0.042
  838   1H3   GPI 108          1H3       GPI 108  -1.822   0.536  -1.097
  839   2H3   GPI 108          2H3       GPI 108  -2.336   1.011   0.532
  840   1H4   GPI 108          1H4       GPI 108  -0.802   2.542  -1.570
  841   2H4   GPI 108          2H4       GPI 108  -0.716   2.757   0.206
  842   1H14  GPI 108          1H14      GPI 108  -6.685  -0.069   1.136
  843   2H14  GPI 108          2H14      GPI 108  -7.022   1.471   0.312
  844   1H15  GPI 108          1H15      GPI 108  -7.476   2.530   2.278
  845   2H15  GPI 108          2H15      GPI 108  -6.024   1.863   3.058
  846   1H16  GPI 108          1H16      GPI 108  -7.232  -0.315   3.372
  847   2H16  GPI 108          2H16      GPI 108  -8.035   1.033   4.213
  848    H20  GPI 108           H20      GPI 108 -12.347  -0.371   0.438
  849    H21  GPI 108           H21      GPI 108 -10.802  -2.242   0.999
  850    H22  GPI 108           H22      GPI 108  -8.714  -1.784   2.278
  851    H18  GPI 108           H18      GPI 108  -9.711   2.408   2.436
  852   1H12  GPI 108          1H12      GPI 108  -2.901   5.914   1.841
  853   2H12  GPI 108          2H12      GPI 108  -3.936   5.535   3.188
  854   3H12  GPI 108          3H12      GPI 108  -3.608   4.320   1.967
  855   1H13  GPI 108          1H13      GPI 108  -6.021   4.443   2.630
  856   2H13  GPI 108          2H13      GPI 108  -6.741   6.063   2.593
  857   3H13  GPI 108          3H13      GPI 108  -6.961   4.958   1.207
  858   1H10  GPI 108          1H10      GPI 108  -5.075   7.729   2.413
  859   2H10  GPI 108          2H10      GPI 108  -4.153   7.789   0.894
  860   1H11  GPI 108          1H11      GPI 108  -7.134   7.866   1.299
  861   2H11  GPI 108          2H11      GPI 108  -6.133   8.885   0.303
  862   3H11  GPI 108          3H11      GPI 108  -6.492   7.247  -0.204
  Start of MODEL   10
    1   1H    GLY   1          1H        GLY   1 -10.184  -5.720 -15.429
    2   2H    GLY   1          2H        GLY   1  -9.174  -4.436 -15.867
    3   3H    GLY   1          3H        GLY   1  -9.873  -4.486 -14.313
    4   1HA   GLY   1          1HA       GLY   1  -8.596  -6.397 -13.737
    5   2HA   GLY   1          2HA       GLY   1  -7.914  -6.426 -15.370
    6    H    VAL   2           H        VAL   2  -5.835  -6.109 -14.257
    7    HA   VAL   2           HA       VAL   2  -5.182  -3.271 -13.801
    8    HB   VAL   2           HB       VAL   2  -5.014  -4.369 -11.645
    9   1HG1  VAL   2          1HG1      VAL   2  -5.039  -6.651 -11.976
   10   2HG1  VAL   2          2HG1      VAL   2  -3.356  -6.388 -11.518
   11   3HG1  VAL   2          3HG1      VAL   2  -3.786  -6.592 -13.216
   12   1HG2  VAL   2          1HG2      VAL   2  -2.738  -3.984 -11.113
   13   2HG2  VAL   2          2HG2      VAL   2  -2.995  -2.998 -12.553
   14   3HG2  VAL   2          3HG2      VAL   2  -2.185  -4.560 -12.685
   15    H    GLN   3           H        GLN   3  -3.402  -2.742 -15.041
   16    HA   GLN   3           HA       GLN   3  -2.316  -4.697 -16.956
   17   1HB   GLN   3          2HB       GLN   3  -3.650  -3.062 -17.957
   18   2HB   GLN   3          1HB       GLN   3  -2.910  -1.782 -16.984
   19   1HG   GLN   3          2HG       GLN   3  -0.839  -2.075 -18.217
   20   2HG   GLN   3          1HG       GLN   3  -1.635  -3.298 -19.223
   21   1HE2  GLN   3          1HE2      GLN   3  -0.894  -0.070 -19.216
   22   2HE2  GLN   3          2HE2      GLN   3  -2.173   0.477 -20.243
   23    H    VAL   4           H        VAL   4   0.028  -4.828 -16.596
   24    HA   VAL   4           HA       VAL   4   1.233  -3.083 -14.552
   25    HB   VAL   4           HB       VAL   4   1.946  -5.946 -15.431
   26   1HG1  VAL   4          1HG1      VAL   4   3.454  -5.606 -13.275
   27   2HG1  VAL   4          2HG1      VAL   4   3.339  -3.908 -13.738
   28   3HG1  VAL   4          3HG1      VAL   4   4.019  -5.085 -14.863
   29   1HG2  VAL   4          1HG2      VAL   4   0.679  -6.753 -13.785
   30   2HG2  VAL   4          2HG2      VAL   4   0.048  -5.129 -13.515
   31   3HG2  VAL   4          3HG2      VAL   4   1.451  -5.692 -12.607
   32    H    GLU   5           H        GLU   5   2.589  -1.533 -15.721
   33    HA   GLU   5           HA       GLU   5   3.858  -2.503 -18.203
   34   1HB   GLU   5          2HB       GLU   5   3.406   0.409 -17.570
   35   2HB   GLU   5          1HB       GLU   5   3.765  -0.337 -19.133
   36   1HG   GLU   5          2HG       GLU   5   1.576  -0.579 -19.581
   37   2HG   GLU   5          1HG       GLU   5   1.316  -1.439 -18.055
   38    H    THR   6           H        THR   6   6.173  -2.559 -17.862
   39    HA   THR   6           HA       THR   6   7.249  -1.667 -15.326
   40    HB   THR   6           HB       THR   6   8.546  -2.886 -17.813
   41    HG1  THR   6           HG1      THR   6   7.714  -4.258 -15.467
   42   1HG2  THR   6          1HG2      THR   6  10.110  -3.769 -15.964
   43   2HG2  THR   6          2HG2      THR   6   9.625  -2.269 -15.171
   44   3HG2  THR   6          3HG2      THR   6  10.362  -2.222 -16.773
   45    H    ILE   7           H        ILE   7   8.484  -0.099 -14.755
   46    HA   ILE   7           HA       ILE   7   9.324   1.985 -16.649
   47    HB   ILE   7           HB       ILE   7   9.174   1.955 -13.592
   48   1HG1  ILE   7          2HG1      ILE   7   7.572   3.425 -15.705
   49   2HG1  ILE   7          1HG1      ILE   7   7.037   1.948 -14.884
   50   1HG2  ILE   7          1HG2      ILE   7  10.902   3.494 -13.979
   51   2HG2  ILE   7          2HG2      ILE   7   9.451   4.491 -13.871
   52   3HG2  ILE   7          3HG2      ILE   7  10.148   4.116 -15.447
   53   1HD1  ILE   7          1HD1      ILE   7   6.104   4.220 -14.095
   54   2HD1  ILE   7          2HD1      ILE   7   7.674   4.426 -13.317
   55   3HD1  ILE   7          3HD1      ILE   7   6.644   3.063 -12.878
   56    H    SER   8           H        SER   8  10.603  -0.023 -13.868
   57    HA   SER   8           HA       SER   8  13.150  -0.215 -15.311
   58   1HB   SER   8          2HB       SER   8  12.963   0.239 -12.319
   59   2HB   SER   8          1HB       SER   8  14.443   0.043 -13.267
   60    HG   SER   8           HG       SER   8  13.494   1.892 -14.557
   61    HA   PRO   9           HA       PRO   9  12.195  -4.488 -14.335
   62   1HB   PRO   9          2HB       PRO   9  15.067  -4.994 -14.687
   63   2HB   PRO   9          1HB       PRO   9  13.701  -5.632 -15.585
   64   1HG   PRO   9          2HG       PRO   9  15.266  -3.813 -16.725
   65   2HG   PRO   9          1HG       PRO   9  13.526  -3.706 -16.934
   66   1HD   PRO   9          1HD       PRO   9  15.270  -2.168 -14.991
   67   2HD   PRO   9          2HD       PRO   9  14.047  -1.540 -16.074
   68    H    GLY  10           H        GLY  10  12.403  -6.055 -12.856
   69   1HA   GLY  10          2HA       GLY  10  13.702  -5.350 -10.325
   70   2HA   GLY  10          1HA       GLY  10  12.398  -6.526 -10.541
   71    H    ASP  11           H        ASP  11  13.970  -8.174  -9.355
   72    HA   ASP  11           HA       ASP  11  16.402  -8.726 -10.874
   73   1HB   ASP  11          2HB       ASP  11  16.913 -10.365  -9.171
   74   2HB   ASP  11          1HB       ASP  11  16.351  -8.884  -8.382
   75    H    GLY  12           H        GLY  12  13.237  -9.675 -11.217
   76   1HA   GLY  12          2HA       GLY  12  12.273 -11.204 -12.649
   77   2HA   GLY  12          1HA       GLY  12  13.900 -11.646 -13.186
   78    H    ARG  13           H        ARG  13  13.568 -12.072  -9.752
   79    HA   ARG  13           HA       ARG  13  12.730 -14.856 -10.203
   80   1HB   ARG  13          2HB       ARG  13  15.050 -14.303  -8.384
   81   2HB   ARG  13          1HB       ARG  13  14.617 -15.800  -9.217
   82   1HG   ARG  13          2HG       ARG  13  15.507 -14.963 -11.270
   83   2HG   ARG  13          1HG       ARG  13  15.849 -13.397 -10.515
   84   1HD   ARG  13          2HD       ARG  13  17.938 -14.355 -10.544
   85   2HD   ARG  13          1HD       ARG  13  17.369 -14.839  -8.939
   86    HE   ARG  13           HE       ARG  13  16.907 -17.033  -9.825
