*HEADER    DNA BINDING PROTEIN INHIBITOR           30-JUN-11   2LFH              
*TITLE     SOLUTION NMR STRUCTURE OF THE HELIX-LOOP-HELIX DOMAIN OF HUMAN ID3    
*TITLE    2 PROTEIN, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM TARGET HR3111A     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DNA-BINDING PROTEIN INHIBITOR ID-3;                        
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 FRAGMENT: HELIX-LOOP-HELIX MOTIF DOMAIN RESIDUES 27-83;              
*COMPND   5 SYNONYM: CLASS B BASIC HELIX-LOOP-HELIX PROTEIN 25, BHLHB25, HELIX-  
*COMPND   6 LOOP-HELIX PROTEIN HEIR-1, ID-LIKE PROTEIN INHIBITOR HLH 1R21,       
*COMPND   7 INHIBITOR OF DNA BINDING 3;                                          
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: 1R21, BHLHB25, HEIR1, ID3;                                     
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+ MAGIC;                          
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET 14-15C                                 
*KEYWDS    STRUCTURAL GENOMICS, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG), 
*KEYWDS   2 PSI-2, PROTEIN STRUCTURE INITIATIVE, HELIX-LOOP-HELIX, DNA BINDING   
*KEYWDS   3 PROTEIN INHIBITOR                                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.ELETSKY, D.WANG, E.KOHAN, H.JANJUA, T.B.ACTON, R.XIAO, J.K.EVERETT, 
*AUTHOR   2 G.T.MONTELIONE, T.SZYPERSKI, NORTHEAST STRUCTURAL GENOMICS           
*AUTHOR   3 CONSORTIUM (NESG)                                                    
*REVDAT   1   27-JUL-11 2LFH    0                                                


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assign (resid   29 and name N    ) (resid   29 and name CA   )
       (resid   29 and name C    ) (resid   30 and name N    )    1.0  -42.0   11.9 2
assign (resid   29 and name C    ) (resid   30 and name N    )
       (resid   30 and name CA   ) (resid   30 and name C    )    1.0  -63.1   15.2 2
assign (resid   30 and name N    ) (resid   30 and name CA   )
       (resid   30 and name C    ) (resid   31 and name N    )    1.0  -41.5   13.3 2
assign (resid   30 and name C    ) (resid   31 and name N    )
       (resid   31 and name CA   ) (resid   31 and name C    )    1.0  -64.3   13.2 2
assign (resid   31 and name N    ) (resid   31 and name CA   )
       (resid   31 and name C    ) (resid   32 and name N    )    1.0  -41.7   12.1 2
assign (resid   31 and name C    ) (resid   32 and name N    )
       (resid   32 and name CA   ) (resid   32 and name C    )    1.0  -64.2   10.0 2
assign (resid   32 and name N    ) (resid   32 and name CA   )
       (resid   32 and name C    ) (resid   33 and name N    )    1.0  -44.3   12.3 2
assign (resid   32 and name C    ) (resid   33 and name N    )
       (resid   33 and name CA   ) (resid   33 and name C    )    1.0  -60.1   10.0 2
assign (resid   33 and name N    ) (resid   33 and name CA   )
       (resid   33 and name C    ) (resid   34 and name N    )    1.0  -42.7   11.6 2
assign (resid   33 and name C    ) (resid   34 and name N    )
       (resid   34 and name CA   ) (resid   34 and name C    )    1.0  -62.7   12.8 2
assign (resid   34 and name N    ) (resid   34 and name CA   )
       (resid   34 and name C    ) (resid   35 and name N    )    1.0  -41.3   12.7 2
assign (resid   34 and name C    ) (resid   35 and name N    )
       (resid   35 and name CA   ) (resid   35 and name C    )    1.0  -64.7   10.0 2
assign (resid   35 and name N    ) (resid   35 and name CA   )
       (resid   35 and name C    ) (resid   36 and name N    )    1.0  -42.3   16.7 2
assign (resid   35 and name C    ) (resid   36 and name N    )
       (resid   36 and name CA   ) (resid   36 and name C    )    1.0  -65.9   12.3 2
assign (resid   36 and name N    ) (resid   36 and name CA   )
       (resid   36 and name C    ) (resid   37 and name N    )    1.0  -41.0   15.6 2
assign (resid   51 and name C    ) (resid   52 and name N    )
       (resid   52 and name CA   ) (resid   52 and name C    )    1.0  -61.6   10.0 2
assign (resid   52 and name N    ) (resid   52 and name CA   )
       (resid   52 and name C    ) (resid   53 and name N    )    1.0  -41.1   10.0 2
assign (resid   52 and name C    ) (resid   53 and name N    )
       (resid   53 and name CA   ) (resid   53 and name C    )    1.0  -64.0   10.0 2
assign (resid   53 and name N    ) (resid   53 and name CA   )
       (resid   53 and name C    ) (resid   54 and name N    )    1.0  -41.0   13.5 2
assign (resid   53 and name C    ) (resid   54 and name N    )
       (resid   54 and name CA   ) (resid   54 and name C    )    1.0  -62.5   11.3 2
assign (resid   54 and name N    ) (resid   54 and name CA   )
       (resid   54 and name C    ) (resid   55 and name N    )    1.0  -42.1   13.4 2
assign (resid   54 and name C    ) (resid   55 and name N    )
       (resid   55 and name CA   ) (resid   55 and name C    )    1.0  -59.7   10.0 2
assign (resid   55 and name N    ) (resid   55 and name CA   )
       (resid   55 and name C    ) (resid   56 and name N    )    1.0  -38.7   10.0 2
assign (resid   55 and name C    ) (resid   56 and name N    )
       (resid   56 and name CA   ) (resid   56 and name C    )    1.0  -61.6   10.1 2
assign (resid   56 and name N    ) (resid   56 and name CA   )
       (resid   56 and name C    ) (resid   57 and name N    )    1.0  -46.8   10.4 2
assign (resid   56 and name C    ) (resid   57 and name N    )
       (resid   57 and name CA   ) (resid   57 and name C    )    1.0  -64.1   10.0 2
assign (resid   57 and name N    ) (resid   57 and name CA   )
       (resid   57 and name C    ) (resid   58 and name N    )    1.0  -40.5   19.5 2
assign (resid   57 and name C    ) (resid   58 and name N    )
       (resid   58 and name CA   ) (resid   58 and name C    )    1.0  -66.0   17.8 2
assign (resid   58 and name N    ) (resid   58 and name CA   )
       (resid   58 and name C    ) (resid   59 and name N    )    1.0  -41.6   14.3 2
assign (resid   58 and name C    ) (resid   59 and name N    )
       (resid   59 and name CA   ) (resid   59 and name C    )    1.0  -61.9   10.0 2
assign (resid   59 and name N    ) (resid   59 and name CA   )
       (resid   59 and name C    ) (resid   60 and name N    )    1.0  -44.8   13.5 2
assign (resid   59 and name C    ) (resid   60 and name N    )
       (resid   60 and name CA   ) (resid   60 and name C    )    1.0  -62.6   16.8 2
assign (resid   60 and name N    ) (resid   60 and name CA   )
       (resid   60 and name C    ) (resid   61 and name N    )    1.0  -38.4   19.6 2
assign (resid   60 and name C    ) (resid   61 and name N    )
       (resid   61 and name CA   ) (resid   61 and name C    )    1.0  -67.2   10.0 2
assign (resid   61 and name N    ) (resid   61 and name CA   )
       (resid   61 and name C    ) (resid   62 and name N    )    1.0  -43.2   12.0 2
assign (resid   61 and name C    ) (resid   62 and name N    )
       (resid   62 and name CA   ) (resid   62 and name C    )    1.0  -64.0   10.0 2
assign (resid   62 and name N    ) (resid   62 and name CA   )
       (resid   62 and name C    ) (resid   63 and name N    )    1.0  -41.3   14.0 2
assign (resid   62 and name C    ) (resid   63 and name N    )
       (resid   63 and name CA   ) (resid   63 and name C    )    1.0  -59.4   10.0 2
assign (resid   63 and name N    ) (resid   63 and name CA   )
       (resid   63 and name C    ) (resid   64 and name N    )    1.0  -40.6   10.0 2
assign (resid   63 and name C    ) (resid   64 and name N    )
       (resid   64 and name CA   ) (resid   64 and name C    )    1.0  -64.2   10.0 2
assign (resid   64 and name N    ) (resid   64 and name CA   )
       (resid   64 and name C    ) (resid   65 and name N    )    1.0  -41.5   10.0 2
assign (resid  127 and name C    ) (resid  128 and name N    )
       (resid  128 and name CA   ) (resid  128 and name C    )    1.0  -66.2   13.9 2
assign (resid  128 and name N    ) (resid  128 and name CA   )
       (resid  128 and name C    ) (resid  129 and name N    )    1.0  -38.0   15.7 2
assign (resid  128 and name C    ) (resid  129 and name N    )
       (resid  129 and name CA   ) (resid  129 and name C    )    1.0  -63.9   11.7 2
assign (resid  129 and name N    ) (resid  129 and name CA   )
       (resid  129 and name C    ) (resid  130 and name N    )    1.0  -42.0   11.9 2
assign (resid  129 and name C    ) (resid  130 and name N    )
       (resid  130 and name CA   ) (resid  130 and name C    )    1.0  -63.1   15.2 2
assign (resid  130 and name N    ) (resid  130 and name CA   )
       (resid  130 and name C    ) (resid  131 and name N    )    1.0  -41.5   13.3 2
assign (resid  130 and name C    ) (resid  131 and name N    )
       (resid  131 and name CA   ) (resid  131 and name C    )    1.0  -64.3   13.2 2
assign (resid  131 and name N    ) (resid  131 and name CA   )
       (resid  131 and name C    ) (resid  132 and name N    )    1.0  -41.7   12.1 2
assign (resid  131 and name C    ) (resid  132 and name N    )
       (resid  132 and name CA   ) (resid  132 and name C    )    1.0  -64.2   10.0 2
assign (resid  132 and name N    ) (resid  132 and name CA   )
       (resid  132 and name C    ) (resid  133 and name N    )    1.0  -44.3   12.3 2
assign (resid  132 and name C    ) (resid  133 and name N    )
       (resid  133 and name CA   ) (resid  133 and name C    )    1.0  -60.1   10.0 2
assign (resid  133 and name N    ) (resid  133 and name CA   )
       (resid  133 and name C    ) (resid  134 and name N    )    1.0  -42.7   11.6 2
assign (resid  133 and name C    ) (resid  134 and name N    )
       (resid  134 and name CA   ) (resid  134 and name C    )    1.0  -62.7   12.8 2
assign (resid  134 and name N    ) (resid  134 and name CA   )
       (resid  134 and name C    ) (resid  135 and name N    )    1.0  -41.3   12.7 2
assign (resid  134 and name C    ) (resid  135 and name N    )
       (resid  135 and name CA   ) (resid  135 and name C    )    1.0  -64.7   10.0 2
assign (resid  135 and name N    ) (resid  135 and name CA   )
       (resid  135 and name C    ) (resid  136 and name N    )    1.0  -42.3   16.7 2
assign (resid  135 and name C    ) (resid  136 and name N    )
       (resid  136 and name CA   ) (resid  136 and name C    )    1.0  -65.9   12.3 2
assign (resid  136 and name N    ) (resid  136 and name CA   )
       (resid  136 and name C    ) (resid  137 and name N    )    1.0  -41.0   15.6 2
assign (resid  151 and name N    ) (resid  151 and name CA   )
       (resid  151 and name C    ) (resid  152 and name N    )    1.0  -40.5   14.8 2
assign (resid  151 and name C    ) (resid  152 and name N    )
       (resid  152 and name CA   ) (resid  152 and name C    )    1.0  -61.6   10.0 2
assign (resid  152 and name N    ) (resid  152 and name CA   )
       (resid  152 and name C    ) (resid  153 and name N    )    1.0  -41.1   10.0 2
assign (resid  152 and name C    ) (resid  153 and name N    )
       (resid  153 and name CA   ) (resid  153 and name C    )    1.0  -64.0   10.0 2
assign (resid  153 and name N    ) (resid  153 and name CA   )
       (resid  153 and name C    ) (resid  154 and name N    )    1.0  -41.0   13.5 2
assign (resid  153 and name C    ) (resid  154 and name N    )
       (resid  154 and name CA   ) (resid  154 and name C    )    1.0  -62.5   11.3 2
assign (resid  154 and name N    ) (resid  154 and name CA   )
       (resid  154 and name C    ) (resid  155 and name N    )    1.0  -42.1   13.4 2
assign (resid  154 and name C    ) (resid  155 and name N    )
       (resid  155 and name CA   ) (resid  155 and name C    )    1.0  -59.7   10.0 2
assign (resid  155 and name N    ) (resid  155 and name CA   )
       (resid  155 and name C    ) (resid  156 and name N    )    1.0  -38.7   10.0 2
assign (resid  155 and name C    ) (resid  156 and name N    )
       (resid  156 and name CA   ) (resid  156 and name C    )    1.0  -61.6   10.1 2
assign (resid  156 and name N    ) (resid  156 and name CA   )
       (resid  156 and name C    ) (resid  157 and name N    )    1.0  -46.8   10.4 2
assign (resid  156 and name C    ) (resid  157 and name N    )
       (resid  157 and name CA   ) (resid  157 and name C    )    1.0  -64.1   10.0 2
assign (resid  157 and name N    ) (resid  157 and name CA   )
       (resid  157 and name C    ) (resid  158 and name N    )    1.0  -40.5   19.5 2
assign (resid  157 and name C    ) (resid  158 and name N    )
       (resid  158 and name CA   ) (resid  158 and name C    )    1.0  -66.0   17.8 2
assign (resid  158 and name N    ) (resid  158 and name CA   )
       (resid  158 and name C    ) (resid  159 and name N    )    1.0  -41.6   14.3 2
assign (resid  158 and name C    ) (resid  159 and name N    )
       (resid  159 and name CA   ) (resid  159 and name C    )    1.0  -61.9   10.0 2
assign (resid  159 and name N    ) (resid  159 and name CA   )
       (resid  159 and name C    ) (resid  160 and name N    )    1.0  -44.8   13.5 2
assign (resid  159 and name C    ) (resid  160 and name N    )
       (resid  160 and name CA   ) (resid  160 and name C    )    1.0  -62.6   16.8 2
assign (resid  160 and name N    ) (resid  160 and name CA   )
       (resid  160 and name C    ) (resid  161 and name N    )    1.0  -38.4   19.6 2
assign (resid  160 and name C    ) (resid  161 and name N    )
       (resid  161 and name CA   ) (resid  161 and name C    )    1.0  -67.2   10.0 2
assign (resid  161 and name N    ) (resid  161 and name CA   )
       (resid  161 and name C    ) (resid  162 and name N    )    1.0  -43.2   12.0 2
assign (resid  161 and name C    ) (resid  162 and name N    )
       (resid  162 and name CA   ) (resid  162 and name C    )    1.0  -64.0   10.0 2
assign (resid  162 and name N    ) (resid  162 and name CA   )
       (resid  162 and name C    ) (resid  163 and name N    )    1.0  -41.3   14.0 2
assign (resid  162 and name C    ) (resid  163 and name N    )
       (resid  163 and name CA   ) (resid  163 and name C    )    1.0  -59.4   10.0 2