   87   1HH1  ARG  13          1HH1      ARG  13  18.197 -15.233 -12.844
   88   2HH1  ARG  13          2HH1      ARG  13  19.703 -15.785 -12.189
   89   1HH2  ARG  13          1HH2      ARG  13  17.673 -18.713 -11.201
   90   2HH2  ARG  13          2HH2      ARG  13  18.635 -18.328 -12.589
   91    H    THR  14           H        THR  14  12.902 -12.176  -7.903
   92    HA   THR  14           HA       THR  14  11.726 -13.893  -5.805
   93    HB   THR  14           HB       THR  14  12.787 -11.052  -5.377
   94    HG1  THR  14           HG1      THR  14  14.552 -12.027  -6.113
   95   1HG2  THR  14          1HG2      THR  14  12.295 -13.321  -3.518
   96   2HG2  THR  14          2HG2      THR  14  11.882 -11.614  -3.352
   97   3HG2  THR  14          3HG2      THR  14  13.559 -12.136  -3.192
   98    H    PHE  15           H        PHE  15   9.637 -13.947  -6.443
   99    HA   PHE  15           HA       PHE  15   8.162 -11.405  -6.743
  100   1HB   PHE  15          2HB       PHE  15   7.406 -14.235  -7.451
  101   2HB   PHE  15          1HB       PHE  15   6.391 -12.807  -7.709
  102    HD1  PHE  15           HD1      PHE  15   6.945 -11.193  -9.434
  103    HD2  PHE  15           HD2      PHE  15   9.293 -14.723  -8.926
  104    HE1  PHE  15           HE1      PHE  15   7.956 -10.858 -11.648
  105    HE2  PHE  15           HE2      PHE  15  10.269 -14.359 -11.157
  106    HZ   PHE  15           HZ       PHE  15   9.599 -12.444 -12.505
  107    HA   PRO  16           HA       PRO  16   6.582 -11.998  -2.682
  108   1HB   PRO  16          2HB       PRO  16   4.249 -10.530  -2.862
  109   2HB   PRO  16          1HB       PRO  16   5.841  -9.829  -2.630
  110   1HG   PRO  16          2HG       PRO  16   4.257 -10.092  -5.200
  111   2HG   PRO  16          1HG       PRO  16   5.229  -8.736  -4.653
  112   1HD   PRO  16          1HD       PRO  16   6.217 -10.465  -6.438
  113   2HD   PRO  16          2HD       PRO  16   7.246  -9.796  -5.188
  114    H    LYS  17           H        LYS  17   5.299 -13.161  -1.504
  115    HA   LYS  17           HA       LYS  17   3.409 -14.927  -2.909
  116   1HB   LYS  17          2HB       LYS  17   5.300 -15.564  -0.607
  117   2HB   LYS  17          1HB       LYS  17   4.167 -16.702  -1.348
  118   1HG   LYS  17          2HG       LYS  17   6.217 -15.321  -3.052
  119   2HG   LYS  17          1HG       LYS  17   6.666 -16.743  -2.095
  120   1HD   LYS  17          2HD       LYS  17   5.454 -18.131  -3.361
  121   2HD   LYS  17          1HD       LYS  17   4.100 -16.994  -3.457
  122   1HE   LYS  17          2HE       LYS  17   6.459 -16.407  -5.140
  123   2HE   LYS  17          1HE       LYS  17   5.470 -17.803  -5.593
  124   1HZ   LYS  17          1HZ       LYS  17   4.771 -15.768  -6.651
  125   2HZ   LYS  17          2HZ       LYS  17   4.466 -15.075  -5.137
  126   3HZ   LYS  17          3HZ       LYS  17   3.564 -16.424  -5.664
  127    H    ARG  18           H        ARG  18   1.602 -15.579  -1.555
  128    HA   ARG  18           HA       ARG  18   0.412 -13.733   0.103
  129   1HB   ARG  18          2HB       ARG  18  -0.557 -15.877  -0.970
  130   2HB   ARG  18          1HB       ARG  18   0.019 -16.687   0.495
  131   1HG   ARG  18          2HG       ARG  18  -1.227 -14.883   1.778
  132   2HG   ARG  18          1HG       ARG  18  -2.006 -14.487   0.237
  133   1HD   ARG  18          2HD       ARG  18  -3.315 -15.945   1.819
  134   2HD   ARG  18          1HD       ARG  18  -3.128 -16.548   0.164
  135    HE   ARG  18           HE       ARG  18  -1.064 -17.633   1.569
  136   1HH1  ARG  18          2HH1      ARG  18  -4.657 -18.505   1.492
  137   2HH1  ARG  18          1HH1      ARG  18  -4.458 -18.842   3.178
  138   1HH2  ARG  18          2HH2      ARG  18  -1.542 -19.659   3.427
  139   2HH2  ARG  18          1HH2      ARG  18  -1.805 -20.426   1.896
  140    H    GLY  19           H        GLY  19   0.549 -13.148   2.148
  141   1HA   GLY  19          2HA       GLY  19   0.935 -13.447   4.429
  142   2HA   GLY  19          1HA       GLY  19   1.904 -14.878   4.045
  143    H    GLN  20           H        GLN  20   3.267 -12.976   1.914
  144    HA   GLN  20           HA       GLN  20   5.253 -11.990   3.784
  145   1HB   GLN  20          2HB       GLN  20   5.102 -11.879   0.771
  146   2HB   GLN  20          1HB       GLN  20   6.431 -11.203   1.722
  147   1HG   GLN  20          2HG       GLN  20   6.842 -13.491   2.669
  148   2HG   GLN  20          1HG       GLN  20   5.605 -14.124   1.569
  149   1HE2  GLN  20          1HE2      GLN  20   8.884 -13.777   1.915
  150   2HE2  GLN  20          2HE2      GLN  20   9.356 -13.642   0.258
  151    H    THR  21           H        THR  21   5.898  -9.934   4.063
  152    HA   THR  21           HA       THR  21   3.948  -7.849   3.444
  153    HB   THR  21           HB       THR  21   6.487  -7.829   5.134
  154    HG1  THR  21           HG1      THR  21   5.081  -8.527   6.605
  155   1HG2  THR  21          1HG2      THR  21   4.528  -5.600   4.683
  156   2HG2  THR  21          2HG2      THR  21   6.269  -5.594   4.395
  157   3HG2  THR  21          3HG2      THR  21   5.646  -5.683   6.044
  158    H    CYS  22           H        CYS  22   4.052  -6.679   1.688
  159    HA   CYS  22           HA       CYS  22   6.559  -6.385   0.226
  160   1HB   CYS  22          2HB       CYS  22   3.812  -5.363  -0.487
  161   2HB   CYS  22          1HB       CYS  22   5.234  -5.434  -1.545
  162    HG   CYS  22           HG       CYS  22   4.729  -7.766  -2.075
  163    H    VAL  23           H        VAL  23   7.678  -4.551   0.161
  164    HA   VAL  23           HA       VAL  23   6.772  -2.298   1.836
  165    HB   VAL  23           HB       VAL  23   9.632  -3.181   1.169
  166   1HG1  VAL  23          1HG1      VAL  23   8.492  -0.920   2.757
  167   2HG1  VAL  23          2HG1      VAL  23   9.899  -0.948   1.693
  168   3HG1  VAL  23          3HG1      VAL  23   9.997  -1.663   3.302
  169   1HG2  VAL  23          1HG2      VAL  23   7.796  -3.856   3.414
  170   2HG2  VAL  23          2HG2      VAL  23   9.509  -3.642   3.772
  171   3HG2  VAL  23          3HG2      VAL  23   9.000  -4.855   2.600
  172    H    VAL  24           H        VAL  24   6.137  -0.648   0.302
  173    HA   VAL  24           HA       VAL  24   7.581  -0.657  -2.263
  174    HB   VAL  24           HB       VAL  24   5.483  -0.200  -3.508
  175   1HG1  VAL  24          1HG1      VAL  24   5.017  -2.630  -1.779
  176   2HG1  VAL  24          2HG1      VAL  24   6.177  -2.583  -3.106
  177   3HG1  VAL  24          3HG1      VAL  24   4.458  -2.363  -3.430
  178   1HG2  VAL  24          1HG2      VAL  24   3.268  -0.454  -2.326
  179   2HG2  VAL  24          2HG2      VAL  24   4.185   0.958  -1.798
  180   3HG2  VAL  24          3HG2      VAL  24   4.141  -0.491  -0.794
  181    H    HIS  25           H        HIS  25   7.790   1.374  -3.359
  182    HA   HIS  25           HA       HIS  25   6.700   3.596  -1.768
  183   1HB   HIS  25          2HB       HIS  25   9.117   3.369  -3.379
  184   2HB   HIS  25          1HB       HIS  25   8.117   4.723  -3.931
  185    HD1  HIS  25           HD1      HIS  25   7.081   5.443  -0.904
  186    HD2  HIS  25           HD2      HIS  25  10.969   4.836  -2.108
  187    HE1  HIS  25           HE1      HIS  25   8.511   6.540   0.827
  188    HE2  HIS  25           HE2      HIS  25  10.844   6.126   0.050
  189    H    TYR  26           H        TYR  26   5.065   5.000  -2.882
  190    HA   TYR  26           HA       TYR  26   4.444   4.247  -5.633
  191   1HB   TYR  26          2HB       TYR  26   2.139   3.707  -5.200
  192   2HB   TYR  26          1HB       TYR  26   3.106   2.742  -4.070
  193    HD1  TYR  26           HD1      TYR  26   0.748   5.509  -4.441
  194    HD2  TYR  26           HD2      TYR  26   2.894   3.060  -1.679
  195    HE1  TYR  26           HE1      TYR  26  -0.613   6.407  -2.592
  196    HE2  TYR  26           HE2      TYR  26   1.550   3.981   0.195
  197    HH   TYR  26           HH       TYR  26  -0.127   6.683   0.102
  198    H    THR  27           H        THR  27   3.221   5.733  -6.796
  199    HA   THR  27           HA       THR  27   2.335   8.163  -5.406
  200    HB   THR  27           HB       THR  27   3.482   8.077  -8.195
  201    HG1  THR  27           HG1      THR  27   4.356   8.924  -5.649
  202   1HG2  THR  27          1HG2      THR  27   2.070   9.782  -8.527
  203   2HG2  THR  27          2HG2      THR  27   3.189  10.688  -7.507
  204   3HG2  THR  27          3HG2      THR  27   1.738   9.972  -6.805
  205    H    GLY  28           H        GLY  28   0.073   8.084  -5.749
  206   1HA   GLY  28          2HA       GLY  28  -1.088   6.460  -7.921
  207   2HA   GLY  28          1HA       GLY  28  -1.922   6.972  -6.446
  208    H    MET  29           H        MET  29  -2.116   7.366  -9.513
  209    HA   MET  29           HA       MET  29  -2.905  10.190  -9.488
  210   1HB   MET  29          2HB       MET  29  -1.480   8.727 -11.720
  211   2HB   MET  29          1HB       MET  29  -2.185  10.342 -11.857
  212   1HG   MET  29          2HG       MET  29  -0.600  11.288 -10.509
  213   2HG   MET  29          1HG       MET  29  -0.179   9.743  -9.751
  214   1HE   MET  29          1HE       MET  29   0.794   8.009 -10.620
  215   2HE   MET  29          2HE       MET  29   2.359   8.218 -11.403
  216   3HE   MET  29          3HE       MET  29   0.961   7.704 -12.348
  217    H    LEU  30           H        LEU  30  -4.550  10.704 -10.719
  218    HA   LEU  30           HA       LEU  30  -6.562   8.805 -11.485
  219   1HB   LEU  30          2HB       LEU  30  -6.137  11.614 -10.972
  220   2HB   LEU  30          1HB       LEU  30  -7.161  11.340 -12.384
  221    HG   LEU  30           HG       LEU  30  -8.958  10.998 -11.160
  222   1HD1  LEU  30          1HD1      LEU  30  -8.540   8.873 -10.285
  223   2HD1  LEU  30          2HD1      LEU  30  -8.873   9.873  -8.870
  224   3HD1  LEU  30          3HD1      LEU  30  -7.211   9.451  -9.279
  225   1HD2  LEU  30          1HD2      LEU  30  -8.617  12.083  -8.842
  226   2HD2  LEU  30          2HD2      LEU  30  -8.463  13.011 -10.335
  227   3HD2  LEU  30          3HD2      LEU  30  -7.018  12.446  -9.495
  228    H    GLU  31           H        GLU  31  -7.370   8.959 -13.977
  229    HA   GLU  31           HA       GLU  31  -5.215   8.503 -15.715
  230   1HB   GLU  31          2HB       GLU  31  -8.121   9.086 -16.065
  231   2HB   GLU  31          1HB       GLU  31  -7.057   8.987 -17.474
  232   1HG   GLU  31          2HG       GLU  31  -6.310   6.759 -16.613
  233   2HG   GLU  31          1HG       GLU  31  -7.627   6.865 -15.435
  234    H    ASP  32           H        ASP  32  -6.496  11.596 -14.899
  235    HA   ASP  32           HA       ASP  32  -5.306  12.763 -17.295
  236   1HB   ASP  32          2HB       ASP  32  -6.184  14.858 -16.414
  237   2HB   ASP  32          1HB       ASP  32  -7.439  13.611 -16.364
  238    H    GLY  33           H        GLY  33  -3.818  11.613 -14.623
  239   1HA   GLY  33          2HA       GLY  33  -1.526  11.886 -14.228
  240   2HA   GLY  33          1HA       GLY  33  -1.619  13.506 -14.936
  241    H    LYS  34           H        LYS  34  -4.145  13.639 -12.941
  242    HA   LYS  34           HA       LYS  34  -2.768  15.197 -11.018
  243   1HB   LYS  34          2HB       LYS  34  -5.260  15.189 -11.901
  244   2HB   LYS  34          1HB       LYS  34  -5.505  14.052 -10.568
  245   1HG   LYS  34          2HG       LYS  34  -3.976  16.471  -9.967
  246   2HG   LYS  34          1HG       LYS  34  -5.698  16.691 -10.326
  247   1HD   LYS  34          2HD       LYS  34  -4.721  14.717  -8.286
  248   2HD   LYS  34          1HD       LYS  34  -5.073  16.407  -7.890
  249   1HE   LYS  34          2HE       LYS  34  -7.007  14.532  -9.255
  250   2HE   LYS  34          1HE       LYS  34  -7.005  14.870  -7.518
  251   1HZ   LYS  34          1HZ       LYS  34  -8.074  16.372  -9.644
  252   2HZ   LYS  34          2HZ       LYS  34  -6.990  17.299  -8.736
  253   3HZ   LYS  34          3HZ       LYS  34  -8.312  16.536  -7.978
  254    H    LYS  35           H        LYS  35  -1.723  14.606  -9.323
  255    HA   LYS  35           HA       LYS  35  -1.545  11.908  -8.413
  256   1HB   LYS  35          2HB       LYS  35   0.315  13.565  -8.491
  257   2HB   LYS  35          1HB       LYS  35  -0.489  14.442  -7.183
  258   1HG   LYS  35          2HG       LYS  35  -0.095  12.541  -5.702
  259   2HG   LYS  35          1HG       LYS  35   0.772  11.725  -7.013
  260   1HD   LYS  35          2HD       LYS  35   2.379  12.751  -5.539
  261   2HD   LYS  35          1HD       LYS  35   2.365  13.635  -7.075
  262   1HE   LYS  35          2HE       LYS  35   0.923  15.362  -6.034
  263   2HE   LYS  35          1HE       LYS  35   1.033  14.495  -4.494
  264   1HZ   LYS  35          1HZ       LYS  35   3.281  14.954  -4.340
  265   2HZ   LYS  35          2HZ       LYS  35   2.541  16.413  -4.770
  266   3HZ   LYS  35          3HZ       LYS  35   3.382  15.499  -5.937
  267    H    PHE  36           H        PHE  36  -2.816  11.064  -6.760
  268    HA   PHE  36           HA       PHE  36  -4.245  13.051  -5.101
  269   1HB   PHE  36          2HB       PHE  36  -5.736  11.140  -4.494
  270   2HB   PHE  36          1HB       PHE  36  -5.797  11.609  -6.200
  271    HD1  PHE  36           HD1      PHE  36  -4.652   8.995  -3.835
  272    HD2  PHE  36           HD2      PHE  36  -5.388  10.099  -7.920
  273    HE1  PHE  36           HE1      PHE  36  -4.541   6.622  -4.509
  274    HE2  PHE  36           HE2      PHE  36  -5.279   7.711  -8.564
  275    HZ   PHE  36           HZ       PHE  36  -4.858   5.985  -6.865
  276    H    ASP  37           H        ASP  37  -1.761  10.658  -4.990
  277    HA   ASP  37           HA       ASP  37  -1.054  11.467  -2.360
  278   1HB   ASP  37          2HB       ASP  37  -2.943   9.814  -1.834
  279   2HB   ASP  37          1HB       ASP  37  -1.866   8.556  -2.454
  280    H    SER  38           H        SER  38   0.978  10.468  -1.659
  281    HA   SER  38           HA       SER  38   2.321   8.515  -3.298
  282   1HB   SER  38          2HB       SER  38   2.764  10.582  -4.605
  283   2HB   SER  38          1HB       SER  38   3.449  11.334  -3.158
  284    HG   SER  38           HG       SER  38   5.034  10.353  -4.566
  285    H    SER  39           H        SER  39   3.581   7.305  -1.912
  286    HA   SER  39           HA       SER  39   4.091   8.272   0.752
  287   1HB   SER  39          2HB       SER  39   5.451   6.188   0.992
  288   2HB   SER  39          1HB       SER  39   3.791   5.894   0.457
  289    HG   SER  39           HG       SER  39   4.881   4.730  -0.965
  290    H    ARG  40           H        ARG  40   5.672   8.414  -2.311
  291    HA   ARG  40           HA       ARG  40   8.347   8.698  -1.495
  292   1HB   ARG  40          2HB       ARG  40   6.896   9.774  -3.938
  293   2HB   ARG  40          1HB       ARG  40   8.646   9.874  -3.706
  294   1HG   ARG  40          2HG       ARG  40   8.669   7.373  -3.552
  295   2HG   ARG  40          1HG       ARG  40   6.968   7.397  -4.047
  296   1HD   ARG  40          2HD       ARG  40   7.654   8.458  -6.183
  297   2HD   ARG  40          1HD       ARG  40   9.345   8.285  -5.688
  298    HE   ARG  40           HE       ARG  40   9.209   5.986  -6.101
  299   1HH1  ARG  40          1HH1      ARG  40   5.580   6.787  -6.202
  300   2HH1  ARG  40          2HH1      ARG  40   5.910   6.968  -7.892
  301   1HH2  ARG  40          1HH2      ARG  40   7.872   3.981  -6.856
  302   2HH2  ARG  40          2HH2      ARG  40   6.914   4.487  -8.209
  303    H    ASP  41           H        ASP  41   5.606  11.042  -1.764
  304    HA   ASP  41           HA       ASP  41   7.158  13.334  -1.090
  305   1HB   ASP  41          2HB       ASP  41   4.187  12.793  -0.678
  306   2HB   ASP  41          1HB       ASP  41   4.960  14.377  -0.522
  307    H    ARG  42           H        ARG  42   5.682  10.787   0.920