assign (resid  163 and name N    ) (resid  163 and name CA   )
       (resid  163 and name C    ) (resid  164 and name N    )    1.0  -40.6   10.0 2
assign (resid  163 and name C    ) (resid  164 and name N    )
       (resid  164 and name CA   ) (resid  164 and name C    )    1.0  -64.2   10.0 2
assign (resid  164 and name N    ) (resid  164 and name CA   )
       (resid  164 and name C    ) (resid  165 and name N    )    1.0  -41.5   10.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H1       MET   1  22.030   3.992  18.435
    2    H2   MET   1           H2       MET   1  22.499   2.571  17.657
    3    H3   MET   1           H3       MET   1  20.863   2.991  17.744
    4    HA   MET   1           HA       MET   1  21.220   4.917  16.374
    5    HB2  MET   1           HB2      MET   1  24.098   3.917  16.196
    6    HB3  MET   1           HB3      MET   1  23.434   5.265  15.278
    7    HG2  MET   1           HG2      MET   1  23.060   6.522  17.349
    8    HG3  MET   1           HG3      MET   1  23.667   5.162  18.300
    9    HE1  MET   1           HE1      MET   1  24.830   8.115  18.655
   10    HE2  MET   1           HE2      MET   1  26.557   7.774  18.707
   11    HE3  MET   1           HE3      MET   1  25.430   6.713  19.548
   12    H    GLY   2           H        GLY   2  19.755   3.923  15.037
   13    HA2  GLY   2           HA2      GLY   2  19.112   2.753  13.099
   14    HA3  GLY   2           HA3      GLY   2  20.635   1.877  13.112
   15    H    HIS   3           H        HIS   3  17.409   1.429  13.491
   16    HA   HIS   3           HA       HIS   3  17.698  -0.952  15.220
   17    HB2  HIS   3           HB2      HIS   3  15.643  -0.326  16.494
   18    HB3  HIS   3           HB3      HIS   3  16.963   0.806  16.752
   19    HD2  HIS   3           HD2      HIS   3  16.557   3.395  15.744
   20    HE1  HIS   3           HE1      HIS   3  12.515   2.737  14.690
   21    HE2  HIS   3           HE2      HIS   3  14.384   4.434  14.797
   22    H    HIS   4           H        HIS   4  15.983  -2.511  15.022
   23    HA   HIS   4           HA       HIS   4  14.267  -2.272  12.605
   24    HB2  HIS   4           HB2      HIS   4  14.257  -4.707  12.472
   25    HB3  HIS   4           HB3      HIS   4  15.924  -4.162  12.560
   26    HD2  HIS   4           HD2      HIS   4  17.362  -5.021  14.794
   27    HE1  HIS   4           HE1      HIS   4  14.229  -7.378  16.389
   28    HE2  HIS   4           HE2      HIS   4  16.640  -6.669  16.657
   29    H    HIS   5           H        HIS   5  12.168  -3.586  12.847
   30    HA   HIS   5           HA       HIS   5  11.040  -3.404  15.590
   31    HB2  HIS   5           HB2      HIS   5  10.243  -1.500  14.168
   32    HB3  HIS   5           HB3      HIS   5   9.592  -2.648  13.006
   33    HD2  HIS   5           HD2      HIS   5   7.050  -3.506  13.532
   34    HE1  HIS   5           HE1      HIS   5   6.722  -1.795  17.376
   35    HE2  HIS   5           HE2      HIS   5   5.540  -3.148  15.602
   36    H    HIS   6           H        HIS   6  11.400  -5.648  15.901
   37    HA   HIS   6           HA       HIS   6  10.148  -7.611  14.160
   38    HB2  HIS   6           HB2      HIS   6  12.217  -8.229  15.357
   39    HB3  HIS   6           HB3      HIS   6  11.429  -7.954  16.909
   40    HD2  HIS   6           HD2      HIS   6  10.704 -10.324  18.000
   41    HE1  HIS   6           HE1      HIS   6   9.788 -12.344  14.397
   42    HE2  HIS   6           HE2      HIS   6   9.633 -12.419  16.918
   43    H    HIS   7           H        HIS   7   7.982  -7.353  14.099
   44    HA   HIS   7           HA       HIS   7   6.351  -8.132  16.359
   45    HB2  HIS   7           HB2      HIS   7   6.546  -5.760  16.883
   46    HB3  HIS   7           HB3      HIS   7   6.171  -5.307  15.227
   47    HD2  HIS   7           HD2      HIS   7   4.286  -6.796  18.367
   48    HE1  HIS   7           HE1      HIS   7   1.515  -4.968  15.740
   49    HE2  HIS   7           HE2      HIS   7   1.878  -5.885  18.065
   50    H    HIS   8           H        HIS   8   4.514  -9.108  15.693
   51    HA   HIS   8           HA       HIS   8   3.423  -8.703  12.989
   52    HB2  HIS   8           HB2      HIS   8   4.938 -10.655  12.782
   53    HB3  HIS   8           HB3      HIS   8   4.167 -11.433  14.158
   54    HD2  HIS   8           HD2      HIS   8   3.293 -10.506  10.421
   55    HE1  HIS   8           HE1      HIS   8   0.700 -13.559  11.787
   56    HE2  HIS   8           HE2      HIS   8   1.561 -12.317   9.761
   57    H    SER   9           H        SER   9   1.200  -9.131  12.844
   58    HA   SER   9           HA       SER   9  -0.280  -9.993  15.246
   59    HB2  SER   9           HB2      SER   9  -0.892  -7.425  13.706
   60    HB3  SER   9           HB3      SER   9  -1.902  -8.106  14.986
   61    HG   SER   9           HG       SER   9   0.755  -7.714  15.653
   62    H    HIS  10           H        HIS  10  -1.922 -11.308  14.770
   63    HA   HIS  10           HA       HIS  10  -3.126 -11.413  12.082
   64    HB2  HIS  10           HB2      HIS  10  -1.284 -13.089  12.080
   65    HB3  HIS  10           HB3      HIS  10  -1.941 -13.845  13.525
   66    HD1  HIS  10           HD1      HIS  10  -2.658 -13.421   9.836
   67    HD2  HIS  10           HD2      HIS  10  -3.964 -15.716  13.047
   68    HE1  HIS  10           HE1      HIS  10  -4.125 -15.190   8.850
   69    HE2  HIS  10           HE2      HIS  10  -5.001 -16.485  10.815
   70    H    MET  11           H        MET  11  -5.020 -10.547  12.988
   71    HA   MET  11           HA       MET  11  -6.620 -12.463  14.605
   72    HB2  MET  11           HB2      MET  11  -6.029 -10.511  16.011
   73    HB3  MET  11           HB3      MET  11  -6.698  -9.421  14.807
   74    HG2  MET  11           HG2      MET  11  -8.940 -10.290  15.207
   75    HG3  MET  11           HG3      MET  11  -8.307 -11.491  16.330
   76    HE1  MET  11           HE1      MET  11  -6.176  -9.883  18.070
   77    HE2  MET  11           HE2      MET  11  -7.409 -10.932  18.771
   78    HE3  MET  11           HE3      MET  11  -7.196  -9.291  19.380
   79    H    GLY  12           H        GLY  12  -6.833  -9.691  12.326
   80    HA2  GLY  12           HA2      GLY  12  -7.775 -10.391  10.097
   81    HA3  GLY  12           HA3      GLY  12  -9.141 -11.045  10.987
   82    H    GLY  13           H        GLY  13  -9.402  -9.198   8.907
   83    HA2  GLY  13           HA2      GLY  13 -10.771  -7.402   8.447
   84    HA3  GLY  13           HA3      GLY  13 -10.937  -7.091  10.166
   85    H    GLY  14           H        GLY  14  -9.314  -5.800  11.226
   86    HA2  GLY  14           HA2      GLY  14  -7.811  -4.059  11.407
   87    HA3  GLY  14           HA3      GLY  14  -7.237  -4.425   9.790
   88    H    LYS  15           H        LYS  15 -10.594  -3.922   9.958
   89    HA   LYS  15           HA       LYS  15 -10.521  -1.477   8.431
   90    HB2  LYS  15           HB2      LYS  15 -12.188  -3.285   8.020
   91    HB3  LYS  15           HB3      LYS  15 -12.869  -3.028   9.622
   92    HG2  LYS  15           HG2      LYS  15 -13.521  -0.713   8.941
   93    HG3  LYS  15           HG3      LYS  15 -12.899  -1.040   7.322
   94    HD2  LYS  15           HD2      LYS  15 -14.570  -2.972   7.193
   95    HD3  LYS  15           HD3      LYS  15 -15.269  -2.365   8.697
   96    HE2  LYS  15           HE2      LYS  15 -16.558  -1.555   6.788
   97    HE3  LYS  15           HE3      LYS  15 -15.744  -0.196   7.571
   98    HZ1  LYS  15           HZ1      LYS  15 -13.974  -0.439   5.841
   99    HZ2  LYS  15           HZ2      LYS  15 -15.479   0.037   5.241
  100    HZ3  LYS  15           HZ3      LYS  15 -14.963  -1.562   5.054
  101    H    GLY  16           H        GLY  16 -11.003   0.606   9.133
  102    HA2  GLY  16           HA2      GLY  16 -12.588   1.321  11.321
  103    HA3  GLY  16           HA3      GLY  16 -10.922   1.319  11.885
  104    HA   PRO  17           HA       PRO  17 -11.832   5.449   9.565
  105    HB2  PRO  17           HB2      PRO  17 -12.759   7.041  11.592
  106    HB3  PRO  17           HB3      PRO  17 -13.839   6.105  10.549
  107    HG2  PRO  17           HG2      PRO  17 -12.816   5.426  13.305
  108    HG3  PRO  17           HG3      PRO  17 -14.473   5.312  12.672
  109    HD2  PRO  17           HD2      PRO  17 -12.832   3.146  12.853
  110    HD3  PRO  17           HD3      PRO  17 -14.040   3.305  11.555
  111    H    ALA  18           H        ALA  18 -10.565   4.535  12.701
  112    HA   ALA  18           HA       ALA  18  -8.622   4.850  13.799
  113    HB1  ALA  18           HB1      ALA  18  -7.573   5.944  11.172
  114    HB2  ALA  18           HB2      ALA  18  -7.590   4.246  11.646
  115    HB3  ALA  18           HB3      ALA  18  -6.593   5.398  12.536
  116    H    ALA  19           H        ALA  19  -6.727   6.708  14.077
  117    HA   ALA  19           HA       ALA  19  -8.080   9.333  14.442
  118    HB1  ALA  19           HB1      ALA  19  -7.664   8.240  16.604
  119    HB2  ALA  19           HB2      ALA  19  -6.673   9.688  16.433
  120    HB3  ALA  19           HB3      ALA  19  -5.951   8.092  16.218
  121    H    GLU  20           H        GLU  20  -6.982  11.156  13.831
  122    HA   GLU  20           HA       GLU  20  -4.874  10.920  11.894
  123    HB2  GLU  20           HB2      GLU  20  -5.078  13.393  11.716
  124    HB3  GLU  20           HB3      GLU  20  -6.631  12.578  11.594
  125    HG2  GLU  20           HG2      GLU  20  -7.090  13.151  13.988
  126    HG3  GLU  20           HG3      GLU  20  -5.567  14.037  14.036
  127    H    GLU  21           H        GLU  21  -2.765  11.715  11.977
  128    HA   GLU  21           HA       GLU  21  -1.602  12.444  14.616
  129    HB2  GLU  21           HB2      GLU  21  -0.312  10.704  12.453
  130    HB3  GLU  21           HB3      GLU  21   0.432  11.156  13.984
  131    HG2  GLU  21           HG2      GLU  21  -1.363   9.868  15.176
  132    HG3  GLU  21           HG3      GLU  21  -1.984   9.360  13.605
  133    HA   PRO  22           HA       PRO  22   0.592  15.878  12.395
  134    HB2  PRO  22           HB2      PRO  22   3.128  14.746  13.591
  135    HB3  PRO  22           HB3      PRO  22   2.541  16.419  13.579
  136    HG2  PRO  22           HG2      PRO  22   2.363  14.945  15.804
  137    HG3  PRO  22           HG3      PRO  22   1.033  16.034  15.346
  138    HD2  PRO  22           HD2      PRO  22   1.221  13.033  15.069
  139    HD3  PRO  22           HD3      PRO  22  -0.177  14.036  15.516
  140    H    LEU  23           H        LEU  23   0.536  15.391  10.218
  141    HA   LEU  23           HA       LEU  23   1.319  12.915   9.119
  142    HB2  LEU  23           HB2      LEU  23   0.716  15.509   7.681
  143    HB3  LEU  23           HB3      LEU  23   0.878  13.942   6.905
  144    HG   LEU  23           HG       LEU  23  -1.274  14.650   8.944
  145   HD11  LEU  23          HD11      LEU  23  -1.625  15.887   6.863
  146   HD12  LEU  23          HD12      LEU  23  -2.851  14.638   7.058
  147   HD13  LEU  23          HD13      LEU  23  -1.516  14.392   5.929
  148   HD21  LEU  23          HD21      LEU  23  -2.323  12.511   8.301
  149   HD22  LEU  23          HD22      LEU  23  -0.722  12.249   8.986
  150   HD23  LEU  23          HD23      LEU  23  -0.960  12.146   7.239
  151    H    SER  24           H        SER  24   3.317  12.268   9.043
  152    HA   SER  24           HA       SER  24   5.354  11.882   8.269
  153    HB2  SER  24           HB2      SER  24   4.651  12.718   6.088
  154    HB3  SER  24           HB3      SER  24   5.022  14.375   6.566
  155    HG   SER  24           HG       SER  24   7.031  14.018   6.129
  156    H    LEU  25           H        LEU  25   7.169  12.043   9.447
  157    HA   LEU  25           HA       LEU  25   7.884  14.578  10.812
  158    HB2  LEU  25           HB2      LEU  25   7.455  12.514  12.166
  159    HB3  LEU  25           HB3      LEU  25   8.796  11.719  11.375
  160    HG   LEU  25           HG       LEU  25   9.315  14.275  12.925
  161   HD11  LEU  25          HD11      LEU  25   9.669  13.022  15.012
  162   HD12  LEU  25          HD12      LEU  25   9.070  11.549  14.243
  163   HD13  LEU  25          HD13      LEU  25   7.991  12.923  14.482
  164   HD21  LEU  25          HD21      LEU  25  11.018  11.790  12.498
  165   HD22  LEU  25          HD22      LEU  25  11.515  13.250  13.358
  166   HD23  LEU  25          HD23      LEU  25  11.178  13.321  11.633
  167    H    LEU  26           H        LEU  26   9.465  11.849   9.139
  168    HA   LEU  26           HA       LEU  26  11.793  13.563   8.430
  169    HB2  LEU  26           HB2      LEU  26  11.806  11.281   9.963
  170    HB3  LEU  26           HB3      LEU  26  12.001  10.553   8.387
  171    HG   LEU  26           HG       LEU  26  13.889  12.617   9.596
  172   HD11  LEU  26          HD11      LEU  26  15.463  10.752   9.939
  173   HD12  LEU  26          HD12      LEU  26  14.238   9.615   9.370
  174   HD13  LEU  26          HD13      LEU  26  13.972  10.526  10.855
  175   HD21  LEU  26          HD21      LEU  26  13.951  12.673   7.135
  176   HD22  LEU  26          HD22      LEU  26  14.250  10.933   7.092
  177   HD23  LEU  26          HD23      LEU  26  15.451  12.022   7.794
  178    H    ASP  27           H        ASP  27   9.297  13.462   6.907
  179    HA   ASP  27           HA       ASP  27   8.291  12.981   4.934
  180    HB2  ASP  27           HB2      ASP  27  11.178  13.079   3.964
  181    HB3  ASP  27           HB3      ASP  27   9.789  13.042   2.880
  182    H    ASP  28           H        ASP  28   8.471  10.866   6.559
  183    HA   ASP  28           HA       ASP  28   9.643   8.482   5.662
  184    HB2  ASP  28           HB2      ASP  28   7.040   8.656   7.231
  185    HB3  ASP  28           HB3      ASP  28   8.248   7.376   7.299
  186    H    MET  29           H        MET  29   6.520   9.932   4.966
  187    HA   MET  29           HA       MET  29   5.187   8.003   3.490
  188    HB2  MET  29           HB2      MET  29   3.992   9.960   4.076
  189    HB3  MET  29           HB3      MET  29   5.230  11.033   3.445
  190    HG2  MET  29           HG2      MET  29   4.509  10.748   1.221
  191    HG3  MET  29           HG3      MET  29   3.606   9.285   1.602
  192    HE1  MET  29           HE1      MET  29   0.426  10.577   3.333
  193    HE2  MET  29           HE2      MET  29   1.877   9.835   4.018
  194    HE3  MET  29           HE3      MET  29   1.193   9.220   2.508
  195    H    ASN  30           H        ASN  30   7.639  10.335   2.334
  196    HA   ASN  30           HA       ASN  30   7.498   9.671  -0.424
  197    HB2  ASN  30           HB2      ASN  30   8.460  11.795   0.472
  198    HB3  ASN  30           HB3      ASN  30   9.829  10.888   1.114
  199   HD21  ASN  30          HD21      ASN  30  11.448  10.204  -0.326
  200   HD22  ASN  30          HD22      ASN  30  11.501  10.715  -1.974
  201    H    HIS  31           H        HIS  31   9.590   8.483   2.221
  202    HA   HIS  31           HA       HIS  31  11.239   6.730   0.736
  203    HB2  HIS  31           HB2      HIS  31  10.323   6.553   3.640
  204    HB3  HIS  31           HB3      HIS  31  11.569   5.520   2.943
  205    HD2  HIS  31           HD2      HIS  31  11.162   9.041   4.451
  206    HE1  HIS  31           HE1      HIS  31  15.130   8.654   3.060
  207    HE2  HIS  31           HE2      HIS  31  13.463  10.180   4.187
  208    H    CYS  32           H        CYS  32   8.092   6.221   2.285
  209    HA   CYS  32           HA       CYS  32   7.849   3.434   1.887
  210    HB2  CYS  32           HB2      CYS  32   5.671   5.521   2.265
  211    HB3  CYS  32           HB3      CYS  32   5.439   3.778   2.407
  212    HG   CYS  32           HG       CYS  32   7.844   5.092   4.353
  213    H    TYR  33           H        TYR  33   6.551   6.171  -0.027
  214    HA   TYR  33           HA       TYR  33   5.160   4.665  -1.965
  215    HB2  TYR  33           HB2      TYR  33   6.175   7.508  -1.862
  216    HB3  TYR  33           HB3      TYR  33   5.507   6.892  -3.370
  217    HD1  TYR  33           HD1      TYR  33   3.244   5.302  -2.659
  218    HD2  TYR  33           HD2      TYR  33   4.550   8.938  -0.833
  219    HE1  TYR  33           HE1      TYR  33   0.945   5.792  -1.998
  220    HE2  TYR  33           HE2      TYR  33   2.243   9.410  -0.157
  221    HH   TYR  33           HH       TYR  33  -0.008   8.837  -0.842
  222    H    SER  34           H        SER  34   8.544   5.680  -1.878
  223    HA   SER  34           HA       SER  34   9.313   4.908  -4.494
  224    HB2  SER  34           HB2      SER  34  10.941   4.914  -1.915
  225    HB3  SER  34           HB3      SER  34  11.627   4.756  -3.534
  226    HG   SER  34           HG       SER  34  10.197   6.977  -2.483
  227    H    ARG  35           H        ARG  35   9.455   3.108  -1.406
  228    HA   ARG  35           HA       ARG  35  10.408   0.654  -2.433
  229    HB2  ARG  35           HB2      ARG  35  10.652   1.446  -0.109
  230    HB3  ARG  35           HB3      ARG  35   8.920   1.241   0.146
  231    HG2  ARG  35           HG2      ARG  35   9.058  -1.058   0.247
  232    HG3  ARG  35           HG3      ARG  35  10.453  -1.139  -0.827
  233    HD2  ARG  35           HD2      ARG  35  11.009  -1.813   1.461
  234    HD3  ARG  35           HD3      ARG  35  11.926  -0.402   0.964
  235    HE   ARG  35           HE       ARG  35  10.184   0.905   2.274
  236   HH11  ARG  35          HH11      ARG  35  11.008  -2.326   3.220
  237   HH12  ARG  35          HH12      ARG  35  10.653  -2.020   4.882
  238   HH21  ARG  35          HH21      ARG  35   9.791   1.257   4.385
  239   HH22  ARG  35          HH22      ARG  35   9.980  -0.024   5.532
  240    H    LEU  36           H        LEU  36   7.089   1.871  -1.971
  241    HA   LEU  36           HA       LEU  36   5.646  -0.508  -2.425
  242    HB2  LEU  36           HB2      LEU  36   4.926   2.389  -2.998
  243    HB3  LEU  36           HB3      LEU  36   3.798   1.075  -3.277
  244    HG   LEU  36           HG       LEU  36   4.960   1.845  -0.569
  245   HD11  LEU  36          HD11      LEU  36   2.692   2.600  -0.008
  246   HD12  LEU  36          HD12      LEU  36   2.163   2.253  -1.656
  247   HD13  LEU  36          HD13      LEU  36   3.364   3.511  -1.361
  248   HD21  LEU  36          HD21      LEU  36   4.515  -0.582  -0.684
  249   HD22  LEU  36          HD22      LEU  36   2.866  -0.267  -1.230
  250   HD23  LEU  36          HD23      LEU  36   3.371   0.219   0.391
  251    H    ARG  37           H        ARG  37   6.555   2.057  -4.772
  252    HA   ARG  37           HA       ARG  37   5.568   0.835  -7.113
  253    HB2  ARG  37           HB2      ARG  37   7.667   2.966  -6.669
  254    HB3  ARG  37           HB3      ARG  37   7.236   2.423  -8.289
  255    HG2  ARG  37           HG2      ARG  37   4.884   3.083  -7.888
  256    HG3  ARG  37           HG3      ARG  37   5.315   3.636  -6.271
  257    HD2  ARG  37           HD2      ARG  37   6.519   4.768  -8.815
  258    HD3  ARG  37           HD3      ARG  37   5.116   5.450  -7.997
  259    HE   ARG  37           HE       ARG  37   7.295   5.191  -6.195
  260   HH11  ARG  37          HH11      ARG  37   6.184   7.250  -8.773
  261   HH12  ARG  37          HH12      ARG  37   7.075   8.604  -8.186
  262   HH21  ARG  37          HH21      ARG  37   8.387   6.975  -5.502
  263   HH22  ARG  37          HH22      ARG  37   8.277   8.449  -6.391
  264    H    GLU  38           H        GLU  38   8.414   0.048  -5.333
  265    HA   GLU  38           HA       GLU  38   9.819  -1.229  -7.554
  266    HB2  GLU  38           HB2      GLU  38  10.430  -1.140  -4.567
  267    HB3  GLU  38           HB3      GLU  38  11.467  -1.910  -5.769
  268    HG2  GLU  38           HG2      GLU  38  11.763   0.297  -6.898
  269    HG3  GLU  38           HG3      GLU  38  10.779   1.047  -5.648
  270    H    LEU  39           H        LEU  39   7.826  -2.157  -4.780
  271    HA   LEU  39           HA       LEU  39   8.087  -5.016  -5.170
  272    HB2  LEU  39           HB2      LEU  39   6.136  -3.393  -3.494
  273    HB3  LEU  39           HB3      LEU  39   6.263  -5.146  -3.451
  274    HG   LEU  39           HG       LEU  39   8.547  -3.270  -2.704
  275   HD11  LEU  39          HD11      LEU  39   8.097  -3.802  -0.361
  276   HD12  LEU  39          HD12      LEU  39   6.680  -4.744  -0.827
  277   HD13  LEU  39          HD13      LEU  39   6.711  -3.002  -1.100
  278   HD21  LEU  39          HD21      LEU  39   8.260  -6.277  -2.328
  279   HD22  LEU  39          HD22      LEU  39   9.596  -5.287  -1.737
  280   HD23  LEU  39          HD23      LEU  39   9.339  -5.463  -3.469
  281    H    VAL  40           H        VAL  40   5.909  -2.505  -6.262
  282    HA   VAL  40           HA       VAL  40   3.938  -4.326  -7.411
  283    HB   VAL  40           HB       VAL  40   4.142  -1.285  -7.667
  284   HG11  VAL  40          HG11      VAL  40   1.797  -3.126  -8.301
  285   HG12  VAL  40          HG12      VAL  40   2.781  -2.254  -9.476
  286   HG13  VAL  40          HG13      VAL  40   1.758  -1.360  -8.352
  287   HG21  VAL  40          HG21      VAL  40   2.388  -1.193  -5.918
  288   HG22  VAL  40          HG22      VAL  40   3.881  -1.926  -5.327
  289   HG23  VAL  40          HG23      VAL  40   2.492  -2.948  -5.725
  290    HA   PRO  41           HA       PRO  41   6.606  -4.462 -11.156
  291    HB2  PRO  41           HB2      PRO  41   4.737  -6.565 -12.118
  292    HB3  PRO  41           HB3      PRO  41   6.464  -6.682 -11.766
  293    HG2  PRO  41           HG2      PRO  41   4.625  -7.862 -10.176
  294    HG3  PRO  41           HG3      PRO  41   6.110  -7.149  -9.508
  295    HD2  PRO  41           HD2      PRO  41   3.331  -5.948  -9.624
  296    HD3  PRO  41           HD3      PRO  41   4.456  -6.041  -8.245
  297    H    GLY  42           H        GLY  42   3.330  -3.546 -10.914
  298    HA2  GLY  42           HA2      GLY  42   2.673  -3.410 -13.741
  299    HA3  GLY  42           HA3      GLY  42   1.666  -2.916 -12.398
  300    H    VAL  43           H        VAL  43   4.923  -1.613 -12.740
  301    HA   VAL  43           HA       VAL  43   3.860   1.055 -13.380
  302    HB   VAL  43           HB       VAL  43   6.731   0.265 -12.674
  303   HG11  VAL  43          HG11      VAL  43   7.078   2.686 -12.238
  304   HG12  VAL  43          HG12      VAL  43   5.438   3.028 -12.797
  305   HG13  VAL  43          HG13      VAL  43   6.639   2.386 -13.920
  306   HG21  VAL  43          HG21      VAL  43   5.223  -0.227 -10.795
  307   HG22  VAL  43          HG22      VAL  43   4.571   1.411 -10.855
  308   HG23  VAL  43          HG23      VAL  43   6.259   1.149 -10.407
  309    HA   PRO  44           HA       PRO  44   5.222   0.391 -17.722
  310    HB2  PRO  44           HB2      PRO  44   4.354   3.208 -18.130
  311    HB3  PRO  44           HB3      PRO  44   3.772   1.736 -18.916
  312    HG2  PRO  44           HG2      PRO  44   2.246   3.059 -17.125
  313    HG3  PRO  44           HG3      PRO  44   2.226   1.284 -17.219
  314    HD2  PRO  44           HD2      PRO  44   3.717   3.057 -15.270
  315    HD3  PRO  44           HD3      PRO  44   2.740   1.603 -14.945
  316    H    ARG  45           H        ARG  45   7.182   0.809 -18.703
  317    HA   ARG  45           HA       ARG  45   9.208   2.306 -17.425
  318    HB2  ARG  45           HB2      ARG  45  10.639   1.818 -19.406
  319    HB3  ARG  45           HB3      ARG  45   9.878   0.393 -18.731
  320    HG2  ARG  45           HG2      ARG  45   8.703   1.770 -21.159
  321    HG3  ARG  45           HG3      ARG  45  10.036   0.632 -21.322
  322    HD2  ARG  45           HD2      ARG  45   7.316   0.005 -20.113
  323    HD3  ARG  45           HD3      ARG  45   7.849  -0.448 -21.735
  324    HE   ARG  45           HE       ARG  45   9.701  -1.698 -20.448
  325   HH11  ARG  45          HH11      ARG  45   6.460  -1.410 -19.209
  326   HH12  ARG  45          HH12      ARG  45   6.549  -2.929 -18.402
  327   HH21  ARG  45          HH21      ARG  45   9.731  -3.622 -19.440
  328   HH22  ARG  45          HH22      ARG  45   8.361  -4.154 -18.522
  329    H    GLY  46           H        GLY  46   9.428   4.442 -17.342
  330    HA2  GLY  46           HA2      GLY  46   9.936   6.548 -18.394
  331    HA3  GLY  46           HA3      GLY  46   8.836   6.153 -19.703
  332    H    THR  47           H        THR  47   7.648   5.462 -16.511
  333    HA   THR  47           HA       THR  47   6.025   7.967 -16.493
  334    HB   THR  47           HB       THR  47   4.291   6.740 -15.202
  335    HG1  THR  47           HG1      THR  47   6.150   4.629 -15.382
  336   HG21  THR  47          HG21      THR  47   3.436   5.285 -17.002
  337   HG22  THR  47          HG22      THR  47   5.010   5.324 -17.795
  338   HG23  THR  47          HG23      THR  47   4.053   6.802 -17.659
  339    H    GLN  48           H        GLN  48   5.991   9.211 -14.687
  340    HA   GLN  48           HA       GLN  48   7.692   8.560 -12.387
  341    HB2  GLN  48           HB2      GLN  48   7.326  10.909 -13.616
  342    HB3  GLN  48           HB3      GLN  48   5.930  11.039 -12.567
  343    HG2  GLN  48           HG2      GLN  48   8.825  10.791 -11.684
  344    HG3  GLN  48           HG3      GLN  48   7.867  12.263 -11.688
  345   HE21  GLN  48          HE21      GLN  48   6.142  12.422 -10.152
  346   HE22  GLN  48          HE22      GLN  48   6.171  11.503  -8.689
  347    H    LEU  49           H        LEU  49   4.263   9.076 -13.151
  348    HA   LEU  49           HA       LEU  49   2.288   8.527 -12.239
  349    HB2  LEU  49           HB2      LEU  49   3.818   6.757 -10.300
  350    HB3  LEU  49           HB3      LEU  49   2.084   6.719 -10.565
  351    HG   LEU  49           HG       LEU  49   4.202   5.944 -12.619
  352   HD11  LEU  49          HD11      LEU  49   3.997   4.302 -10.789
  353   HD12  LEU  49          HD12      LEU  49   3.435   3.651 -12.327
  354   HD13  LEU  49          HD13      LEU  49   2.265   4.164 -11.108
  355   HD21  LEU  49          HD21      LEU  49   2.331   5.168 -14.020
  356   HD22  LEU  49          HD22      LEU  49   2.244   6.904 -13.738
  357   HD23  LEU  49          HD23      LEU  49   1.175   5.814 -12.851
  358    H    SER  50           H        SER  50   0.857   9.368 -10.710
  359    HA   SER  50           HA       SER  50   1.918  11.399  -8.921
  360    HB2  SER  50           HB2      SER  50  -0.361  12.143  -8.628
  361    HB3  SER  50           HB3      SER  50  -0.195  11.714 -10.328
  362    HG   SER  50           HG       SER  50  -1.794  10.410 -10.030
  363    H    GLN  51           H        GLN  51   1.163  11.619  -6.686
  364    HA   GLN  51           HA       GLN  51   1.839   9.523  -5.011
  365    HB2  GLN  51           HB2      GLN  51   1.830  11.967  -4.450
  366    HB3  GLN  51           HB3      GLN  51   0.075  11.915  -4.323
  367    HG2  GLN  51           HG2      GLN  51   0.252  10.339  -2.444
  368    HG3  GLN  51           HG3      GLN  51   2.003  10.339  -2.601
  369   HE21  GLN  51          HE21      GLN  51   3.170  12.126  -1.835
  370   HE22  GLN  51          HE22      GLN  51   2.457  13.332  -0.830
  371    H    VAL  52           H        VAL  52  -1.417  10.450  -6.124
  372    HA   VAL  52           HA       VAL  52  -2.834   8.584  -4.439
  373    HB   VAL  52           HB       VAL  52  -3.989   9.870  -6.956
  374   HG11  VAL  52          HG11      VAL  52  -5.376   8.118  -5.930
  375   HG12  VAL  52          HG12      VAL  52  -6.137   9.693  -5.714
  376   HG13  VAL  52          HG13      VAL  52  -5.291   8.931  -4.363
  377   HG21  VAL  52          HG21      VAL  52  -4.732  11.779  -5.546
  378   HG22  VAL  52          HG22      VAL  52  -2.973  11.684  -5.647
  379   HG23  VAL  52          HG23      VAL  52  -3.801  11.132  -4.190
  380    H    GLU  53           H        GLU  53  -1.763   8.569  -7.864