  308    HA   ARG  42           HA       ARG  42   6.300  12.310   3.320
  309   1HB   ARG  42          2HB       ARG  42   5.439   9.439   3.144
  310   2HB   ARG  42          1HB       ARG  42   5.372  10.509   4.552
  311   1HG   ARG  42          2HG       ARG  42   3.750  11.916   3.344
  312   2HG   ARG  42          1HG       ARG  42   3.758  10.732   2.026
  313   1HD   ARG  42          2HD       ARG  42   3.174  10.027   4.871
  314   2HD   ARG  42          1HD       ARG  42   1.918  10.547   3.736
  315    HE   ARG  42           HE       ARG  42   3.115   7.958   3.944
  316   1HH1  ARG  42          1HH1      ARG  42   0.345   9.704   2.080
  317   2HH1  ARG  42          2HH1      ARG  42   1.579   9.540   0.875
  318   1HH2  ARG  42          1HH2      ARG  42   1.853   6.329   2.839
  319   2HH2  ARG  42          2HH2      ARG  42   1.143   6.788   1.328
  320    H    ASN  43           H        ASN  43   7.997  10.294   1.243
  321    HA   ASN  43           HA       ASN  43   9.990   9.199   1.290
  322   1HB   ASN  43          2HB       ASN  43  10.556  11.533   2.023
  323   2HB   ASN  43          1HB       ASN  43  10.441  10.968   3.696
  324   1HD2  ASN  43          1HD2      ASN  43  12.042   9.103   0.961
  325   2HD2  ASN  43          2HD2      ASN  43  13.588   9.743   1.390
  326    H    LYS  44           H        LYS  44   7.798   7.928   2.742
  327    HA   LYS  44           HA       LYS  44   9.468   6.181   4.409
  328   1HB   LYS  44          2HB       LYS  44   8.223   7.817   5.851
  329   2HB   LYS  44          1HB       LYS  44   6.710   7.206   5.169
  330   1HG   LYS  44          2HG       LYS  44   7.127   5.014   6.173
  331   2HG   LYS  44          1HG       LYS  44   8.665   5.598   6.830
  332   1HD   LYS  44          2HD       LYS  44   7.583   7.121   8.278
  333   2HD   LYS  44          1HD       LYS  44   6.035   6.934   7.436
  334   1HE   LYS  44          2HE       LYS  44   7.384   4.697   8.961
  335   2HE   LYS  44          1HE       LYS  44   6.179   5.778   9.676
  336   1HZ   LYS  44          1HZ       LYS  44   5.866   3.723   7.645
  337   2HZ   LYS  44          2HZ       LYS  44   4.809   5.045   7.655
  338   3HZ   LYS  44          3HZ       LYS  44   4.933   4.034   9.022
  339    HA   PRO  45           HA       PRO  45   7.453   3.618   1.208
  340   1HB   PRO  45          2HB       PRO  45   8.336   1.316   2.815
  341   2HB   PRO  45          1HB       PRO  45   8.652   1.689   1.129
  342   1HG   PRO  45          2HG       PRO  45  10.598   1.989   2.946
  343   2HG   PRO  45          1HG       PRO  45  10.418   3.160   1.650
  344   1HD   PRO  45          1HD       PRO  45   9.468   3.382   4.524
  345   2HD   PRO  45          2HD       PRO  45  10.320   4.577   3.570
  346    H    PHE  46           H        PHE  46   5.602   2.323   1.036
  347    HA   PHE  46           HA       PHE  46   3.982   2.332   3.476
  348   1HB   PHE  46          2HB       PHE  46   3.005   3.314   1.482
  349   2HB   PHE  46          1HB       PHE  46   3.339   1.839   0.559
  350    HD1  PHE  46           HD1      PHE  46   1.391   3.118   3.441
  351    HD2  PHE  46           HD2      PHE  46   1.764   0.211   0.358
  352    HE1  PHE  46           HE1      PHE  46  -0.840   2.248   3.983
  353    HE2  PHE  46           HE2      PHE  46  -0.462  -0.653   0.917
  354    HZ   PHE  46           HZ       PHE  46  -1.778   0.358   2.731
  355    H    LYS  47           H        LYS  47   3.424   0.256   4.456
  356    HA   LYS  47           HA       LYS  47   4.540  -2.088   3.051
  357   1HB   LYS  47          2HB       LYS  47   3.966  -1.641   5.984
  358   2HB   LYS  47          1HB       LYS  47   4.454  -3.195   5.293
  359   1HG   LYS  47          2HG       LYS  47   6.483  -2.130   4.440
  360   2HG   LYS  47          1HG       LYS  47   6.001  -0.632   5.255
  361   1HD   LYS  47          2HD       LYS  47   6.197  -1.683   7.415
  362   2HD   LYS  47          1HD       LYS  47   6.493  -3.261   6.666
  363   1HE   LYS  47          2HE       LYS  47   8.468  -2.422   5.551
  364   2HE   LYS  47          1HE       LYS  47   8.132  -0.778   6.119
  365   1HZ   LYS  47          1HZ       LYS  47   8.244  -2.000   8.400
  366   2HZ   LYS  47          2HZ       LYS  47   9.622  -1.386   7.635
  367   3HZ   LYS  47          3HZ       LYS  47   9.247  -3.045   7.526
  368    H    PHE  48           H        PHE  48   3.031  -3.772   2.431
  369    HA   PHE  48           HA       PHE  48   0.644  -3.987   4.111
  370   1HB   PHE  48          2HB       PHE  48  -0.872  -4.237   2.306
  371   2HB   PHE  48          1HB       PHE  48   0.050  -2.759   1.981
  372    HD1  PHE  48           HD1      PHE  48   1.793  -2.773   0.222
  373    HD2  PHE  48           HD2      PHE  48  -0.908  -6.024   0.771
  374    HE1  PHE  48           HE1      PHE  48   2.259  -3.558  -2.053
  375    HE2  PHE  48           HE2      PHE  48  -0.438  -6.810  -1.534
  376    HZ   PHE  48           HZ       PHE  48   1.146  -5.556  -2.945
  377    H    MET  49           H        MET  49  -0.031  -6.291   4.275
  378    HA   MET  49           HA       MET  49   1.873  -8.239   3.220
  379   1HB   MET  49          2HB       MET  49   1.321  -8.654   5.476
  380   2HB   MET  49          1HB       MET  49  -0.401  -8.377   5.187
  381   1HG   MET  49          2HG       MET  49  -0.659 -10.502   4.182
  382   2HG   MET  49          1HG       MET  49   1.092 -10.765   4.147
  383   1HE   MET  49          1HE       MET  49   1.596 -10.935   8.133
  384   2HE   MET  49          2HE       MET  49   1.277  -9.410   7.306
  385   3HE   MET  49          3HE       MET  49   2.403 -10.574   6.607
  386    H    LEU  50           H        LEU  50   1.555  -9.321   1.510
  387    HA   LEU  50           HA       LEU  50  -0.592  -9.100  -0.214
  388   1HB   LEU  50          2HB       LEU  50   1.838 -10.578  -0.103
  389   2HB   LEU  50          1HB       LEU  50   0.514 -11.617  -0.634
  390    HG   LEU  50           HG       LEU  50   1.997  -9.555  -2.080
  391   1HD1  LEU  50          1HD1      LEU  50   0.745 -12.296  -2.467
  392   2HD1  LEU  50          2HD1      LEU  50   2.461 -11.927  -2.292
  393   3HD1  LEU  50          3HD1      LEU  50   1.597 -11.431  -3.747
  394   1HD2  LEU  50          1HD2      LEU  50   0.265  -9.495  -3.780
  395   2HD2  LEU  50          2HD2      LEU  50  -0.224  -8.668  -2.301
  396   3HD2  LEU  50          3HD2      LEU  50  -0.850 -10.277  -2.660
  397    H    GLY  51           H        GLY  51  -2.500 -10.135  -0.243
  398   1HA   GLY  51          2HA       GLY  51  -3.966 -11.914  -0.223
  399   2HA   GLY  51          1HA       GLY  51  -2.817 -12.828   0.766
  400    H    LYS  52           H        LYS  52  -3.037  -9.957   2.332
  401    HA   LYS  52           HA       LYS  52  -4.859 -11.123   4.260
  402   1HB   LYS  52          2HB       LYS  52  -2.633  -9.863   4.490
  403   2HB   LYS  52          1HB       LYS  52  -3.670  -8.436   4.366
  404   1HG   LYS  52          2HG       LYS  52  -4.948  -9.342   6.363
  405   2HG   LYS  52          1HG       LYS  52  -3.626 -10.506   6.556
  406   1HD   LYS  52          2HD       LYS  52  -2.031  -8.611   6.084
  407   2HD   LYS  52          1HD       LYS  52  -3.414  -7.508   6.197
  408   1HE   LYS  52          2HE       LYS  52  -3.790  -8.459   8.458
  409   2HE   LYS  52          1HE       LYS  52  -2.179  -9.179   8.302
  410   1HZ   LYS  52          1HZ       LYS  52  -2.521  -6.809   9.255
  411   2HZ   LYS  52          2HZ       LYS  52  -2.534  -6.380   7.619
  412   3HZ   LYS  52          3HZ       LYS  52  -1.187  -7.185   8.286
  413    H    GLN  53           H        GLN  53  -5.463  -9.221   1.593
  414    HA   GLN  53           HA       GLN  53  -7.281  -8.072   0.876
  415   1HB   GLN  53          2HB       GLN  53  -8.463  -9.202   3.401
  416   2HB   GLN  53          1HB       GLN  53  -9.382  -8.293   2.194
  417   1HG   GLN  53          2HG       GLN  53  -9.298  -9.999   0.667
  418   2HG   GLN  53          1HG       GLN  53  -7.927 -10.784   1.471