  381    HA   GLU  53           HA       GLU  53  -3.017   6.264  -8.815
  382    HB2  GLU  53           HB2      GLU  53  -0.323   7.470  -9.519
  383    HB3  GLU  53           HB3      GLU  53  -0.886   6.003 -10.313
  384    HG2  GLU  53           HG2      GLU  53  -2.896   7.270 -11.107
  385    HG3  GLU  53           HG3      GLU  53  -2.192   8.736 -10.425
  386    H    ILE  54           H        ILE  54   0.029   6.548  -7.019
  387    HA   ILE  54           HA       ILE  54   0.955   3.923  -7.175
  388    HB   ILE  54           HB       ILE  54   1.258   5.823  -4.806
  389   HG12  ILE  54          HG12      ILE  54   3.123   5.471  -7.209
  390   HG13  ILE  54          HG13      ILE  54   1.985   6.798  -7.027
  391   HG21  ILE  54          HG21      ILE  54   1.902   3.541  -4.185
  392   HG22  ILE  54          HG22      ILE  54   3.346   4.544  -4.314
  393   HG23  ILE  54          HG23      ILE  54   2.946   3.412  -5.608
  394   HD11  ILE  54          HD11      ILE  54   4.343   6.228  -5.235
  395   HD12  ILE  54          HD12      ILE  54   3.199   7.561  -5.038
  396   HD13  ILE  54          HD13      ILE  54   4.229   7.485  -6.468
  397    H    LEU  55           H        LEU  55  -1.146   5.391  -4.666
  398    HA   LEU  55           HA       LEU  55  -1.556   3.237  -2.956
  399    HB2  LEU  55           HB2      LEU  55  -3.476   5.447  -3.770
  400    HB3  LEU  55           HB3      LEU  55  -3.759   4.372  -2.411
  401    HG   LEU  55           HG       LEU  55  -1.432   6.313  -2.634
  402   HD11  LEU  55          HD11      LEU  55  -2.577   7.608  -0.889
  403   HD12  LEU  55          HD12      LEU  55  -3.952   6.505  -0.952
  404   HD13  LEU  55          HD13      LEU  55  -3.557   7.507  -2.350
  405   HD21  LEU  55          HD21      LEU  55  -1.022   5.738  -0.271
  406   HD22  LEU  55          HD22      LEU  55  -0.833   4.339  -1.325
  407   HD23  LEU  55          HD23      LEU  55  -2.294   4.515  -0.343
  408    H    GLN  56           H        GLN  56  -3.527   4.184  -5.742
  409    HA   GLN  56           HA       GLN  56  -5.517   2.188  -5.607
  410    HB2  GLN  56           HB2      GLN  56  -4.490   3.737  -8.031
  411    HB3  GLN  56           HB3      GLN  56  -6.044   2.911  -7.930
  412    HG2  GLN  56           HG2      GLN  56  -6.860   4.466  -6.288
  413    HG3  GLN  56           HG3      GLN  56  -5.263   5.181  -6.077
  414   HE21  GLN  56          HE21      GLN  56  -7.732   6.536  -6.740
  415   HE22  GLN  56          HE22      GLN  56  -7.478   7.309  -8.260
  416    H    ARG  57           H        ARG  57  -2.450   2.370  -7.339
  417    HA   ARG  57           HA       ARG  57  -2.757  -0.047  -8.869
  418    HB2  ARG  57           HB2      ARG  57  -1.543   2.070  -9.546
  419    HB3  ARG  57           HB3      ARG  57  -0.266   1.637  -8.423
  420    HG2  ARG  57           HG2      ARG  57   0.476  -0.151  -9.768
  421    HG3  ARG  57           HG3      ARG  57  -1.060  -0.266 -10.629
  422    HD2  ARG  57           HD2      ARG  57   0.888   2.064 -10.889
  423    HD3  ARG  57           HD3      ARG  57   0.760   0.720 -12.028
  424    HE   ARG  57           HE       ARG  57  -1.595   1.453 -12.406
  425   HH11  ARG  57          HH11      ARG  57   0.606   3.866 -11.224
  426   HH12  ARG  57          HH12      ARG  57  -0.265   5.153 -11.985
  427   HH21  ARG  57          HH21      ARG  57  -2.671   3.126 -13.310
  428   HH22  ARG  57          HH22      ARG  57  -2.090   4.747 -13.124
  429    H    VAL  58           H        VAL  58  -1.338   0.738  -5.757
  430    HA   VAL  58           HA       VAL  58   0.075  -1.723  -5.318
  431    HB   VAL  58           HB       VAL  58  -1.006   0.347  -3.333
  432   HG11  VAL  58          HG11      VAL  58  -0.937  -1.823  -2.172
  433   HG12  VAL  58          HG12      VAL  58   0.338  -0.770  -1.564
  434   HG13  VAL  58          HG13      VAL  58   0.732  -2.073  -2.689
  435   HG21  VAL  58          HG21      VAL  58   0.897   1.124  -4.712
  436   HG22  VAL  58          HG22      VAL  58   1.857  -0.258  -4.190
  437   HG23  VAL  58          HG23      VAL  58   1.365   0.968  -3.019
  438    H    ILE  59           H        ILE  59  -3.254  -0.598  -4.692
  439    HA   ILE  59           HA       ILE  59  -4.195  -2.864  -3.279
  440    HB   ILE  59           HB       ILE  59  -5.782  -0.943  -5.049
  441   HG12  ILE  59          HG12      ILE  59  -5.445  -0.919  -2.007
  442   HG13  ILE  59          HG13      ILE  59  -4.497   0.082  -3.096
  443   HG21  ILE  59          HG21      ILE  59  -7.782  -1.693  -3.766
  444   HG22  ILE  59          HG22      ILE  59  -6.795  -2.891  -2.931
  445   HG23  ILE  59          HG23      ILE  59  -7.058  -3.023  -4.670
  446   HD11  ILE  59          HD11      ILE  59  -7.484   0.214  -2.740
  447   HD12  ILE  59          HD12      ILE  59  -6.517   1.238  -3.806
  448   HD13  ILE  59          HD13      ILE  59  -6.293   1.321  -2.060
  449    H    ASP  60           H        ASP  60  -4.282  -2.106  -6.801
  450    HA   ASP  60           HA       ASP  60  -5.488  -4.439  -7.774
  451    HB2  ASP  60           HB2      ASP  60  -3.292  -2.768  -9.077
  452    HB3  ASP  60           HB3      ASP  60  -4.252  -3.980  -9.924
  453    H    TYR  61           H        TYR  61  -2.061  -3.808  -7.130
  454    HA   TYR  61           HA       TYR  61  -0.915  -6.260  -7.792
  455    HB2  TYR  61           HB2      TYR  61   0.532  -4.434  -7.376
  456    HB3  TYR  61           HB3      TYR  61  -0.225  -4.049  -5.843
  457    HD1  TYR  61           HD1      TYR  61   1.931  -6.651  -7.493
  458    HD2  TYR  61           HD2      TYR  61   0.784  -4.772  -3.820
  459    HE1  TYR  61           HE1      TYR  61   3.742  -7.825  -6.316
  460    HE2  TYR  61           HE2      TYR  61   2.602  -5.939  -2.664
  461    HH   TYR  61           HH       TYR  61   3.941  -7.926  -2.912
  462    H    ILE  62           H        ILE  62  -2.360  -5.258  -4.662
  463    HA   ILE  62           HA       ILE  62  -1.736  -7.702  -3.290
  464    HB   ILE  62           HB       ILE  62  -3.753  -5.548  -2.479
  465   HG12  ILE  62          HG12      ILE  62  -0.833  -5.878  -1.604
  466   HG13  ILE  62          HG13      ILE  62  -1.402  -4.673  -2.750
  467   HG21  ILE  62          HG21      ILE  62  -2.429  -7.702  -0.776
  468   HG22  ILE  62          HG22      ILE  62  -4.125  -7.671  -1.261
  469   HG23  ILE  62          HG23      ILE  62  -3.501  -6.431  -0.177
  470   HD11  ILE  62          HD11      ILE  62  -2.748  -3.631  -0.978
  471   HD12  ILE  62          HD12      ILE  62  -1.035  -3.696  -0.568
  472   HD13  ILE  62          HD13      ILE  62  -2.156  -4.838   0.170
  473    H    LEU  63           H        LEU  63  -4.486  -6.676  -5.271
  474    HA   LEU  63           HA       LEU  63  -6.458  -8.521  -4.447
  475    HB2  LEU  63           HB2      LEU  63  -5.961  -7.323  -7.199
  476    HB3  LEU  63           HB3      LEU  63  -7.396  -8.250  -6.790
  477    HG   LEU  63           HG       LEU  63  -6.606  -5.596  -5.526
  478   HD11  LEU  63          HD11      LEU  63  -7.311  -5.296  -7.849
  479   HD12  LEU  63          HD12      LEU  63  -8.506  -4.631  -6.738
  480   HD13  LEU  63          HD13      LEU  63  -8.806  -6.182  -7.526
  481   HD21  LEU  63          HD21      LEU  63  -8.830  -5.634  -4.460
  482   HD22  LEU  63          HD22      LEU  63  -7.834  -6.981  -3.920
  483   HD23  LEU  63          HD23      LEU  63  -9.115  -7.255  -5.103
  484    H    ASP  64           H        ASP  64  -3.927  -8.851  -6.938
  485    HA   ASP  64           HA       ASP  64  -4.480 -11.502  -7.749
  486    HB2  ASP  64           HB2      ASP  64  -1.941  -9.822  -7.827
  487    HB3  ASP  64           HB3      ASP  64  -2.032 -11.432  -8.535
  488    H    LEU  65           H        LEU  65  -2.576 -10.250  -5.060
  489    HA   LEU  65           HA       LEU  65  -1.381 -12.742  -4.273
  490    HB2  LEU  65           HB2      LEU  65  -1.830 -10.225  -2.624
  491    HB3  LEU  65           HB3      LEU  65  -0.729 -11.535  -2.224
  492    HG   LEU  65           HG       LEU  65  -0.457  -9.649  -4.599
  493   HD11  LEU  65          HD11      LEU  65   0.061  -8.533  -2.489
  494   HD12  LEU  65          HD12      LEU  65   1.515  -8.755  -3.460
  495   HD13  LEU  65          HD13      LEU  65   1.212  -9.808  -2.077
  496   HD21  LEU  65          HD21      LEU  65   1.415 -11.876  -3.733
  497   HD22  LEU  65          HD22      LEU  65   1.709 -10.718  -5.031
  498   HD23  LEU  65          HD23      LEU  65   0.390 -11.877  -5.172
  499    H    GLN  66           H        GLN  66  -4.362 -11.062  -3.430
  500    HA   GLN  66           HA       GLN  66  -5.080 -12.899  -1.277
  501    HB2  GLN  66           HB2      GLN  66  -6.614 -10.560  -2.494
  502    HB3  GLN  66           HB3      GLN  66  -7.178 -11.505  -1.122
  503    HG2  GLN  66           HG2      GLN  66  -4.652  -9.829  -1.181
  504    HG3  GLN  66           HG3      GLN  66  -6.186  -9.354  -0.442
  505   HE21  GLN  66          HE21      GLN  66  -6.811 -10.343   1.502
  506   HE22  GLN  66          HE22      GLN  66  -5.702 -11.237   2.476
  507    H    VAL  67           H        VAL  67  -7.297 -11.798  -3.852
  508    HA   VAL  67           HA       VAL  67  -7.902 -14.579  -4.646
  509    HB   VAL  67           HB       VAL  67 -10.072 -12.569  -3.841
  510   HG11  VAL  67          HG11      VAL  67 -10.818 -13.965  -5.711
  511   HG12  VAL  67          HG12      VAL  67 -11.679 -14.424  -4.243
  512   HG13  VAL  67          HG13      VAL  67 -10.358 -15.431  -4.839
  513   HG21  VAL  67          HG21      VAL  67  -8.991 -13.505  -1.838
  514   HG22  VAL  67          HG22      VAL  67  -9.253 -15.144  -2.433
  515   HG23  VAL  67          HG23      VAL  67 -10.633 -14.132  -1.997
  516    H    VAL  68           H        VAL  68  -7.772 -14.677  -6.816
  517    HA   VAL  68           HA       VAL  68  -8.032 -12.288  -8.469
  518    HB   VAL  68           HB       VAL  68  -7.438 -13.865 -10.402
  519   HG11  VAL  68          HG11      VAL  68  -5.765 -12.406  -9.358
  520   HG12  VAL  68          HG12      VAL  68  -5.038 -13.950  -9.797
  521   HG13  VAL  68          HG13      VAL  68  -5.446 -13.617  -8.112
  522   HG21  VAL  68          HG21      VAL  68  -8.102 -16.022  -9.397
  523   HG22  VAL  68          HG22      VAL  68  -6.867 -15.843  -8.151
  524   HG23  VAL  68          HG23      VAL  68  -6.393 -16.043  -9.839
  525    H1   MET   1           H1       MET   1   7.689   3.573 -31.508
  526    H2   MET   1           H2       MET   1   6.975   5.024 -31.017
  527    H3   MET   1           H3       MET   1   6.018   3.781 -31.650
  528    HA   MET   1           HA       MET   1   6.472   2.375 -29.803
  529    HB2  MET   1           HB2      MET   1   8.253   4.669 -28.882
  530    HB3  MET   1           HB3      MET   1   7.744   3.367 -27.810
  531    HG2  MET   1           HG2      MET   1   9.393   3.024 -30.327
  532    HG3  MET   1           HG3      MET   1  10.003   2.982 -28.670
  533    HE1  MET   1           HE1      MET   1  11.135   0.589 -28.985
  534    HE2  MET   1           HE2      MET   1  10.639   0.603 -30.679
  535    HE3  MET   1           HE3      MET   1  10.293  -0.801 -29.669
  536    H    GLY   2           H        GLY   2   5.480   2.586 -27.631
  537    HA2  GLY   2           HA2      GLY   2   4.200   4.677 -26.437
  538    HA3  GLY   2           HA3      GLY   2   3.080   4.191 -27.708
  539    H    HIS   3           H        HIS   3   5.234   2.259 -25.650
  540    HA   HIS   3           HA       HIS   3   5.012   0.411 -24.403
  541    HB2  HIS   3           HB2      HIS   3   2.345   1.662 -23.657
  542    HB3  HIS   3           HB3      HIS   3   3.014   0.247 -22.851
  543    HD2  HIS   3           HD2      HIS   3   5.648   0.820 -21.629
  544    HE1  HIS   3           HE1      HIS   3   4.563   4.858 -21.011
  545    HE2  HIS   3           HE2      HIS   3   6.317   3.095 -20.590
  546    H    HIS   4           H        HIS   4   5.101  -0.994 -26.157
  547    HA   HIS   4           HA       HIS   4   2.872  -1.944 -27.644
  548    HB2  HIS   4           HB2      HIS   4   4.484  -3.777 -28.371
  549    HB3  HIS   4           HB3      HIS   4   5.050  -2.131 -28.635
  550    HD2  HIS   4           HD2      HIS   4   6.079  -5.327 -26.729
  551    HE1  HIS   4           HE1      HIS   4   8.851  -2.270 -25.798
  552    HE2  HIS   4           HE2      HIS   4   8.332  -4.735 -25.602
  553    H    HIS   5           H        HIS   5   1.536  -3.710 -27.367
  554    HA   HIS   5           HA       HIS   5   1.304  -4.761 -24.658
  555    HB2  HIS   5           HB2      HIS   5  -0.672  -3.880 -25.957
  556    HB3  HIS   5           HB3      HIS   5  -0.509  -5.232 -27.070
  557    HD2  HIS   5           HD2      HIS   5  -1.855  -7.483 -26.318
  558    HE1  HIS   5           HE1      HIS   5  -2.708  -6.264 -22.359
  559    HE2  HIS   5           HE2      HIS   5  -2.917  -8.132 -24.046
  560    H    HIS   6           H        HIS   6   3.374  -5.948 -24.906
  561    HA   HIS   6           HA       HIS   6   2.982  -8.691 -25.985
  562    HB2  HIS   6           HB2      HIS   6   5.491  -6.962 -26.113
  563    HB3  HIS   6           HB3      HIS   6   5.552  -8.712 -26.297
  564    HD2  HIS   6           HD2      HIS   6   4.033  -5.620 -28.228
  565    HE1  HIS   6           HE1      HIS   6   4.531  -8.893 -30.863
  566    HE2  HIS   6           HE2      HIS   6   3.773  -6.490 -30.655
  567    H    HIS   7           H        HIS   7   4.446 -10.301 -24.931
  568    HA   HIS   7           HA       HIS   7   4.145 -10.127 -22.044
  569    HB2  HIS   7           HB2      HIS   7   5.220 -12.426 -23.741
  570    HB3  HIS   7           HB3      HIS   7   4.671 -12.519 -22.068
  571    HD2  HIS   7           HD2      HIS   7   1.904 -12.658 -21.715
  572    HE1  HIS   7           HE1      HIS   7   0.971 -12.671 -25.842
  573    HE2  HIS   7           HE2      HIS   7   0.104 -13.143 -23.515