  419   1HE2  GLN  53          1HE2      GLN  53  -9.753 -12.935   1.700
  420   2HE2  GLN  53          2HE2      GLN  53  -9.076 -12.731   3.276
  421    H    GLU  54           H        GLU  54  -5.348  -6.569   2.308
  422    HA   GLU  54           HA       GLU  54  -7.165  -4.585   3.518
  423   1HB   GLU  54          2HB       GLU  54  -5.240  -3.760   4.724
  424   2HB   GLU  54          1HB       GLU  54  -5.554  -5.464   5.078
  425   1HG   GLU  54          2HG       GLU  54  -3.731  -6.107   3.600
  426   2HG   GLU  54          1HG       GLU  54  -3.416  -4.399   3.248
  427    H    VAL  55           H        VAL  55  -5.458  -5.033   0.730
  428    HA   VAL  55           HA       VAL  55  -5.543  -2.135   0.239
  429    HB   VAL  55           HB       VAL  55  -3.881  -2.656  -1.664
  430   1HG1  VAL  55          1HG1      VAL  55  -3.277  -2.882   1.284
  431   2HG1  VAL  55          2HG1      VAL  55  -3.215  -1.440   0.269
  432   3HG1  VAL  55          3HG1      VAL  55  -2.005  -2.710   0.072
  433   1HG2  VAL  55          1HG2      VAL  55  -3.254  -5.155  -0.163
  434   2HG2  VAL  55          2HG2      VAL  55  -2.604  -4.583  -1.699
  435   3HG2  VAL  55          3HG2      VAL  55  -4.279  -5.125  -1.596
  436    H    ILE  56           H        ILE  56  -5.906  -1.830  -2.310
  437    HA   ILE  56           HA       ILE  56  -8.393  -3.119  -2.876
  438    HB   ILE  56           HB       ILE  56  -8.230  -1.808  -5.097
  439   1HG1  ILE  56          2HG1      ILE  56  -5.913  -0.390  -3.803
  440   2HG1  ILE  56          1HG1      ILE  56  -5.701  -1.647  -5.033
  441   1HG2  ILE  56          1HG2      ILE  56  -9.529  -0.598  -3.668
  442   2HG2  ILE  56          2HG2      ILE  56  -8.131   0.476  -3.581
  443   3HG2  ILE  56          3HG2      ILE  56  -8.379  -0.755  -2.342
  444   1HD1  ILE  56          1HD1      ILE  56  -6.876  -0.250  -6.672
  445   2HD1  ILE  56          2HD1      ILE  56  -5.491   0.606  -5.992
  446   3HD1  ILE  56          3HD1      ILE  56  -7.123   0.997  -5.448
  447    H    ARG  57           H        ARG  57  -8.929  -4.372  -4.685
  448    HA   ARG  57           HA       ARG  57  -7.301  -6.655  -4.957
  449   1HB   ARG  57          2HB       ARG  57  -9.779  -6.631  -5.312
  450   2HB   ARG  57          1HB       ARG  57  -9.544  -5.687  -6.788
  451   1HG   ARG  57          2HG       ARG  57  -8.333  -7.515  -7.790
  452   2HG   ARG  57          1HG       ARG  57  -8.506  -8.460  -6.302
  453   1HD   ARG  57          2HD       ARG  57 -10.927  -8.588  -6.657
  454   2HD   ARG  57          1HD       ARG  57 -10.766  -7.625  -8.134
  455    HE   ARG  57           HE       ARG  57  -8.910  -9.771  -8.134
  456   1HH1  ARG  57          1HH1      ARG  57 -12.265  -9.326  -9.731
  457   2HH1  ARG  57          2HH1      ARG  57 -12.631 -10.669  -8.699
  458   1HH2  ARG  57          1HH2      ARG  57  -9.483 -11.967  -9.049
  459   2HH2  ARG  57          2HH2      ARG  57 -10.210 -11.505 -10.550
  460    H    GLY  58           H        GLY  58  -7.318  -3.873  -7.249
  461   1HA   GLY  58          2HA       GLY  58  -5.786  -5.258  -9.176
  462   2HA   GLY  58          1HA       GLY  58  -5.913  -3.499  -9.004
  463    H    TRP  59           H        TRP  59  -4.853  -3.702  -6.137
  464    HA   TRP  59           HA       TRP  59  -2.019  -3.685  -6.667
  465   1HB   TRP  59          2HB       TRP  59  -3.792  -3.134  -4.345
  466   2HB   TRP  59          1HB       TRP  59  -2.167  -3.716  -3.948
  467    HD1  TRP  59           HD1      TRP  59  -3.605  -1.156  -6.510
  468    HE1  TRP  59           HE1      TRP  59  -2.118   0.903  -6.378
  469    HE3  TRP  59           HE3      TRP  59  -0.322  -2.655  -2.814
  470    HZ2  TRP  59           HZ2      TRP  59   0.090   1.799  -4.975
  471    HZ3  TRP  59           HZ3      TRP  59   1.464  -1.100  -2.155
  472    HH2  TRP  59           HH2      TRP  59   1.657   1.074  -3.214
  473    H    GLU  60           H        GLU  60  -3.998  -5.885  -4.554
  474    HA   GLU  60           HA       GLU  60  -2.182  -7.808  -3.914
  475   1HB   GLU  60          2HB       GLU  60  -4.937  -8.445  -4.979
  476   2HB   GLU  60          1HB       GLU  60  -3.931  -9.488  -3.962
  477   1HG   GLU  60          2HG       GLU  60  -4.904  -6.876  -2.951
  478   2HG   GLU  60          1HG       GLU  60  -5.969  -8.291  -2.983
  479    H    GLU  61           H        GLU  61  -3.992  -7.515  -6.943
  480    HA   GLU  61           HA       GLU  61  -2.772  -9.826  -8.164
  481   1HB   GLU  61          2HB       GLU  61  -4.418  -7.607  -9.393
  482   2HB   GLU  61          1HB       GLU  61  -4.041  -9.165 -10.139
  483   1HG   GLU  61          2HG       GLU  61  -5.246  -9.498  -7.528
  484   2HG   GLU  61          1HG       GLU  61  -6.275  -8.538  -8.606
  485    H    GLY  62           H        GLY  62  -2.125  -6.342  -8.334
  486   1HA   GLY  62          2HA       GLY  62  -0.507  -6.786 -10.674
  487   2HA   GLY  62          1HA       GLY  62  -0.757  -5.248  -9.833
  488    H    VAL  63           H        VAL  63   0.134  -5.861  -7.305
  489    HA   VAL  63           HA       VAL  63   2.942  -5.683  -7.764
  490    HB   VAL  63           HB       VAL  63   1.302  -5.995  -5.198
  491   1HG1  VAL  63          1HG1      VAL  63   3.647  -6.696  -4.933
  492   2HG1  VAL  63          2HG1      VAL  63   3.350  -5.180  -4.083
  493   3HG1  VAL  63          3HG1      VAL  63   4.187  -5.171  -5.634
  494   1HG2  VAL  63          1HG2      VAL  63   0.933  -3.779  -6.426
  495   2HG2  VAL  63          2HG2      VAL  63   2.678  -3.533  -6.449
  496   3HG2  VAL  63          3HG2      VAL  63   1.807  -3.530  -4.916
  497    H    ALA  64           H        ALA  64   0.822  -8.472  -7.070
  498    HA   ALA  64           HA       ALA  64   2.871 -10.243  -6.296
  499   1HB   ALA  64          1HB       ALA  64   0.456 -10.984  -7.916
  500   2HB   ALA  64          2HB       ALA  64   0.406 -10.689  -6.178
  501   3HB   ALA  64          3HB       ALA  64   1.385 -12.007  -6.820
  502    H    GLN  65           H        GLN  65   2.108  -8.871  -9.375
  503    HA   GLN  65           HA       GLN  65   3.585 -10.841 -10.889
  504   1HB   GLN  65          2HB       GLN  65   2.247  -8.223 -11.563
  505   2HB   GLN  65          1HB       GLN  65   3.242  -9.099 -12.733
  506   1HG   GLN  65          2HG       GLN  65   1.822 -11.070 -12.542
  507   2HG   GLN  65          1HG       GLN  65   0.885 -10.309 -11.243
  508   1HE2  GLN  65          1HE2      GLN  65  -1.178  -9.486 -12.159
  509   2HE2  GLN  65          2HE2      GLN  65  -0.902  -8.129 -13.191
  510    H    MET  66           H        MET  66   4.752  -8.571  -8.816
  511    HA   MET  66           HA       MET  66   6.777  -7.620 -10.720
  512   1HB   MET  66          2HB       MET  66   5.986  -6.535  -8.024
  513   2HB   MET  66          1HB       MET  66   7.237  -5.864  -9.079
  514   1HG   MET  66          2HG       MET  66   5.597  -5.381 -10.782
  515   2HG   MET  66          1HG       MET  66   4.328  -6.153  -9.816
  516   1HE   MET  66          1HE       MET  66   7.230  -3.850  -8.685
  517   2HE   MET  66          2HE       MET  66   6.481  -2.254  -8.657
  518   3HE   MET  66          3HE       MET  66   6.730  -3.084 -10.192
  519    H    SER  67           H        SER  67   8.935  -7.975 -10.280
  520    HA   SER  67           HA       SER  67   9.648  -9.757  -8.078
  521   1HB   SER  67          2HB       SER  67  11.858  -9.704  -9.291
  522   2HB   SER  67          1HB       SER  67  10.496 -10.434 -10.151
  523    HG   SER  67           HG       SER  67  10.484  -8.799 -11.555
  524    H    VAL  68           H        VAL  68  11.482  -9.147  -6.637
  525    HA   VAL  68           HA       VAL  68  11.309  -6.546  -5.629
  526    HB   VAL  68           HB       VAL  68  13.513  -8.620  -5.346
  527   1HG1  VAL  68          1HG1      VAL  68  14.187  -7.416  -3.308
  528   2HG1  VAL  68          2HG1      VAL  68  12.990  -6.166  -3.645
  529   3HG1  VAL  68          3HG1      VAL  68  14.360  -6.391  -4.732