  574    H    HIS   8           H        HIS   8   5.681  -8.916 -21.071
  575    HA   HIS   8           HA       HIS   8   8.565  -9.516 -21.508
  576    HB2  HIS   8           HB2      HIS   8   9.036  -7.198 -20.736
  577    HB3  HIS   8           HB3      HIS   8   8.009  -7.200 -22.165
  578    HD2  HIS   8           HD2      HIS   8   5.482  -6.120 -21.835
  579    HE1  HIS   8           HE1      HIS   8   5.931  -5.183 -17.738
  580    HE2  HIS   8           HE2      HIS   8   4.339  -5.214 -19.702
  581    H    SER   9           H        SER   9   9.865  -8.813 -19.469
  582    HA   SER   9           HA       SER   9   8.559  -9.634 -16.940
  583    HB2  SER   9           HB2      SER   9  10.581 -11.043 -16.419
  584    HB3  SER   9           HB3      SER   9   9.650 -11.646 -17.787
  585    HG   SER   9           HG       SER   9  11.785 -11.697 -18.371
  586    H    HIS  10           H        HIS  10   9.049  -7.018 -17.710
  587    HA   HIS  10           HA       HIS  10  11.140  -6.165 -15.782
  588    HB2  HIS  10           HB2      HIS  10  10.582  -4.923 -18.503
  589    HB3  HIS  10           HB3      HIS  10  11.575  -4.159 -17.268
  590    HD1  HIS  10           HD1      HIS  10  12.102  -5.736 -20.285
  591    HD2  HIS  10           HD2      HIS  10  13.694  -6.396 -16.499
  592    HE1  HIS  10           HE1      HIS  10  14.276  -6.916 -20.662
  593    HE2  HIS  10           HE2      HIS  10  15.149  -7.428 -18.363
  594    H    MET  11           H        MET  11  10.520  -4.675 -14.319
  595    HA   MET  11           HA       MET  11   7.913  -3.363 -14.386
  596    HB2  MET  11           HB2      MET  11   8.945  -4.300 -12.290
  597    HB3  MET  11           HB3      MET  11  10.233  -3.117 -12.405
  598    HG2  MET  11           HG2      MET  11   7.392  -2.166 -12.213
  599    HG3  MET  11           HG3      MET  11   8.193  -2.759 -10.761
  600    HE1  MET  11           HE1      MET  11  11.063  -0.196 -10.212
  601    HE2  MET  11           HE2      MET  11  11.151  -1.814 -10.908
  602    HE3  MET  11           HE3      MET  11  10.119  -1.509  -9.508
  603    H    GLY  12           H        GLY  12   8.061  -0.808 -13.791
  604    HA2  GLY  12           HA2      GLY  12   8.839   0.678 -15.962
  605    HA3  GLY  12           HA3      GLY  12   8.598   1.339 -14.359
  606    H    GLY  13           H        GLY  13  10.864  -0.052 -13.133
  607    HA2  GLY  13           HA2      GLY  13  13.290  -0.213 -14.183
  608    HA3  GLY  13           HA3      GLY  13  13.118   1.537 -14.173
  609    H    GLY  14           H        GLY  14  12.120   2.274 -11.905
  610    HA2  GLY  14           HA2      GLY  14  12.541   1.268  -9.451
  611    HA3  GLY  14           HA3      GLY  14  14.192   1.642  -9.934
  612    H    LYS  15           H        LYS  15  14.909   3.686  -9.579
  613    HA   LYS  15           HA       LYS  15  13.054   5.777  -8.672
  614    HB2  LYS  15           HB2      LYS  15  16.103   5.643  -8.707
  615    HB3  LYS  15           HB3      LYS  15  15.221   7.103  -8.282
  616    HG2  LYS  15           HG2      LYS  15  15.837   6.106  -6.230
  617    HG3  LYS  15           HG3      LYS  15  14.112   5.789  -6.420
  618    HD2  LYS  15           HD2      LYS  15  14.620   3.478  -7.150
  619    HD3  LYS  15           HD3      LYS  15  16.348   3.805  -6.990
  620    HE2  LYS  15           HE2      LYS  15  15.980   4.254  -4.541
  621    HE3  LYS  15           HE3      LYS  15  14.294   3.770  -4.748
  622    HZ1  LYS  15           HZ1      LYS  15  15.658   1.959  -3.913
  623    HZ2  LYS  15           HZ2      LYS  15  16.654   2.053  -5.275
  624    HZ3  LYS  15           HZ3      LYS  15  15.042   1.590  -5.440
  625    H    GLY  16           H        GLY  16  13.356   8.022  -9.485
  626    HA2  GLY  16           HA2      GLY  16  14.513   8.500 -12.096
  627    HA3  GLY  16           HA3      GLY  16  12.754   8.428 -12.122
  628    HA   PRO  17           HA       PRO  17  14.043  12.864 -11.131
  629    HB2  PRO  17           HB2      PRO  17  12.422  14.075 -13.000
  630    HB3  PRO  17           HB3      PRO  17  14.064  13.525 -13.350
  631    HG2  PRO  17           HG2      PRO  17  11.446  12.135 -13.917
  632    HG3  PRO  17           HG3      PRO  17  12.856  12.344 -14.983
  633    HD2  PRO  17           HD2      PRO  17  12.408  10.027 -13.647
  634    HD3  PRO  17           HD3      PRO  17  14.056  10.627 -13.937
  635    H    ALA  18           H        ALA  18  13.066  12.872  -9.145
  636    HA   ALA  18           HA       ALA  18  10.353  12.345  -8.570
  637    HB1  ALA  18           HB1      ALA  18  12.163  12.101  -6.924
  638    HB2  ALA  18           HB2      ALA  18  10.870  13.125  -6.304
  639    HB3  ALA  18           HB3      ALA  18  12.376  13.852  -6.874
  640    H    ALA  19           H        ALA  19   8.926  13.579  -9.756
  641    HA   ALA  19           HA       ALA  19   8.614  16.422  -9.012
  642    HB1  ALA  19           HB1      ALA  19   9.783  16.404 -11.171
  643    HB2  ALA  19           HB2      ALA  19   8.146  17.035 -11.355
  644    HB3  ALA  19           HB3      ALA  19   8.519  15.387 -11.866
  645    H    GLU  20           H        GLU  20   6.782  16.261  -7.873
  646    HA   GLU  20           HA       GLU  20   4.248  15.697  -9.064
  647    HB2  GLU  20           HB2      GLU  20   3.586  13.782  -7.606
  648    HB3  GLU  20           HB3      GLU  20   4.886  13.349  -8.714
  649    HG2  GLU  20           HG2      GLU  20   6.543  13.582  -6.916
  650    HG3  GLU  20           HG3      GLU  20   5.276  14.079  -5.792
  651    H    GLU  21           H        GLU  21   2.476  15.775  -7.348
  652    HA   GLU  21           HA       GLU  21   3.165  17.062  -4.819
  653    HB2  GLU  21           HB2      GLU  21   1.588  18.951  -5.157
  654    HB3  GLU  21           HB3      GLU  21   2.917  18.993  -6.310
  655    HG2  GLU  21           HG2      GLU  21   1.474  18.118  -8.081
  656    HG3  GLU  21           HG3      GLU  21   0.137  17.938  -6.947
  657    HA   PRO  22           HA       PRO  22  -0.435  14.656  -3.414
  658    HB2  PRO  22           HB2      PRO  22  -0.723  16.721  -1.251
  659    HB3  PRO  22           HB3      PRO  22  -0.497  14.971  -1.116
  660    HG2  PRO  22           HG2      PRO  22   1.514  16.649  -0.535
  661    HG3  PRO  22           HG3      PRO  22   1.822  15.111  -1.376
  662    HD2  PRO  22           HD2      PRO  22   1.621  17.899  -2.541
  663    HD3  PRO  22           HD3      PRO  22   2.826  16.629  -2.870
  664    H    LEU  23           H        LEU  23  -1.895  15.083  -5.115
  665    HA   LEU  23           HA       LEU  23  -3.322  17.537  -5.443
  666    HB2  LEU  23           HB2      LEU  23  -3.934  14.763  -6.516
  667    HB3  LEU  23           HB3      LEU  23  -4.753  16.228  -7.033
  668    HG   LEU  23           HG       LEU  23  -1.791  15.630  -7.438
  669   HD11  LEU  23          HD11      LEU  23  -4.039  15.668  -9.477
  670   HD12  LEU  23          HD12      LEU  23  -3.195  14.233  -8.888
  671   HD13  LEU  23          HD13      LEU  23  -2.322  15.442  -9.827
  672   HD21  LEU  23          HD21      LEU  23  -3.422  18.018  -8.380
  673   HD22  LEU  23          HD22      LEU  23  -1.753  17.671  -8.835
  674   HD23  LEU  23          HD23      LEU  23  -2.145  18.038  -7.159
  675    H    SER  24           H        SER  24  -4.644  14.329  -4.535
  676    HA   SER  24           HA       SER  24  -6.230  13.580  -3.135
  677    HB2  SER  24           HB2      SER  24  -6.182  16.329  -1.835
  678    HB3  SER  24           HB3      SER  24  -7.024  14.918  -1.190
  679    HG   SER  24           HG       SER  24  -4.614  15.562  -0.641
  680    H    LEU  25           H        LEU  25  -7.125  16.902  -4.135
  681    HA   LEU  25           HA       LEU  25  -8.808  17.793  -5.292
  682    HB2  LEU  25           HB2      LEU  25  -8.438  15.960  -6.900
  683    HB3  LEU  25           HB3      LEU  25  -9.551  14.935  -6.011
  684    HG   LEU  25           HG       LEU  25 -11.433  16.464  -6.601
  685   HD11  LEU  25          HD11      LEU  25 -10.212  18.582  -6.810
  686   HD12  LEU  25          HD12      LEU  25 -11.141  18.248  -8.267
  687   HD13  LEU  25          HD13      LEU  25  -9.396  17.990  -8.261
  688   HD21  LEU  25          HD21      LEU  25 -10.954  14.521  -8.033
  689   HD22  LEU  25          HD22      LEU  25  -9.861  15.500  -9.016
  690   HD23  LEU  25          HD23      LEU  25 -11.587  15.868  -8.976
  691    H    LEU  26           H        LEU  26 -10.521  14.855  -4.165
  692    HA   LEU  26           HA       LEU  26 -12.416  16.557  -2.636
  693    HB2  LEU  26           HB2      LEU  26 -13.216  15.109  -4.632
  694    HB3  LEU  26           HB3      LEU  26 -12.908  13.710  -3.625
  695    HG   LEU  26           HG       LEU  26 -14.864  15.905  -2.812
  696   HD11  LEU  26          HD11      LEU  26 -16.693  14.516  -3.671
  697   HD12  LEU  26          HD12      LEU  26 -15.530  13.351  -4.309
  698   HD13  LEU  26          HD13      LEU  26 -15.597  14.986  -4.969
  699   HD21  LEU  26          HD21      LEU  26 -14.600  13.024  -1.873
  700   HD22  LEU  26          HD22      LEU  26 -15.843  14.165  -1.352
  701   HD23  LEU  26          HD23      LEU  26 -14.155  14.468  -0.958
  702    H    ASP  27           H        ASP  27 -11.553  13.092  -2.464
  703    HA   ASP  27           HA       ASP  27 -10.113  13.254   0.037
  704    HB2  ASP  27           HB2      ASP  27 -12.537  13.442   0.760
  705    HB3  ASP  27           HB3      ASP  27 -12.862  11.889  -0.002
  706    H    ASP  28           H        ASP  28  -9.934  12.219  -2.788
  707    HA   ASP  28           HA       ASP  28 -10.675   9.535  -3.054
  708    HB2  ASP  28           HB2      ASP  28 -10.171  11.320  -4.874
  709    HB3  ASP  28           HB3      ASP  28  -8.483  10.836  -4.720
  710    H    MET  29           H        MET  29  -7.643  10.925  -1.935
  711    HA   MET  29           HA       MET  29  -5.958   8.677  -2.052
  712    HB2  MET  29           HB2      MET  29  -5.955  10.887   0.052
  713    HB3  MET  29           HB3      MET  29  -4.629   9.777  -0.274
  714    HG2  MET  29           HG2      MET  29  -4.748  10.781  -2.701
  715    HG3  MET  29           HG3      MET  29  -5.594  12.103  -1.901
  716    HE1  MET  29           HE1      MET  29  -2.276  10.063  -2.208
  717    HE2  MET  29           HE2      MET  29  -2.674   9.824  -0.504
  718    HE3  MET  29           HE3      MET  29  -1.272  10.795  -0.954
  719    H    ASN  30           H        ASN  30  -8.163   9.787   0.500
  720    HA   ASN  30           HA       ASN  30  -7.469   7.772   2.414
  721    HB2  ASN  30           HB2      ASN  30  -9.868   9.641   2.389
  722    HB3  ASN  30           HB3      ASN  30  -9.260   8.738   3.780
  723   HD21  ASN  30          HD21      ASN  30  -8.765  11.491   1.733
  724   HD22  ASN  30          HD22      ASN  30  -7.503  12.215   2.665
  725    H    HIS  31           H        HIS  31  -9.952   8.019  -0.080
  726    HA   HIS  31           HA       HIS  31 -11.481   5.726   0.585
  727    HB2  HIS  31           HB2      HIS  31 -10.891   7.061  -2.088
  728    HB3  HIS  31           HB3      HIS  31 -11.954   5.660  -1.958
  729    HD2  HIS  31           HD2      HIS  31 -11.990   9.475  -1.257
  730    HE1  HIS  31           HE1      HIS  31 -15.765   7.877  -0.245
  731    HE2  HIS  31           HE2      HIS  31 -14.349   9.968  -0.329
  732    H    CYS  32           H        CYS  32  -8.490   6.073  -1.328
  733    HA   CYS  32           HA       CYS  32  -8.075   3.308  -1.880
  734    HB2  CYS  32           HB2      CYS  32  -6.032   5.550  -1.664
  735    HB3  CYS  32           HB3      CYS  32  -5.740   3.968  -2.387
  736    HG   CYS  32           HG       CYS  32  -7.971   6.266  -3.568
  737    H    TYR  33           H        TYR  33  -7.011   5.416   0.775
  738    HA   TYR  33           HA       TYR  33  -5.292   3.622   2.118
  739    HB2  TYR  33           HB2      TYR  33  -6.712   6.161   2.945
  740    HB3  TYR  33           HB3      TYR  33  -5.861   5.215   4.159
  741    HD1  TYR  33           HD1      TYR  33  -3.435   4.349   3.027
  742    HD2  TYR  33           HD2      TYR  33  -5.418   8.062   2.334
  743    HE1  TYR  33           HE1      TYR  33  -1.290   5.391   2.542
  744    HE2  TYR  33           HE2      TYR  33  -3.262   9.116   1.817
  745    HH   TYR  33           HH       TYR  33  -0.426   7.367   1.281
  746    H    SER  34           H        SER  34  -8.776   4.205   2.472
  747    HA   SER  34           HA       SER  34  -9.226   2.523   4.713
  748    HB2  SER  34           HB2      SER  34 -10.927   4.155   3.965
  749    HB3  SER  34           HB3      SER  34 -11.150   3.261   2.465
  750    HG   SER  34           HG       SER  34 -11.521   1.483   4.348
  751    H    ARG  35           H        ARG  35  -9.386   1.946   1.200
  752    HA   ARG  35           HA       ARG  35 -10.157  -0.768   1.276
  753    HB2  ARG  35           HB2      ARG  35 -10.276   0.943  -0.648
  754    HB3  ARG  35           HB3      ARG  35  -8.604   0.501  -0.989
  755    HG2  ARG  35           HG2      ARG  35  -9.186  -1.732  -1.525
  756    HG3  ARG  35           HG3      ARG  35 -10.765  -1.592  -0.748
  757    HD2  ARG  35           HD2      ARG  35 -11.133  -1.587  -3.083
  758    HD3  ARG  35           HD3      ARG  35 -11.411   0.056  -2.528
  759    HE   ARG  35           HE       ARG  35  -8.821  -0.667  -3.700
  760   HH11  ARG  35          HH11      ARG  35 -11.698   1.216  -3.931
  761   HH12  ARG  35          HH12      ARG  35 -11.120   2.108  -5.289
  762   HH21  ARG  35          HH21      ARG  35  -8.119   0.472  -5.438
  763   HH22  ARG  35          HH22      ARG  35  -9.131   1.678  -6.140
  764    H    LEU  36           H        LEU  36  -6.976   0.762   1.499
  765    HA   LEU  36           HA       LEU  36  -5.371  -1.588   1.416
  766    HB2  LEU  36           HB2      LEU  36  -4.952   1.083   2.817
  767    HB3  LEU  36           HB3      LEU  36  -3.738  -0.185   2.805
  768    HG   LEU  36           HG       LEU  36  -4.795   1.218   0.316
  769   HD11  LEU  36          HD11      LEU  36  -2.612   2.327   0.190
  770   HD12  LEU  36          HD12      LEU  36  -2.136   1.593   1.723
  771   HD13  LEU  36          HD13      LEU  36  -3.461   2.757   1.675
  772   HD21  LEU  36          HD21      LEU  36  -4.075  -1.083  -0.173
  773   HD22  LEU  36          HD22      LEU  36  -2.519  -0.781   0.603
  774   HD23  LEU  36          HD23      LEU  36  -2.955   0.084  -0.873
  775    H    ARG  37           H        ARG  37  -6.816   0.206   4.180
  776    HA   ARG  37           HA       ARG  37  -5.959  -1.377   6.309
  777    HB2  ARG  37           HB2      ARG  37  -8.483   0.279   6.043
  778    HB3  ARG  37           HB3      ARG  37  -7.974  -0.466   7.555
  779    HG2  ARG  37           HG2      ARG  37  -5.905   0.883   7.539
  780    HG3  ARG  37           HG3      ARG  37  -6.395   1.622   6.012
  781    HD2  ARG  37           HD2      ARG  37  -8.380   2.581   7.098
  782    HD3  ARG  37           HD3      ARG  37  -7.936   1.814   8.624
  783    HE   ARG  37           HE       ARG  37  -5.766   3.347   7.974
  784   HH11  ARG  37          HH11      ARG  37  -9.127   4.093   8.478
  785   HH12  ARG  37          HH12      ARG  37  -8.774   5.679   9.073
  786   HH21  ARG  37          HH21      ARG  37  -5.386   5.377   8.766
  787   HH22  ARG  37          HH22      ARG  37  -6.711   6.389   9.218
  788    H    GLU  38           H        GLU  38  -8.677  -1.898   4.135
  789    HA   GLU  38           HA       GLU  38 -10.199  -3.812   5.535
  790    HB2  GLU  38           HB2      GLU  38  -9.798  -3.740   2.508
  791    HB3  GLU  38           HB3      GLU  38 -11.153  -4.458   3.359
  792    HG2  GLU  38           HG2      GLU  38 -10.531  -1.509   3.135
  793    HG3  GLU  38           HG3      GLU  38 -11.777  -2.381   2.256
  794    H    LEU  39           H        LEU  39  -7.300  -4.123   3.564
  795    HA   LEU  39           HA       LEU  39  -7.368  -7.060   3.536
  796    HB2  LEU  39           HB2      LEU  39  -5.563  -5.093   2.079
  797    HB3  LEU  39           HB3      LEU  39  -5.547  -6.836   1.850
  798    HG   LEU  39           HG       LEU  39  -7.914  -5.025   1.193
  799   HD11  LEU  39          HD11      LEU  39  -7.389  -5.427  -1.169
  800   HD12  LEU  39          HD12      LEU  39  -5.949  -6.336  -0.708
  801   HD13  LEU  39          HD13      LEU  39  -6.055  -4.611  -0.354
  802   HD21  LEU  39          HD21      LEU  39  -7.522  -7.994   0.652
  803   HD22  LEU  39          HD22      LEU  39  -8.876  -7.013   0.085
  804   HD23  LEU  39          HD23      LEU  39  -8.654  -7.284   1.811
  805    H    VAL  40           H        VAL  40  -6.105  -4.747   5.594
  806    HA   VAL  40           HA       VAL  40  -3.624  -6.254   6.199
  807    HB   VAL  40           HB       VAL  40  -4.479  -3.535   7.307
  808   HG11  VAL  40          HG11      VAL  40  -2.924  -4.710   8.811
  809   HG12  VAL  40          HG12      VAL  40  -2.120  -3.334   8.056
  810   HG13  VAL  40          HG13      VAL  40  -1.795  -4.968   7.476
  811   HG21  VAL  40          HG21      VAL  40  -2.517  -4.151   5.063
  812   HG22  VAL  40          HG22      VAL  40  -2.788  -2.559   5.777
  813   HG23  VAL  40          HG23      VAL  40  -4.089  -3.362   4.896
  814    HA   PRO  41           HA       PRO  41  -6.069  -7.794   9.813
  815    HB2  PRO  41           HB2      PRO  41  -4.376 -10.163   9.865
  816    HB3  PRO  41           HB3      PRO  41  -6.055 -10.040   9.333
  817    HG2  PRO  41           HG2      PRO  41  -3.937 -10.583   7.632
  818    HG3  PRO  41           HG3      PRO  41  -5.474  -9.861   7.113
  819    HD2  PRO  41           HD2      PRO  41  -2.855  -8.488   7.741
  820    HD3  PRO  41           HD3      PRO  41  -3.972  -8.218   6.379
  821    H    GLY  42           H        GLY  42  -3.219  -6.336   9.635
  822    HA2  GLY  42           HA2      GLY  42  -2.056  -7.117  12.216
  823    HA3  GLY  42           HA3      GLY  42  -1.353  -6.027  11.033
  824    H    VAL  43           H        VAL  43  -4.181  -4.697  10.998
  825    HA   VAL  43           HA       VAL  43  -3.634  -2.675  13.015
  826    HB   VAL  43           HB       VAL  43  -5.961  -2.922  11.050
  827   HG11  VAL  43          HG11      VAL  43  -6.409  -0.529  11.481
  828   HG12  VAL  43          HG12      VAL  43  -5.148  -0.509  12.716
  829   HG13  VAL  43          HG13      VAL  43  -6.592  -1.494  12.948
  830   HG21  VAL  43          HG21      VAL  43  -4.781  -1.237   9.687
  831   HG22  VAL  43          HG22      VAL  43  -3.813  -2.699   9.882
  832   HG23  VAL  43          HG23      VAL  43  -3.427  -1.253  10.819
  833    HA   PRO  44           HA       PRO  44  -6.261  -4.486  16.328
  834    HB2  PRO  44           HB2      PRO  44  -6.482  -1.554  17.029
  835    HB3  PRO  44           HB3      PRO  44  -6.154  -2.938  18.085
  836    HG2  PRO  44           HG2      PRO  44  -4.163  -1.329  17.334
  837    HG3  PRO  44           HG3      PRO  44  -3.909  -3.089  17.402
  838    HD2  PRO  44           HD2      PRO  44  -4.329  -1.319  15.002
  839    HD3  PRO  44           HD3      PRO  44  -3.282  -2.743  15.183
  840    H    ARG  45           H        ARG  45  -7.509  -1.234  15.386
  841    HA   ARG  45           HA       ARG  45  -9.829  -1.979  14.013
  842    HB2  ARG  45           HB2      ARG  45 -10.510  -3.014  16.190
  843    HB3  ARG  45           HB3      ARG  45 -10.326  -1.459  16.985
  844    HG2  ARG  45           HG2      ARG  45 -12.194  -0.549  15.605
  845    HG3  ARG  45           HG3      ARG  45 -12.380  -2.132  14.846
  846    HD2  ARG  45           HD2      ARG  45 -12.890  -3.128  17.056
  847    HD3  ARG  45           HD3      ARG  45 -12.711  -1.538  17.806
  848    HE   ARG  45           HE       ARG  45 -14.643  -1.336  15.799
  849   HH11  ARG  45          HH11      ARG  45 -14.286  -2.951  18.848
  850   HH12  ARG  45          HH12      ARG  45 -15.982  -2.901  19.177
  851   HH21  ARG  45          HH21      ARG  45 -16.802  -1.324  16.244
  852   HH22  ARG  45          HH22      ARG  45 -17.384  -2.003  17.724
  853    H    GLY  46           H        GLY  46  -9.599   0.305  16.754
  854    HA2  GLY  46           HA2      GLY  46  -9.689   2.618  14.878
  855    HA3  GLY  46           HA3      GLY  46 -10.518   2.570  16.429
  856    H    THR  47           H        THR  47  -7.252   2.114  15.103
  857    HA   THR  47           HA       THR  47  -6.037   3.323  17.530
  858    HB   THR  47           HB       THR  47  -5.244   1.052  16.912
  859    HG1  THR  47           HG1      THR  47  -2.889   1.837  16.560
  860   HG21  THR  47          HG21      THR  47  -3.903   0.669  14.886
  861   HG22  THR  47          HG22      THR  47  -4.218   2.321  14.353
  862   HG23  THR  47          HG23      THR  47  -5.544   1.161  14.464
  863    H    GLN  48           H        GLN  48  -3.909   4.585  16.983
  864    HA   GLN  48           HA       GLN  48  -4.583   6.832  15.313
  865    HB2  GLN  48           HB2      GLN  48  -2.125   6.172  16.981
  866    HB3  GLN  48           HB3      GLN  48  -2.216   7.624  15.995
  867    HG2  GLN  48           HG2      GLN  48  -2.740   8.169  18.294
  868    HG3  GLN  48           HG3      GLN  48  -4.170   8.394  17.292
  869   HE21  GLN  48          HE21      GLN  48  -5.560   8.248  19.071
  870   HE22  GLN  48          HE22      GLN  48  -5.864   6.765  19.903
  871    H    LEU  49           H        LEU  49  -4.691   6.132  13.183
  872    HA   LEU  49           HA       LEU  49  -2.142   5.329  11.876
  873    HB2  LEU  49           HB2      LEU  49  -4.990   4.834  10.917
  874    HB3  LEU  49           HB3      LEU  49  -3.546   4.468   9.990
  875    HG   LEU  49           HG       LEU  49  -4.387   3.134  12.587
  876   HD11  LEU  49          HD11      LEU  49  -5.733   2.383  10.694
  877   HD12  LEU  49          HD12      LEU  49  -4.639   1.105  11.221
  878   HD13  LEU  49          HD13      LEU  49  -4.271   2.030   9.763
  879   HD21  LEU  49          HD21      LEU  49  -1.948   3.312  12.511
  880   HD22  LEU  49          HD22      LEU  49  -1.923   2.603  10.895
  881   HD23  LEU  49          HD23      LEU  49  -2.459   1.641  12.277
  882    H    SER  50           H        SER  50  -1.284   7.330  11.397
  883    HA   SER  50           HA       SER  50  -2.631   9.345   9.858
  884    HB2  SER  50           HB2      SER  50  -0.415  10.260   9.420
  885    HB3  SER  50           HB3      SER  50  -0.440   9.704  11.092
  886    HG   SER  50           HG       SER  50   1.400   8.864  10.330
  887    H    GLN  51           H        GLN  51  -2.113   9.825   7.561
  888    HA   GLN  51           HA       GLN  51  -2.485   7.772   5.713
  889    HB2  GLN  51           HB2      GLN  51  -1.176  10.498   5.344
  890    HB3  GLN  51           HB3      GLN  51  -1.677   9.458   4.013
  891    HG2  GLN  51           HG2      GLN  51  -4.027   9.620   4.762
  892    HG3  GLN  51           HG3      GLN  51  -3.530  10.646   6.107
  893   HE21  GLN  51          HE21      GLN  51  -3.975  10.492   2.640
  894   HE22  GLN  51          HE22      GLN  51  -3.903  12.191   2.357
  895    H    VAL  52           H        VAL  52   0.477   8.936   7.176
  896    HA   VAL  52           HA       VAL  52   2.360   7.706   5.410
  897    HB   VAL  52           HB       VAL  52   2.778   8.601   8.304
  898   HG11  VAL  52          HG11      VAL  52   4.791   8.166   6.067
  899   HG12  VAL  52          HG12      VAL  52   4.591   7.159   7.504
  900   HG13  VAL  52          HG13      VAL  52   5.163   8.818   7.667
  901   HG21  VAL  52          HG21      VAL  52   3.589  10.744   7.368
  902   HG22  VAL  52          HG22      VAL  52   1.896  10.464   6.968
  903   HG23  VAL  52          HG23      VAL  52   3.141  10.210   5.745
  904    H    GLU  53           H        GLU  53   1.140   6.764   8.703
  905    HA   GLU  53           HA       GLU  53   2.845   4.508   8.917
  906    HB2  GLU  53           HB2      GLU  53   1.813   5.778  10.863
  907    HB3  GLU  53           HB3      GLU  53   0.291   4.969  10.508
  908    HG2  GLU  53           HG2      GLU  53   1.305   2.794  10.909
  909    HG3  GLU  53           HG3      GLU  53   2.884   3.534  11.142
  910    H    ILE  54           H        ILE  54  -0.389   4.897   7.594
  911    HA   ILE  54           HA       ILE  54  -1.155   2.210   7.302
  912    HB   ILE  54           HB       ILE  54  -1.651   4.545   5.400
  913   HG12  ILE  54          HG12      ILE  54  -3.479   3.368   7.555
  914   HG13  ILE  54          HG13      ILE  54  -2.544   4.849   7.734
  915   HG21  ILE  54          HG21      ILE  54  -3.019   1.822   5.463
  916   HG22  ILE  54          HG22      ILE  54  -1.998   2.467   4.171
  917   HG23  ILE  54          HG23      ILE  54  -3.560   3.207   4.507
  918   HD11  ILE  54          HD11      ILE  54  -4.811   5.390   7.244
  919   HD12  ILE  54          HD12      ILE  54  -4.809   4.360   5.815
  920   HD13  ILE  54          HD13      ILE  54  -3.824   5.829   5.849
  921    H    LEU  55           H        LEU  55   0.764   4.272   5.075
  922    HA   LEU  55           HA       LEU  55   1.357   2.469   3.038
  923    HB2  LEU  55           HB2      LEU  55   3.168   4.626   4.188
  924    HB3  LEU  55           HB3      LEU  55   3.387   3.862   2.622
  925    HG   LEU  55           HG       LEU  55   1.007   5.592   3.382
  926   HD11  LEU  55          HD11      LEU  55   3.405   6.288   1.656
  927   HD12  LEU  55          HD12      LEU  55   3.064   6.930   3.265
  928   HD13  LEU  55          HD13      LEU  55   1.985   7.305   1.924
  929   HD21  LEU  55          HD21      LEU  55   1.809   4.411   0.704
  930   HD22  LEU  55          HD22      LEU  55   0.471   5.527   0.985
  931   HD23  LEU  55          HD23      LEU  55   0.431   3.915   1.694
  932    H    GLN  56           H        GLN  56   3.162   3.108   6.021
  933    HA   GLN  56           HA       GLN  56   5.371   1.410   5.610
  934    HB2  GLN  56           HB2      GLN  56   4.148   2.322   8.252
  935    HB3  GLN  56           HB3      GLN  56   5.792   1.727   8.027
  936    HG2  GLN  56           HG2      GLN  56   6.343   3.656   6.640
  937    HG3  GLN  56           HG3      GLN  56   4.684   4.238   6.740
  938   HE21  GLN  56          HE21      GLN  56   7.111   5.619   7.509
  939   HE22  GLN  56          HE22      GLN  56   6.950   6.003   9.181
  940    H    ARG  57           H        ARG  57   2.287   0.849   7.327
  941    HA   ARG  57           HA       ARG  57   2.926  -1.827   8.178
  942    HB2  ARG  57           HB2      ARG  57   1.443  -0.342   9.466
  943    HB3  ARG  57           HB3      ARG  57   0.264  -0.351   8.161
  944    HG2  ARG  57           HG2      ARG  57  -0.405  -2.570   8.613
  945    HG3  ARG  57           HG3      ARG  57   1.086  -2.948   9.475
  946    HD2  ARG  57           HD2      ARG  57  -1.030  -1.022  10.506
  947    HD3  ARG  57           HD3      ARG  57  -0.920  -2.722  10.967
  948    HE   ARG  57           HE       ARG  57   1.316  -2.221  11.887
  949   HH11  ARG  57          HH11      ARG  57  -0.797   0.468  11.466
  950   HH12  ARG  57          HH12      ARG  57  -0.001   1.415  12.668
  951   HH21  ARG  57          HH21      ARG  57   2.305  -0.982  13.429
  952   HH22  ARG  57          HH22      ARG  57   1.707   0.603  13.771
  953    H    VAL  58           H        VAL  58   1.359  -0.482   5.341
  954    HA   VAL  58           HA       VAL  58   0.373  -2.967   4.288
  955    HB   VAL  58           HB       VAL  58   0.968  -0.292   2.935
  956   HG11  VAL  58          HG11      VAL  58  -0.175  -1.150   0.897
  957   HG12  VAL  58          HG12      VAL  58  -0.237  -2.762   1.615
  958   HG13  VAL  58          HG13      VAL  58   1.319  -2.029   1.228
  959   HG21  VAL  58          HG21      VAL  58  -0.998  -0.322   4.428