  530   1HG2  VAL  68          1HG2      VAL  68  11.725  -9.651  -4.480
  531   2HG2  VAL  68          2HG2      VAL  68  10.883  -8.142  -4.130
  532   3HG2  VAL  68          3HG2      VAL  68  12.173  -8.698  -3.065
  533    H    GLY  69           H        GLY  69  12.137  -4.762  -6.123
  534   1HA   GLY  69          2HA       GLY  69  13.883  -3.301  -6.746
  535   2HA   GLY  69          1HA       GLY  69  14.458  -4.530  -7.884
  536    H    GLN  70           H        GLN  70  11.270  -4.686  -8.434
  537    HA   GLN  70           HA       GLN  70  11.690  -3.130 -10.841
  538   1HB   GLN  70          2HB       GLN  70  10.814  -5.488 -10.677
  539   2HB   GLN  70          1HB       GLN  70   9.325  -4.777 -10.035
  540   1HG   GLN  70          2HG       GLN  70   9.149  -3.445 -12.106
  541   2HG   GLN  70          1HG       GLN  70  10.538  -4.345 -12.742
  542   1HE2  GLN  70          2HE2      GLN  70   9.493  -7.238 -12.034
  543   2HE2  GLN  70          1HE2      GLN  70   7.917  -6.874 -11.427
  544    H    ARG  71           H        ARG  71  10.582  -1.587 -11.625
  545    HA   ARG  71           HA       ARG  71   8.697  -0.179  -9.844
  546   1HB   ARG  71          2HB       ARG  71  10.803   1.073 -10.000
  547   2HB   ARG  71          1HB       ARG  71  10.687   1.055 -11.765
  548   1HG   ARG  71          2HG       ARG  71   8.899   2.569 -11.794
  549   2HG   ARG  71          1HG       ARG  71   8.396   2.160 -10.146
  550   1HD   ARG  71          2HD       ARG  71  10.283   3.310  -9.214
  551   2HD   ARG  71          1HD       ARG  71  10.989   3.554 -10.820
  552    HE   ARG  71           HE       ARG  71   8.426   4.696 -10.780
  553   1HH1  ARG  71          2HH1      ARG  71  11.612   5.179  -9.290
  554   2HH1  ARG  71          1HH1      ARG  71  11.463   6.904  -9.285
  555   1HH2  ARG  71          1HH2      ARG  71   8.120   6.876 -10.465
  556   2HH2  ARG  71          2HH2      ARG  71   9.446   7.883  -9.987
  557    H    ALA  72           H        ALA  72   6.801  -0.068 -10.813
  558    HA   ALA  72           HA       ALA  72   6.470  -0.150 -13.715
  559   1HB   ALA  72          1HB       ALA  72   5.011  -2.005 -13.696
  560   2HB   ALA  72          2HB       ALA  72   4.894  -1.997 -11.937
  561   3HB   ALA  72          3HB       ALA  72   6.392  -2.504 -12.718
  562    H    LYS  73           H        LYS  73   4.461   0.425 -14.507
  563    HA   LYS  73           HA       LYS  73   2.807   2.083 -12.736
  564   1HB   LYS  73          2HB       LYS  73   3.831   3.035 -14.744
  565   2HB   LYS  73          1HB       LYS  73   2.998   1.822 -15.723
  566   1HG   LYS  73          2HG       LYS  73   0.828   2.876 -14.911
  567   2HG   LYS  73          1HG       LYS  73   1.830   4.217 -14.335
  568   1HD   LYS  73          2HD       LYS  73   2.965   4.301 -16.495
  569   2HD   LYS  73          1HD       LYS  73   1.971   2.953 -17.073
  570   1HE   LYS  73          2HE       LYS  73  -0.017   4.448 -16.677
  571   2HE   LYS  73          1HE       LYS  73   1.147   5.770 -16.499
  572   1HZ   LYS  73          1HZ       LYS  73   0.808   4.007 -18.847
  573   2HZ   LYS  73          2HZ       LYS  73   2.039   5.156 -18.683
  574   3HZ   LYS  73          3HZ       LYS  73   0.408   5.648 -18.751
  575    H    LEU  74           H        LEU  74   0.909   1.250 -12.075
  576    HA   LEU  74           HA       LEU  74  -0.136  -1.172 -13.368
  577   1HB   LEU  74          2HB       LEU  74   0.213  -0.093 -10.656
  578   2HB   LEU  74          1HB       LEU  74  -1.340  -0.881 -10.938
  579    HG   LEU  74           HG       LEU  74  -0.400  -3.001 -11.005
  580   1HD1  LEU  74          1HD1      LEU  74   1.990  -3.482 -11.265
  581   2HD1  LEU  74          2HD1      LEU  74   2.322  -1.758 -11.424
  582   3HD1  LEU  74          3HD1      LEU  74   1.364  -2.587 -12.650
  583   1HD2  LEU  74          1HD2      LEU  74  -0.467  -1.888  -8.849
  584   2HD2  LEU  74          2HD2      LEU  74   1.230  -1.448  -9.036
  585   3HD2  LEU  74          3HD2      LEU  74   0.765  -3.145  -8.938
  586    H    THR  75           H        THR  75  -1.870  -0.574 -14.790
  587    HA   THR  75           HA       THR  75  -3.497   1.772 -14.022
  588    HB   THR  75           HB       THR  75  -3.435   0.122 -16.596
  589    HG1  THR  75           HG1      THR  75  -1.653   1.266 -16.761
  590   1HG2  THR  75          1HG2      THR  75  -4.608   1.967 -17.628
  591   2HG2  THR  75          2HG2      THR  75  -4.845   2.694 -16.038
  592   3HG2  THR  75          3HG2      THR  75  -5.575   1.134 -16.413
  593    H    ILE  76           H        ILE  76  -5.455   1.333 -12.988
  594    HA   ILE  76           HA       ILE  76  -6.290  -1.484 -12.781
  595    HB   ILE  76           HB       ILE  76  -6.389   0.674 -10.636
  596   1HG1  ILE  76          2HG1      ILE  76  -4.508  -1.672 -10.945
  597   2HG1  ILE  76          1HG1      ILE  76  -4.084   0.026 -11.222
  598   1HG2  ILE  76          1HG2      ILE  76  -7.210  -2.170 -10.634
  599   2HG2  ILE  76          2HG2      ILE  76  -8.130  -0.726 -10.214
  600   3HG2  ILE  76          3HG2      ILE  76  -6.833  -1.283  -9.157
  601   1HD1  ILE  76          1HD1      ILE  76  -4.414  -1.467  -8.691
  602   2HD1  ILE  76          2HD1      ILE  76  -4.927   0.220  -8.708
  603   3HD1  ILE  76          3HD1      ILE  76  -3.267  -0.199  -9.126
  604    H    SER  77           H        SER  77  -8.341  -1.762 -13.535
  605    HA   SER  77           HA       SER  77 -10.074   0.347 -14.262
  606   1HB   SER  77          2HB       SER  77 -11.733  -1.397 -14.644
  607   2HB   SER  77          1HB       SER  77 -10.163  -1.886 -15.294
  608    HG   SER  77           HG       SER  77 -11.683  -3.015 -13.262
  609    HA   PRO  78           HA       PRO  78 -12.060   1.321 -10.425
  610   1HB   PRO  78          2HB       PRO  78 -14.776   1.357 -11.226
  611   2HB   PRO  78          1HB       PRO  78 -13.689   2.734 -11.185
  612   1HG   PRO  78          2HG       PRO  78 -14.507   1.056 -13.514
  613   2HG   PRO  78          1HG       PRO  78 -14.013   2.741 -13.487
  614   1HD   PRO  78          1HD       PRO  78 -12.360   0.789 -14.398
  615   2HD   PRO  78          2HD       PRO  78 -11.740   2.212 -13.584
  616    H    ASP  79           H        ASP  79 -13.478  -1.462 -12.055
  617    HA   ASP  79           HA       ASP  79 -14.744  -2.335  -9.643
  618   1HB   ASP  79          2HB       ASP  79 -15.146  -4.410 -10.855
  619   2HB   ASP  79          1HB       ASP  79 -15.490  -3.031 -11.909
  620    H    TYR  80           H        TYR  80 -11.546  -2.401 -10.611
  621    HA   TYR  80           HA       TYR  80 -10.755  -4.457  -8.686
  622   1HB   TYR  80          2HB       TYR  80  -9.560  -3.183 -11.069
  623   2HB   TYR  80          1HB       TYR  80  -8.480  -3.757  -9.787
  624    HD1  TYR  80           HD1      TYR  80 -11.502  -4.892 -11.641
  625    HD2  TYR  80           HD2      TYR  80  -7.744  -5.818  -9.877
  626    HE1  TYR  80           HE1      TYR  80 -11.699  -7.200 -12.484
  627    HE2  TYR  80           HE2      TYR  80  -7.919  -8.145 -10.692
  628    HH   TYR  80           HH       TYR  80  -8.975  -9.435 -12.229
  629    H    ALA  81           H        ALA  81 -11.563  -1.442  -8.397
  630    HA   ALA  81           HA       ALA  81  -9.392  -0.750  -6.537
  631   1HB   ALA  81          1HB       ALA  81  -9.043   0.365  -8.763
  632   2HB   ALA  81          2HB       ALA  81  -9.309   1.510  -7.448
  633   3HB   ALA  81          3HB       ALA  81 -10.616   1.142  -8.573
  634    H    TYR  82           H        TYR  82 -11.705   1.776  -7.022
  635    HA   TYR  82           HA       TYR  82 -13.144   0.958  -4.576
  636   1HB   TYR  82          2HB       TYR  82 -12.503   3.643  -5.852
  637   2HB   TYR  82          1HB       TYR  82 -13.463   3.448  -4.376
  638    HD1  TYR  82           HD1      TYR  82 -12.315   2.134  -2.428
  639    HD2  TYR  82           HD2      TYR  82 -10.244   3.941  -5.710
  640    HE1  TYR  82           HE1      TYR  82 -10.207   2.035  -1.126