  960   HG22  VAL  58          HG22      VAL  58  -1.667  -1.699   3.551
  961   HG23  VAL  58          HG23      VAL  58  -1.500  -0.135   2.747
  962    H    ILE  59           H        ILE  59   3.470  -1.170   3.979
  963    HA   ILE  59           HA       ILE  59   4.768  -2.981   2.223
  964    HB   ILE  59           HB       ILE  59   6.049  -1.246   4.395
  965   HG12  ILE  59          HG12      ILE  59   5.750  -0.729   1.391
  966   HG13  ILE  59          HG13      ILE  59   4.811   0.059   2.650
  967   HG21  ILE  59          HG21      ILE  59   7.568  -3.078   3.745
  968   HG22  ILE  59          HG22      ILE  59   8.176  -1.543   3.131
  969   HG23  ILE  59          HG23      ILE  59   7.367  -2.666   2.039
  970   HD11  ILE  59          HD11      ILE  59   6.552   1.506   1.818
  971   HD12  ILE  59          HD12      ILE  59   7.786   0.319   2.235
  972   HD13  ILE  59          HD13      ILE  59   6.850   1.108   3.509
  973    H    ASP  60           H        ASP  60   4.675  -2.863   5.816
  974    HA   ASP  60           HA       ASP  60   6.193  -5.133   6.430
  975    HB2  ASP  60           HB2      ASP  60   3.771  -4.051   7.937
  976    HB3  ASP  60           HB3      ASP  60   4.949  -5.179   8.603
  977    H    TYR  61           H        TYR  61   2.765  -4.866   5.681
  978    HA   TYR  61           HA       TYR  61   1.939  -7.534   5.973
  979    HB2  TYR  61           HB2      TYR  61   0.342  -5.720   5.749
  980    HB3  TYR  61           HB3      TYR  61   0.969  -5.285   4.165
  981    HD1  TYR  61           HD1      TYR  61  -0.808  -8.008   6.014
  982    HD2  TYR  61           HD2      TYR  61   0.020  -6.263   2.189
  983    HE1  TYR  61           HE1      TYR  61  -2.486  -9.460   4.984
  984    HE2  TYR  61           HE2      TYR  61  -1.687  -7.712   1.179
  985    HH   TYR  61           HH       TYR  61  -2.764  -9.872   1.650
  986    H    ILE  62           H        ILE  62   3.194  -5.808   3.118
  987    HA   ILE  62           HA       ILE  62   3.113  -8.032   1.324
  988    HB   ILE  62           HB       ILE  62   4.667  -5.404   1.152
  989   HG12  ILE  62          HG12      ILE  62   2.037  -6.175  -0.219
  990   HG13  ILE  62          HG13      ILE  62   2.130  -5.214   1.248
  991   HG21  ILE  62          HG21      ILE  62   4.096  -7.413  -1.061
  992   HG22  ILE  62          HG22      ILE  62   5.675  -7.081  -0.348
  993   HG23  ILE  62          HG23      ILE  62   4.853  -5.830  -1.278
  994   HD11  ILE  62          HD11      ILE  62   3.342  -3.466   0.023
  995   HD12  ILE  62          HD12      ILE  62   1.768  -3.815  -0.689
  996   HD13  ILE  62          HD13      ILE  62   3.232  -4.434  -1.451
  997    H    LEU  63           H        LEU  63   5.512  -6.895   3.665
  998    HA   LEU  63           HA       LEU  63   7.768  -8.394   2.747
  999    HB2  LEU  63           HB2      LEU  63   7.121  -7.341   5.527
 1000    HB3  LEU  63           HB3      LEU  63   8.659  -8.064   5.088
 1001    HG   LEU  63           HG       LEU  63   7.537  -5.481   3.945
 1002   HD11  LEU  63          HD11      LEU  63   9.821  -5.904   5.889
 1003   HD12  LEU  63          HD12      LEU  63   8.242  -5.208   6.263
 1004   HD13  LEU  63          HD13      LEU  63   9.339  -4.359   5.178
 1005   HD21  LEU  63          HD21      LEU  63   9.726  -5.199   2.848
 1006   HD22  LEU  63          HD22      LEU  63   8.883  -6.626   2.253
 1007   HD23  LEU  63          HD23      LEU  63  10.213  -6.806   3.400
 1008    H    ASP  64           H        ASP  64   5.025  -9.180   4.806
 1009    HA   ASP  64           HA       ASP  64   5.902 -11.747   5.702
 1010    HB2  ASP  64           HB2      ASP  64   4.048 -10.487   6.780
 1011    HB3  ASP  64           HB3      ASP  64   3.075 -10.651   5.327
 1012    H    LEU  65           H        LEU  65   4.214 -10.611   2.814
 1013    HA   LEU  65           HA       LEU  65   3.565 -13.231   1.767
 1014    HB2  LEU  65           HB2      LEU  65   3.479 -10.520   0.392
 1015    HB3  LEU  65           HB3      LEU  65   2.713 -11.994  -0.185
 1016    HG   LEU  65           HG       LEU  65   1.964 -10.473   2.344
 1017   HD11  LEU  65          HD11      LEU  65   1.226  -9.302   0.342
 1018   HD12  LEU  65          HD12      LEU  65  -0.153  -9.982   1.202
 1019   HD13  LEU  65          HD13      LEU  65   0.447 -10.769  -0.260
 1020   HD21  LEU  65          HD21      LEU  65   0.716 -12.995   1.206
 1021   HD22  LEU  65          HD22      LEU  65   0.086 -12.058   2.562
 1022   HD23  LEU  65          HD23      LEU  65   1.645 -12.867   2.703
 1023    H    GLN  66           H        GLN  66   6.129 -10.883   1.241
 1024    HA   GLN  66           HA       GLN  66   7.320 -12.299  -1.032
 1025    HB2  GLN  66           HB2      GLN  66   8.178  -9.785   0.468
 1026    HB3  GLN  66           HB3      GLN  66   9.058 -10.451  -0.903
 1027    HG2  GLN  66           HG2      GLN  66   6.193  -9.451  -0.994
 1028    HG3  GLN  66           HG3      GLN  66   7.608  -8.542  -1.528
 1029   HE21  GLN  66          HE21      GLN  66   5.276  -9.358  -3.066
 1030   HE22  GLN  66          HE22      GLN  66   5.872 -10.287  -4.386
 1031    H    VAL  67           H        VAL  67   7.847 -11.886   2.401
 1032    HA   VAL  67           HA       VAL  67   9.314 -12.576   3.939
 1033    HB   VAL  67           HB       VAL  67   9.830 -14.971   2.120
 1034   HG11  VAL  67          HG11      VAL  67  11.419 -14.812   3.999
 1035   HG12  VAL  67          HG12      VAL  67  10.334 -16.184   4.216
 1036   HG13  VAL  67          HG13      VAL  67  10.077 -14.704   5.144
 1037   HG21  VAL  67          HG21      VAL  67   7.980 -16.109   3.310
 1038   HG22  VAL  67          HG22      VAL  67   7.403 -14.683   2.446
 1039   HG23  VAL  67          HG23      VAL  67   7.627 -14.623   4.196
 1040    H    VAL  68           H        VAL  68  10.677 -10.815   3.629
 1041    HA   VAL  68           HA       VAL  68  13.068 -11.092   1.919
 1042    HB   VAL  68           HB       VAL  68  12.008  -8.578   3.305
 1043   HG11  VAL  68          HG11      VAL  68  13.526  -7.346   1.786
 1044   HG12  VAL  68          HG12      VAL  68  14.135  -8.875   1.151
 1045   HG13  VAL  68          HG13      VAL  68  14.417  -8.447   2.839
 1046   HG21  VAL  68          HG21      VAL  68  11.663  -9.434   0.399
 1047   HG22  VAL  68          HG22      VAL  68  11.160  -7.887   1.083
 1048   HG23  VAL  68          HG23      VAL  68  10.389  -9.379   1.621
  Start of MODEL    2
    1    H1   MET   1           H1       MET   1   6.974   4.602 -21.698
    2    H2   MET   1           H2       MET   1   8.567   4.581 -22.264
    3    H3   MET   1           H3       MET   1   7.339   5.238 -23.219
    4    HA   MET   1           HA       MET   1   8.658   6.971 -22.242
    5    HB2  MET   1           HB2      MET   1   5.852   6.764 -21.046
    6    HB3  MET   1           HB3      MET   1   6.796   8.247 -21.126
    7    HG2  MET   1           HG2      MET   1   6.749   8.114 -23.604
    8    HG3  MET   1           HG3      MET   1   5.743   6.666 -23.488
    9    HE1  MET   1           HE1      MET   1   4.894   9.265 -25.179
   10    HE2  MET   1           HE2      MET   1   3.199   9.428 -24.714
   11    HE3  MET   1           HE3      MET   1   3.871   7.832 -25.051
   12    H    GLY   2           H        GLY   2   9.904   7.646 -20.573
   13    HA2  GLY   2           HA2      GLY   2  10.359   8.168 -18.327
   14    HA3  GLY   2           HA3      GLY   2   9.283   6.889 -17.799
   15    H    HIS   3           H        HIS   3  12.528   7.683 -18.822
   16    HA   HIS   3           HA       HIS   3  13.612   5.037 -18.322
   17    HB2  HIS   3           HB2      HIS   3  14.950   7.744 -18.747
   18    HB3  HIS   3           HB3      HIS   3  15.855   6.264 -18.445
   19    HD2  HIS   3           HD2      HIS   3  13.379   7.618 -21.229
   20    HE1  HIS   3           HE1      HIS   3  16.113   4.861 -22.901
   21    HE2  HIS   3           HE2      HIS   3  14.106   6.327 -23.353
   22    H    HIS   4           H        HIS   4  12.471   4.888 -16.209
   23    HA   HIS   4           HA       HIS   4  13.388   6.286 -13.892
   24    HB2  HIS   4           HB2      HIS   4  12.035   3.563 -14.164
   25    HB3  HIS   4           HB3      HIS   4  12.283   4.404 -12.634
   26    HD2  HIS   4           HD2      HIS   4  10.187   5.962 -11.922
   27    HE1  HIS   4           HE1      HIS   4   8.460   6.343 -15.760
   28    HE2  HIS   4           HE2      HIS   4   8.348   7.082 -13.352
   29    H    HIS   5           H        HIS   5  15.182   5.935 -12.640
   30    HA   HIS   5           HA       HIS   5  16.841   3.540 -13.055
   31    HB2  HIS   5           HB2      HIS   5  18.878   4.913 -13.446
   32    HB3  HIS   5           HB3      HIS   5  17.696   5.100 -14.729
   33    HD2  HIS   5           HD2      HIS   5  16.205   7.633 -14.531
   34    HE1  HIS   5           HE1      HIS   5  19.394   9.473 -12.456
   35    HE2  HIS   5           HE2      HIS   5  17.152   9.835 -13.551
   36    H    HIS   6           H        HIS   6  17.177   2.745 -11.118
   37    HA   HIS   6           HA       HIS   6  18.332   4.351  -8.977
   38    HB2  HIS   6           HB2      HIS   6  16.697   3.450  -7.270
   39    HB3  HIS   6           HB3      HIS   6  15.994   4.590  -8.405
   40    HD2  HIS   6           HD2      HIS   6  15.661   0.846  -7.383
   41    HE1  HIS   6           HE1      HIS   6  12.695   1.766 -10.243
   42    HE2  HIS   6           HE2      HIS   6  13.377   0.192  -8.389
   43    H    HIS   7           H        HIS   7  19.720   3.175  -7.708
   44    HA   HIS   7           HA       HIS   7  19.801   0.238  -7.938
   45    HB2  HIS   7           HB2      HIS   7  21.347   1.194  -9.671
   46    HB3  HIS   7           HB3      HIS   7  22.243   2.010  -8.396
   47    HD2  HIS   7           HD2      HIS   7  21.265  -1.789  -9.055
   48    HE1  HIS   7           HE1      HIS   7  25.282  -1.517  -7.767
   49    HE2  HIS   7           HE2      HIS   7  23.502  -3.042  -8.707
   50    H    HIS   8           H        HIS   8  19.221  -0.069  -5.864
   51    HA   HIS   8           HA       HIS   8  21.116   0.532  -3.732
   52    HB2  HIS   8           HB2      HIS   8  19.326   1.496  -2.238
   53    HB3  HIS   8           HB3      HIS   8  19.708   2.523  -3.613
   54    HD2  HIS   8           HD2      HIS   8  16.730   0.324  -2.288
   55    HE1  HIS   8           HE1      HIS   8  15.391   2.684  -5.528
   56    HE2  HIS   8           HE2      HIS   8  14.757   0.892  -3.872
   57    H    SER   9           H        SER   9  20.757  -0.759  -1.818
   58    HA   SER   9           HA       SER   9  18.654  -2.708  -1.621
   59    HB2  SER   9           HB2      SER   9  20.055  -3.841  -3.344
   60    HB3  SER   9           HB3      SER   9  21.448  -3.764  -2.267
   61    HG   SER   9           HG       SER   9  19.632  -5.663  -2.401
   62    H    HIS  10           H        HIS  10  18.785  -3.970   0.343
   63    HA   HIS  10           HA       HIS  10  20.736  -3.016   2.373
   64    HB2  HIS  10           HB2      HIS  10  17.777  -3.651   2.792
   65    HB3  HIS  10           HB3      HIS  10  18.921  -3.328   4.095
   66    HD1  HIS  10           HD1      HIS  10  19.731  -0.885   4.381
   67    HD2  HIS  10           HD2      HIS  10  16.877  -1.353   1.397
   68    HE1  HIS  10           HE1      HIS  10  18.956   1.424   3.833
   69    HE2  HIS  10           HE2      HIS  10  17.373   1.134   1.911
   70    H    MET  11           H        MET  11  21.788  -4.572   3.495
   71    HA   MET  11           HA       MET  11  21.650  -7.316   2.592
   72    HB2  MET  11           HB2      MET  11  23.416  -5.994   4.695
   73    HB3  MET  11           HB3      MET  11  23.623  -7.643   4.108
   74    HG2  MET  11           HG2      MET  11  24.038  -6.770   1.830
   75    HG3  MET  11           HG3      MET  11  23.859  -5.124   2.435
   76    HE1  MET  11           HE1      MET  11  27.024  -4.815   4.789
   77    HE2  MET  11           HE2      MET  11  25.398  -5.287   5.276
   78    HE3  MET  11           HE3      MET  11  25.626  -3.966   4.128
   79    H    GLY  12           H        GLY  12  20.182  -5.607   5.180
   80    HA2  GLY  12           HA2      GLY  12  18.444  -6.350   6.515
   81    HA3  GLY  12           HA3      GLY  12  18.752  -7.994   5.993
   82    H    GLY  13           H        GLY  13  21.461  -6.257   7.320
   83    HA2  GLY  13           HA2      GLY  13  21.834  -7.964   9.571
   84    HA3  GLY  13           HA3      GLY  13  22.676  -6.453   9.264
   85    H    GLY  14           H        GLY  14  20.224  -7.994  11.120
   86    HA2  GLY  14           HA2      GLY  14  19.069  -7.190  13.008
   87    HA3  GLY  14           HA3      GLY  14  19.482  -5.536  12.570
   88    H    LYS  15           H        LYS  15  18.324  -4.519  10.818
   89    HA   LYS  15           HA       LYS  15  16.599  -3.901   9.515
   90    HB2  LYS  15           HB2      LYS  15  17.356  -5.838   8.195
   91    HB3  LYS  15           HB3      LYS  15  16.266  -6.887   9.093
   92    HG2  LYS  15           HG2      LYS  15  14.316  -5.651   8.157
   93    HG3  LYS  15           HG3      LYS  15  15.420  -4.611   7.252
   94    HD2  LYS  15           HD2      LYS  15  14.498  -6.380   5.798
   95    HD3  LYS  15           HD3      LYS  15  16.244  -6.564   5.984
   96    HE2  LYS  15           HE2      LYS  15  15.832  -8.322   7.719
   97    HE3  LYS  15           HE3      LYS  15  14.099  -8.166   7.417
   98    HZ1  LYS  15           HZ1      LYS  15  14.507  -8.799   5.112
   99    HZ2  LYS  15           HZ2      LYS  15  15.002 -10.003   6.183
  100    HZ3  LYS  15           HZ3      LYS  15  16.148  -9.010   5.444
  101    H    GLY  16           H        GLY  16  15.042  -2.909  10.689
  102    HA2  GLY  16           HA2      GLY  16  12.495  -3.418  11.028
  103    HA3  GLY  16           HA3      GLY  16  13.101  -4.456  12.312
  104    HA   PRO  17           HA       PRO  17  13.386  -0.954  15.147