  641    HE2  TYR  82           HE2      TYR  82  -8.141   3.838  -4.423
  642    HH   TYR  82           HH       TYR  82  -7.555   3.779  -1.856
  643    H    GLY  83           H        GLY  83 -13.804   0.861  -7.754
  644   1HA   GLY  83          2HA       GLY  83 -15.708   0.433  -8.896
  645   2HA   GLY  83          1HA       GLY  83 -16.439   0.099  -7.320
  646    H    ALA  84           H        ALA  84 -18.269   0.983  -7.434
  647    HA   ALA  84           HA       ALA  84 -18.706   3.583  -8.635
  648   1HB   ALA  84          1HB       ALA  84 -20.323   1.691  -8.791
  649   2HB   ALA  84          2HB       ALA  84 -21.024   3.181  -8.157
  650   3HB   ALA  84          3HB       ALA  84 -20.613   1.862  -7.058
  651    H    THR  85           H        THR  85 -18.019   2.428  -5.346
  652    HA   THR  85           HA       THR  85 -19.181   4.738  -4.103
  653    HB   THR  85           HB       THR  85 -16.856   3.115  -3.033
  654    HG1  THR  85           HG1      THR  85 -19.571   2.453  -2.690
  655   1HG2  THR  85          1HG2      THR  85 -19.158   4.616  -1.811
  656   2HG2  THR  85          2HG2      THR  85 -17.431   4.850  -1.533
  657   3HG2  THR  85          3HG2      THR  85 -18.237   3.409  -0.916
  658    H    GLY  86           H        GLY  86 -15.913   4.003  -5.319
  659   1HA   GLY  86          2HA       GLY  86 -14.099   5.462  -5.595
  660   2HA   GLY  86          1HA       GLY  86 -15.215   6.806  -5.306
  661    H    HIS  87           H        HIS  87 -13.165   7.510  -3.886
  662    HA   HIS  87           HA       HIS  87 -13.464   6.202  -1.253
  663   1HB   HIS  87          2HB       HIS  87 -11.189   6.024  -2.259
  664   2HB   HIS  87          1HB       HIS  87 -11.087   7.792  -2.211
  665    HD1  HIS  87           HD1      HIS  87 -10.928   8.797   0.416
  666    HD2  HIS  87           HD2      HIS  87 -10.711   4.670  -0.092
  667    HE1  HIS  87           HE1      HIS  87 -10.103   7.850   2.598
  668    HE2  HIS  87           HE2      HIS  87 -10.002   5.371   2.223
  669    HA   PRO  88           HA       PRO  88 -15.772  10.119  -0.978
  670   1HB   PRO  88          2HB       PRO  88 -15.861  10.506   1.732
  671   2HB   PRO  88          1HB       PRO  88 -16.876   9.331   0.912
  672   1HG   PRO  88          2HG       PRO  88 -14.225   8.864   2.307
  673   2HG   PRO  88          1HG       PRO  88 -15.722   7.964   2.495
  674   1HD   PRO  88          1HD       PRO  88 -13.868   6.988   0.830
  675   2HD   PRO  88          2HD       PRO  88 -15.539   6.973   0.308
  676    H    GLY  89           H        GLY  89 -15.166  11.873  -1.572
  677   1HA   GLY  89          2HA       GLY  89 -14.150  13.914  -1.651
  678   2HA   GLY  89          1HA       GLY  89 -13.217  13.473  -0.214
  679    H    ILE  90           H        ILE  90 -12.041  11.022  -1.771
  680    HA   ILE  90           HA       ILE  90  -9.979  12.655  -3.119
  681    HB   ILE  90           HB       ILE  90  -9.842   9.884  -1.827
  682   1HG1  ILE  90          2HG1      ILE  90  -8.445  12.389  -0.968
  683   2HG1  ILE  90          1HG1      ILE  90 -10.099  12.030  -0.441
  684   1HG2  ILE  90          1HG2      ILE  90  -7.308  10.386  -1.932
  685   2HG2  ILE  90          2HG2      ILE  90  -7.712  11.627  -3.117
  686   3HG2  ILE  90          3HG2      ILE  90  -8.066   9.934  -3.460
  687   1HD1  ILE  90          1HD1      ILE  90  -9.335  10.708   1.163
  688   2HD1  ILE  90          2HD1      ILE  90  -7.694  11.180   0.726
  689   3HD1  ILE  90          3HD1      ILE  90  -8.424   9.749  -0.003
  690    H    ILE  91           H        ILE  91 -11.665   9.563  -3.636
  691    HA   ILE  91           HA       ILE  91 -10.634   9.709  -6.403
  692    HB   ILE  91           HB       ILE  91 -11.716   7.252  -4.977
  693   1HG1  ILE  91          2HG1      ILE  91  -9.603   7.976  -3.973
  694   2HG1  ILE  91          1HG1      ILE  91  -9.414   6.461  -4.873
  695   1HG2  ILE  91          1HG2      ILE  91 -10.552   6.112  -6.910
  696   2HG2  ILE  91          2HG2      ILE  91 -10.439   7.707  -7.652
  697   3HG2  ILE  91          3HG2      ILE  91 -12.020   7.012  -7.293
  698   1HD1  ILE  91          1HD1      ILE  91  -7.508   7.969  -5.200
  699   2HD1  ILE  91          2HD1      ILE  91  -8.593   9.197  -5.853
  700   3HD1  ILE  91          3HD1      ILE  91  -8.368   7.672  -6.710
  701    HA   PRO  92           HA       PRO  92 -15.250  10.299  -7.056
  702   1HB   PRO  92          2HB       PRO  92 -14.682   9.827  -9.877
  703   2HB   PRO  92          1HB       PRO  92 -15.346  11.254  -9.101
  704   1HG   PRO  92          2HG       PRO  92 -12.861  11.317 -10.115
  705   2HG   PRO  92          1HG       PRO  92 -13.211  12.132  -8.600
  706   1HD   PRO  92          1HD       PRO  92 -12.060   9.356  -8.999
  707   2HD   PRO  92          2HD       PRO  92 -11.420  10.653  -8.011
  708    HA   PRO  93           HA       PRO  93 -16.847   6.125  -7.868
  709   1HB   PRO  93          2HB       PRO  93 -18.920   7.282  -9.560
  710   2HB   PRO  93          1HB       PRO  93 -19.087   6.342  -8.087
  711   1HG   PRO  93          2HG       PRO  93 -19.618   9.036  -8.232
  712   2HG   PRO  93          1HG       PRO  93 -19.150   8.220  -6.750
  713   1HD   PRO  93          1HD       PRO  93 -17.515   9.977  -8.525
  714   2HD   PRO  93          2HD       PRO  93 -17.370   9.712  -6.800
  715    H    HIS  94           H        HIS  94 -16.501   4.744  -9.377
  716    HA   HIS  94           HA       HIS  94 -15.944   3.694 -11.308
  717   1HB   HIS  94          2HB       HIS  94 -17.265   6.169 -12.563
  718   2HB   HIS  94          1HB       HIS  94 -16.933   4.652 -13.416
  719    HD1  HIS  94           HD1      HIS  94 -18.295   2.487 -12.155
  720    HD2  HIS  94           HD2      HIS  94 -19.607   6.360 -11.436
  721    HE1  HIS  94           HE1      HIS  94 -20.597   2.310 -11.164
  722    HE2  HIS  94           HE2      HIS  94 -21.351   4.658 -10.758
  723    H    ALA  95           H        ALA  95 -13.895   5.538 -10.142
  724    HA   ALA  95           HA       ALA  95 -12.524   6.635 -12.450
  725   1HB   ALA  95          1HB       ALA  95 -12.629   7.329  -9.872
  726   2HB   ALA  95          2HB       ALA  95 -11.238   7.693 -10.892
  727   3HB   ALA  95          3HB       ALA  95 -11.203   6.294  -9.820
  728    H    THR  96           H        THR  96 -10.924   5.698 -13.746
  729    HA   THR  96           HA       THR  96  -9.715   3.197 -13.010
  730    HB   THR  96           HB       THR  96  -9.159   5.171 -15.276
  731    HG1  THR  96           HG1      THR  96 -10.420   3.812 -16.393
  732   1HG2  THR  96          1HG2      THR  96  -7.731   2.634 -14.646
  733   2HG2  THR  96          2HG2      THR  96  -7.065   4.252 -14.874
  734   3HG2  THR  96          3HG2      THR  96  -7.753   3.381 -16.245
  735    H    LEU  97           H        LEU  97  -7.695   3.076 -11.871
  736    HA   LEU  97           HA       LEU  97  -6.462   5.644 -11.105
  737   1HB   LEU  97          2HB       LEU  97  -6.522   2.946  -9.733
  738   2HB   LEU  97          1HB       LEU  97  -5.731   4.392  -9.102
  739    HG   LEU  97           HG       LEU  97  -8.695   3.975  -9.443
  740   1HD1  LEU  97          1HD1      LEU  97  -8.706   3.954  -7.053
  741   2HD1  LEU  97          2HD1      LEU  97  -6.988   4.352  -6.994
  742   3HD1  LEU  97          3HD1      LEU  97  -7.511   2.781  -7.602
  743   1HD2  LEU  97          1HD2      LEU  97  -8.505   6.246  -9.826
  744   2HD2  LEU  97          2HD2      LEU  97  -7.064   6.407  -8.822
  745   3HD2  LEU  97          3HD2      LEU  97  -8.645   6.198  -8.069
  746    H    VAL  98           H        VAL  98  -4.207   5.848 -11.143
  747    HA   VAL  98           HA       VAL  98  -2.849   3.761 -12.691
  748    HB   VAL  98           HB       VAL  98  -2.520   6.782 -12.882
  749   1HG1  VAL  98          1HG1      VAL  98  -1.026   4.461 -14.105
  750   2HG1  VAL  98          2HG1      VAL  98  -0.379   5.705 -13.036
  751   3HG1  VAL  98          3HG1      VAL  98  -0.882   6.124 -14.674
  752   1HG2  VAL  98          1HG2      VAL  98  -3.182   4.907 -15.157
  753   2HG2  VAL  98          2HG2      VAL  98  -3.415   6.653 -15.064
  754   3HG2  VAL  98          3HG2      VAL  98  -4.468   5.573 -14.149
  755    H    PHE  99           H        PHE  99  -1.240   2.912 -11.258
  756    HA   PHE  99           HA       PHE  99  -0.234   4.767  -9.192
  757   1HB   PHE  99          2HB       PHE  99  -0.719   1.816  -9.169
  758   2HB   PHE  99          1HB       PHE  99   0.436   2.563  -8.051
  759    HD1  PHE  99           HD1      PHE  99  -3.098   2.160  -8.946
  760    HD2  PHE  99           HD2      PHE  99  -0.266   3.912  -6.250
  761    HE1  PHE  99           HE1      PHE  99  -4.902   2.660  -7.347
  762    HE2  PHE  99           HE2      PHE  99  -2.089   4.403  -4.663
  763    HZ   PHE  99           HZ       PHE  99  -4.397   3.778  -5.220
  764    H    ASP 100           H        ASP 100   1.948   5.076  -9.152
  765    HA   ASP 100           HA       ASP 100   3.709   3.599 -10.963
  766   1HB   ASP 100          2HB       ASP 100   3.847   5.986 -11.158
  767   2HB   ASP 100          1HB       ASP 100   4.085   6.148  -9.410
  768    H    VAL 101           H        VAL 101   4.563   1.927  -9.767
  769    HA   VAL 101           HA       VAL 101   4.827   2.054  -6.829
  770    HB   VAL 101           HB       VAL 101   3.653  -0.202  -8.531
  771   1HG1  VAL 101          1HG1      VAL 101   3.149  -1.242  -6.290
  772   2HG1  VAL 101          2HG1      VAL 101   4.248  -0.060  -5.580
  773   3HG1  VAL 101          3HG1      VAL 101   4.852  -1.233  -6.751
  774   1HG2  VAL 101          1HG2      VAL 101   1.644   0.199  -7.114
  775   2HG2  VAL 101          2HG2      VAL 101   2.122   1.753  -7.797
  776   3HG2  VAL 101          3HG2      VAL 101   2.550   1.352  -6.133
  777    H    GLU 102           H        GLU 102   6.714   1.361  -6.030
  778    HA   GLU 102           HA       GLU 102   8.510  -0.105  -7.838
  779   1HB   GLU 102          2HB       GLU 102   9.367   2.099  -7.493
  780   2HB   GLU 102          1HB       GLU 102   9.085   1.987  -5.750
  781   1HG   GLU 102          2HG       GLU 102  10.833   0.480  -5.436
  782   2HG   GLU 102          1HG       GLU 102  10.875   0.034  -7.151
  783    H    LEU 103           H        LEU 103   8.833  -2.173  -7.006
  784    HA   LEU 103           HA       LEU 103   8.027  -2.669  -4.241
  785   1HB   LEU 103          2HB       LEU 103   7.226  -4.249  -5.863
  786   2HB   LEU 103          1HB       LEU 103   8.846  -4.466  -6.530
  787    HG   LEU 103           HG       LEU 103   9.548  -5.664  -4.532
  788   1HD1  LEU 103          1HD1      LEU 103   6.783  -4.963  -3.523
  789   2HD1  LEU 103          2HD1      LEU 103   8.336  -4.624  -2.761
  790   3HD1  LEU 103          3HD1      LEU 103   7.733  -6.280  -2.836
  791   1HD2  LEU 103          1HD2      LEU 103   7.982  -7.616  -4.729
  792   2HD2  LEU 103          2HD2      LEU 103   8.588  -7.006  -6.269
  793   3HD2  LEU 103          3HD2      LEU 103   6.951  -6.610  -5.747
  794    H    LEU 104           H        LEU 104   9.456  -2.278  -2.766
  795    HA   LEU 104           HA       LEU 104  12.288  -2.024  -3.406
  796   1HB   LEU 104          2HB       LEU 104  10.807  -1.447  -0.822
  797   2HB   LEU 104          1HB       LEU 104  12.476  -0.997  -1.180
  798    HG   LEU 104           HG       LEU 104  10.041   0.190  -2.506
  799   1HD1  LEU 104          1HD1      LEU 104  10.369   0.799  -0.054
  800   2HD1  LEU 104          2HD1      LEU 104  10.327   2.141  -1.199
  801   3HD1  LEU 104          3HD1      LEU 104  11.870   1.579  -0.556
  802   1HD2  LEU 104          1HD2      LEU 104  12.274   0.035  -3.736
  803   2HD2  LEU 104          2HD2      LEU 104  12.923   1.105  -2.492
  804   3HD2  LEU 104          3HD2      LEU 104  11.621   1.661  -3.544
  805    H    LYS 105           H        LYS 105  10.327  -4.008  -1.313
  806    HA   LYS 105           HA       LYS 105  12.566  -5.750  -0.712
  807   1HB   LYS 105          2HB       LYS 105  12.825  -3.635   0.611
  808   2HB   LYS 105          1HB       LYS 105  11.331  -4.081   1.446
  809   1HG   LYS 105          2HG       LYS 105  12.359  -6.016   2.349
  810   2HG   LYS 105          1HG       LYS 105  13.834  -5.708   1.415
  811   1HD   LYS 105          2HD       LYS 105  14.216  -3.641   2.555
  812   2HD   LYS 105          1HD       LYS 105  12.615  -3.695   3.310
  813   1HE   LYS 105          2HE       LYS 105  13.276  -5.922   4.301
  814   2HE   LYS 105          1HE       LYS 105  14.923  -5.603   3.734
  815   1HZ   LYS 105          1HZ       LYS 105  13.453  -4.430   5.889
  816   2HZ   LYS 105          2HZ       LYS 105  14.253  -3.309   4.908
  817   3HZ   LYS 105          3HZ       LYS 105  15.123  -4.566   5.660
  818    H    LEU 106           H        LEU 106  11.794  -7.704   0.371
  819    HA   LEU 106           HA       LEU 106   8.922  -7.755   1.010
  820   1HB   LEU 106          2HB       LEU 106  10.658 -10.084   0.182
  821   2HB   LEU 106          1HB       LEU 106   8.990 -10.213   0.746
  822    HG   LEU 106           HG       LEU 106   9.870  -8.833  -1.809
  823   1HD1  LEU 106          1HD1      LEU 106   8.415 -11.425  -1.350
  824   2HD1  LEU 106          2HD1      LEU 106  10.121 -11.286  -1.775
  825   3HD1  LEU 106          3HD1      LEU 106   8.883 -10.734  -2.904
  826   1HD2  LEU 106          1HD2      LEU 106   7.567  -8.573  -2.322
  827   2HD2  LEU 106          2HD2      LEU 106   7.753  -7.976  -0.673
  828   3HD2  LEU 106          3HD2      LEU 106   7.072  -9.577  -0.959
  829    H    GLU 107           HN       GLU 107   8.525  -8.268   3.052
  830    HA   GLU 107           HA       GLU 107  10.716  -9.187   4.801
  831   1HB   GLU 107          2HB       GLU 107   8.509  -7.228   5.416
  832   2HB   GLU 107          1HB       GLU 107   9.697  -7.832   6.580
  833   1HG   GLU 107          2HG       GLU 107  11.468  -6.821   5.247
  834   2HG   GLU 107          1HG       GLU 107  10.234  -6.153   4.164
  835    H2   GPI 108           H2       GPI 108  -3.288   1.709  -2.349
  836   1H5   GPI 108          1H5       GPI 108  -1.802   4.289  -1.528
  837   2H5   GPI 108          2H5       GPI 108  -2.050   4.314   0.228
  838   1H3   GPI 108          1H3       GPI 108  -1.572   0.412  -1.144
  839   2H3   GPI 108          2H3       GPI 108  -2.294   0.782   0.431
  840   1H4   GPI 108          1H4       GPI 108  -0.458   2.417  -1.323
  841   2H4   GPI 108          2H4       GPI 108  -0.612   2.499   0.461
  842   1H14  GPI 108          1H14      GPI 108  -6.774   1.411  -0.066
  843   2H14  GPI 108          2H14      GPI 108  -6.642  -0.258   0.538
  844   1H15  GPI 108          1H15      GPI 108  -6.366   0.528   2.832
  845   2H15  GPI 108          2H15      GPI 108  -6.268   2.219   2.289
  846   1H16  GPI 108          1H16      GPI 108  -8.598   2.076   1.426
  847   2H16  GPI 108          2H16      GPI 108  -8.535   1.700   3.165
  848    H20  GPI 108           H20      GPI 108 -10.503  -3.501   1.193
  849    H21  GPI 108           H21      GPI 108 -11.219  -1.508  -0.121
  850    H22  GPI 108           H22      GPI 108 -10.183   0.712   0.329
  851    H18  GPI 108           H18      GPI 108  -7.720  -1.042   3.402
  852   1H12  GPI 108          1H12      GPI 108  -3.039   5.990   2.210
  853   2H12  GPI 108          2H12      GPI 108  -4.098   4.979   3.152
  854   3H12  GPI 108          3H12      GPI 108  -3.274   4.320   1.752
  855   1H13  GPI 108          1H13      GPI 108  -6.553   4.202   0.971
  856   2H13  GPI 108          2H13      GPI 108  -5.961   4.279   2.641
  857   3H13  GPI 108          3H13      GPI 108  -6.982   5.596   1.996
  858   1H10  GPI 108          1H10      GPI 108  -4.239   7.643   1.113
  859   2H10  GPI 108          2H10      GPI 108  -5.404   7.375   2.429
  860   1H11  GPI 108          1H11      GPI 108  -7.041   6.786   0.433
  861   2H11  GPI 108          2H11      GPI 108  -6.750   8.448   0.864
  862   3H11  GPI 108          3H11      GPI 108  -5.923   7.742  -0.512