  105    HB2  PRO  17           HB2      PRO  17  15.894  -1.224  16.297
  106    HB3  PRO  17           HB3      PRO  17  14.510  -2.243  16.717
  107    HG2  PRO  17           HG2      PRO  17  16.761  -2.817  14.787
  108    HG3  PRO  17           HG3      PRO  17  16.081  -3.867  16.053
  109    HD2  PRO  17           HD2      PRO  17  15.361  -4.177  13.479
  110    HD3  PRO  17           HD3      PRO  17  14.163  -4.365  14.779
  111    H    ALA  18           H        ALA  18  13.757   1.193  14.802
  112    HA   ALA  18           HA       ALA  18  16.208   2.340  13.864
  113    HB1  ALA  18           HB1      ALA  18  13.899   2.334  11.881
  114    HB2  ALA  18           HB2      ALA  18  15.416   1.456  11.697
  115    HB3  ALA  18           HB3      ALA  18  15.415   3.221  11.691
  116    H    ALA  19           H        ALA  19  16.199   4.030  15.284
  117    HA   ALA  19           HA       ALA  19  13.853   5.644  15.836
  118    HB1  ALA  19           HB1      ALA  19  15.364   7.028  17.188
  119    HB2  ALA  19           HB2      ALA  19  16.767   6.171  16.541
  120    HB3  ALA  19           HB3      ALA  19  15.600   5.317  17.552
  121    H    GLU  20           H        GLU  20  13.825   8.019  15.422
  122    HA   GLU  20           HA       GLU  20  14.621   8.547  12.604
  123    HB2  GLU  20           HB2      GLU  20  12.217   9.956  13.775
  124    HB3  GLU  20           HB3      GLU  20  12.509   9.404  12.133
  125    HG2  GLU  20           HG2      GLU  20  10.695   8.124  12.936
  126    HG3  GLU  20           HG3      GLU  20  12.087   7.041  12.977
  127    H    GLU  21           H        GLU  21  15.262  10.618  12.028
  128    HA   GLU  21           HA       GLU  21  15.903  12.627  14.029
  129    HB2  GLU  21           HB2      GLU  21  16.532  14.040  12.013
  130    HB3  GLU  21           HB3      GLU  21  17.436  12.552  12.178
  131    HG2  GLU  21           HG2      GLU  21  15.032  12.524  10.377
  132    HG3  GLU  21           HG3      GLU  21  16.463  13.388   9.827
  133    HA   PRO  22           HA       PRO  22  12.054  15.134  13.800
  134    HB2  PRO  22           HB2      PRO  22  12.915  17.639  12.855
  135    HB3  PRO  22           HB3      PRO  22  12.929  17.123  14.545
  136    HG2  PRO  22           HG2      PRO  22  15.177  17.061  12.525
  137    HG3  PRO  22           HG3      PRO  22  15.218  17.559  14.233
  138    HD2  PRO  22           HD2      PRO  22  16.128  15.152  13.517
  139    HD3  PRO  22           HD3      PRO  22  15.170  15.323  15.005
  140    H    LEU  23           H        LEU  23  11.205  13.799  12.091
  141    HA   LEU  23           HA       LEU  23  11.558  14.433   9.292
  142    HB2  LEU  23           HB2      LEU  23   9.544  12.596  10.649
  143    HB3  LEU  23           HB3      LEU  23   9.859  12.656   8.921
  144    HG   LEU  23           HG       LEU  23  11.856  11.770  11.038
  145   HD11  LEU  23          HD11      LEU  23  11.550   9.507  10.148
  146   HD12  LEU  23          HD12      LEU  23  10.295  10.097   9.057
  147   HD13  LEU  23          HD13      LEU  23  10.047  10.153  10.803
  148   HD21  LEU  23          HD21      LEU  23  12.996  12.789   9.113
  149   HD22  LEU  23          HD22      LEU  23  12.123  11.723   8.009
  150   HD23  LEU  23          HD23      LEU  23  13.279  11.050   9.161
  151    H    SER  24           H        SER  24  10.635  16.179   8.408
  152    HA   SER  24           HA       SER  24   7.794  16.732   8.629
  153    HB2  SER  24           HB2      SER  24   8.158  19.154   9.309
  154    HB3  SER  24           HB3      SER  24   8.548  17.995  10.578
  155    HG   SER  24           HG       SER  24  10.288  19.253  10.590
  156    H    LEU  25           H        LEU  25  10.827  18.364   7.607
  157    HA   LEU  25           HA       LEU  25   9.824  18.985   4.962
  158    HB2  LEU  25           HB2      LEU  25  12.627  19.185   6.144
  159    HB3  LEU  25           HB3      LEU  25  12.229  19.670   4.510
  160    HG   LEU  25           HG       LEU  25  12.346  21.679   5.789
  161   HD11  LEU  25          HD11      LEU  25  10.489  21.638   4.203
  162   HD12  LEU  25          HD12      LEU  25  10.110  22.646   5.596
  163   HD13  LEU  25          HD13      LEU  25   9.402  21.034   5.460
  164   HD21  LEU  25          HD21      LEU  25  12.204  20.753   8.049
  165   HD22  LEU  25          HD22      LEU  25  10.475  20.462   7.847
  166   HD23  LEU  25          HD23      LEU  25  11.099  22.114   7.864
  167    H    LEU  26           H        LEU  26  12.036  16.569   6.376
  168    HA   LEU  26           HA       LEU  26  12.393  15.046   3.967
  169    HB2  LEU  26           HB2      LEU  26  13.837  15.006   6.141
  170    HB3  LEU  26           HB3      LEU  26  12.628  13.925   6.798
  171    HG   LEU  26           HG       LEU  26  14.317  13.338   4.315
  172   HD11  LEU  26          HD11      LEU  26  14.681  12.288   7.142
  173   HD12  LEU  26          HD12      LEU  26  15.734  13.429   6.303
  174   HD13  LEU  26          HD13      LEU  26  15.597  11.773   5.721
  175   HD21  LEU  26          HD21      LEU  26  12.204  12.083   4.247
  176   HD22  LEU  26          HD22      LEU  26  12.493  11.457   5.872
  177   HD23  LEU  26          HD23      LEU  26  13.557  10.993   4.542
  178    H    ASP  27           H        ASP  27  10.602  14.294   2.970
  179    HA   ASP  27           HA       ASP  27   8.156  13.599   4.264
  180    HB2  ASP  27           HB2      ASP  27   9.093  13.064   1.415
  181    HB3  ASP  27           HB3      ASP  27   7.436  12.880   1.989
  182    H    ASP  28           H        ASP  28   8.640  11.976   5.789
  183    HA   ASP  28           HA       ASP  28   9.675   9.418   5.394
  184    HB2  ASP  28           HB2      ASP  28   8.935  10.438   7.586
  185    HB3  ASP  28           HB3      ASP  28   7.260  10.185   7.118
  186    H    MET  29           H        MET  29   6.414  10.669   4.723
  187    HA   MET  29           HA       MET  29   5.101   8.298   4.019
  188    HB2  MET  29           HB2      MET  29   4.544  11.050   2.833
  189    HB3  MET  29           HB3      MET  29   3.432   9.687   2.906
  190    HG2  MET  29           HG2      MET  29   3.714   9.863   5.473
  191    HG3  MET  29           HG3      MET  29   4.377  11.461   5.140
  192    HE1  MET  29           HE1      MET  29   0.055  10.115   4.265
  193    HE2  MET  29           HE2      MET  29   1.273   9.134   5.091
  194    HE3  MET  29           HE3      MET  29   1.422   9.466   3.362
  195    H    ASN  30           H        ASN  30   6.828  10.644   1.940
  196    HA   ASN  30           HA       ASN  30   6.280   9.299  -0.529
  197    HB2  ASN  30           HB2      ASN  30   6.743  11.778  -0.280
  198    HB3  ASN  30           HB3      ASN  30   8.436  11.387  -0.003
  199   HD21  ASN  30          HD21      ASN  30   5.845  11.359  -2.357
  200   HD22  ASN  30          HD22      ASN  30   6.857  11.220  -3.747
  201    H    HIS  31           H        HIS  31   8.933   9.156   1.786
  202    HA   HIS  31           HA       HIS  31  10.789   7.587   0.323
  203    HB2  HIS  31           HB2      HIS  31  11.278   8.773   2.491
  204    HB3  HIS  31           HB3      HIS  31  10.291   7.586   3.339
  205    HD2  HIS  31           HD2      HIS  31  13.756   7.805   1.491
  206    HE1  HIS  31           HE1      HIS  31  13.622   4.250   3.777
  207    HE2  HIS  31           HE2      HIS  31  15.107   5.831   2.483
  208    H    CYS  32           H        CYS  32   8.047   6.708   2.408
  209    HA   CYS  32           HA       CYS  32   8.159   3.885   2.103
  210    HB2  CYS  32           HB2      CYS  32   5.824   5.708   2.803
  211    HB3  CYS  32           HB3      CYS  32   5.775   3.949   2.906
  212    HG   CYS  32           HG       CYS  32   7.563   6.107   4.856
  213    H    TYR  33           H        TYR  33   6.487   6.414   0.248
  214    HA   TYR  33           HA       TYR  33   4.934   4.841  -1.484
  215    HB2  TYR  33           HB2      TYR  33   5.974   7.663  -1.573
  216    HB3  TYR  33           HB3      TYR  33   5.368   7.001  -3.086
  217    HD1  TYR  33           HD1      TYR  33   3.018   5.937  -3.033
  218    HD2  TYR  33           HD2      TYR  33   4.372   8.642  -0.033
  219    HE1  TYR  33           HE1      TYR  33   0.710   6.413  -2.438
  220    HE2  TYR  33           HE2      TYR  33   2.050   9.123   0.584
  221    HH   TYR  33           HH       TYR  33  -0.142   8.987  -0.276
  222    H    SER  34           H        SER  34   8.352   5.650  -1.681
  223    HA   SER  34           HA       SER  34   8.965   4.808  -4.285
  224    HB2  SER  34           HB2      SER  34  10.671   4.561  -1.765
  225    HB3  SER  34           HB3      SER  34  11.278   4.415  -3.416
  226    HG   SER  34           HG       SER  34  10.104   6.718  -2.218
  227    H    ARG  35           H        ARG  35   8.827   2.876  -1.266
  228    HA   ARG  35           HA       ARG  35   9.470   0.365  -2.509
  229    HB2  ARG  35           HB2      ARG  35   8.429   1.099   0.243
  230    HB3  ARG  35           HB3      ARG  35   8.644  -0.582  -0.240
  231    HG2  ARG  35           HG2      ARG  35  10.851   1.492  -0.275
  232    HG3  ARG  35           HG3      ARG  35  10.577   0.345   1.038
  233    HD2  ARG  35           HD2      ARG  35  10.956  -1.530  -0.523
  234    HD3  ARG  35           HD3      ARG  35  11.214  -0.387  -1.844
  235    HE   ARG  35           HE       ARG  35  12.987  -0.084   0.440
  236   HH11  ARG  35          HH11      ARG  35  12.623  -1.463  -2.734
  237   HH12  ARG  35          HH12      ARG  35  14.311  -1.783  -2.891
  238   HH21  ARG  35          HH21      ARG  35  15.126  -0.500   0.185
  239   HH22  ARG  35          HH22      ARG  35  15.702  -1.234  -1.274
  240    H    LEU  36           H        LEU  36   6.446   2.030  -1.951
  241    HA   LEU  36           HA       LEU  36   4.696  -0.142  -2.515
  242    HB2  LEU  36           HB2      LEU  36   4.202   2.789  -3.044
  243    HB3  LEU  36           HB3      LEU  36   2.981   1.540  -2.973
  244    HG   LEU  36           HG       LEU  36   4.630   2.587  -0.644
  245   HD11  LEU  36          HD11      LEU  36   2.481   3.352   0.252
  246   HD12  LEU  36          HD12      LEU  36   1.658   2.775  -1.198
  247   HD13  LEU  36          HD13      LEU  36   2.830   4.091  -1.309
  248   HD21  LEU  36          HD21      LEU  36   3.322   1.061   0.805
  249   HD22  LEU  36          HD22      LEU  36   4.325   0.172  -0.336
  250   HD23  LEU  36          HD23      LEU  36   2.590   0.327  -0.626
  251    H    ARG  37           H        ARG  37   6.704   1.809  -4.611
  252    HA   ARG  37           HA       ARG  37   5.494   0.719  -7.050
  253    HB2  ARG  37           HB2      ARG  37   7.987   2.405  -6.680
  254    HB3  ARG  37           HB3      ARG  37   7.294   1.937  -8.233
  255    HG2  ARG  37           HG2      ARG  37   5.181   3.140  -7.581
  256    HG3  ARG  37           HG3      ARG  37   6.011   3.713  -6.133
  257    HD2  ARG  37           HD2      ARG  37   6.783   4.299  -9.006
  258    HD3  ARG  37           HD3      ARG  37   6.034   5.413  -7.864
  259    HE   ARG  37           HE       ARG  37   8.396   4.554  -6.685
  260   HH11  ARG  37          HH11      ARG  37   7.559   6.320  -9.545
  261   HH12  ARG  37          HH12      ARG  37   9.043   7.205  -9.554
  262   HH21  ARG  37          HH21      ARG  37  10.301   5.673  -6.753
  263   HH22  ARG  37          HH22      ARG  37  10.570   6.843  -7.997
  264    H    GLU  38           H        GLU  38   8.192  -0.007  -4.890
  265    HA   GLU  38           HA       GLU  38   9.774  -1.559  -6.739
  266    HB2  GLU  38           HB2      GLU  38   9.851  -1.499  -3.686
  267    HB3  GLU  38           HB3      GLU  38  11.074  -2.246  -4.704
  268    HG2  GLU  38           HG2      GLU  38  10.421   0.710  -4.751
  269    HG3  GLU  38           HG3      GLU  38  11.673   0.002  -3.740
  270    H    LEU  39           H        LEU  39   7.445  -2.308  -4.211
  271    HA   LEU  39           HA       LEU  39   7.823  -5.196  -4.344
  272    HB2  LEU  39           HB2      LEU  39   6.024  -3.452  -2.628
  273    HB3  LEU  39           HB3      LEU  39   6.229  -5.183  -2.428
  274    HG   LEU  39           HG       LEU  39   8.452  -3.129  -2.072
  275   HD11  LEU  39          HD11      LEU  39   8.264  -3.564   0.345
  276   HD12  LEU  39          HD12      LEU  39   6.868  -4.604   0.055
  277   HD13  LEU  39          HD13      LEU  39   6.777  -2.879  -0.309
  278   HD21  LEU  39          HD21      LEU  39   8.453  -6.113  -1.469
  279   HD22  LEU  39          HD22      LEU  39   9.764  -4.986  -1.119
  280   HD23  LEU  39          HD23      LEU  39   9.322  -5.321  -2.789
  281    H    VAL  40           H        VAL  40   6.018  -3.086  -6.158
  282    HA   VAL  40           HA       VAL  40   3.731  -4.942  -6.521
  283    HB   VAL  40           HB       VAL  40   3.884  -1.961  -7.186
  284   HG11  VAL  40          HG11      VAL  40   1.526  -3.876  -7.440
  285   HG12  VAL  40          HG12      VAL  40   2.403  -3.118  -8.769
  286   HG13  VAL  40          HG13      VAL  40   1.451  -2.125  -7.668
  287   HG21  VAL  40          HG21      VAL  40   2.240  -1.694  -5.326
  288   HG22  VAL  40          HG22      VAL  40   3.796  -2.310  -4.773
  289   HG23  VAL  40          HG23      VAL  40   2.417  -3.412  -4.937
  290    HA   PRO  41           HA       PRO  41   5.836  -5.633 -10.596
  291    HB2  PRO  41           HB2      PRO  41   4.565  -7.987 -11.171
  292    HB3  PRO  41           HB3      PRO  41   5.932  -7.896 -10.051
  293    HG2  PRO  41           HG2      PRO  41   2.980  -7.942  -9.421
  294    HG3  PRO  41           HG3      PRO  41   4.291  -8.900  -8.694
  295    HD2  PRO  41           HD2      PRO  41   3.319  -6.675  -7.490
  296    HD3  PRO  41           HD3      PRO  41   5.034  -7.120  -7.375
  297    H    GLY  42           H        GLY  42   2.487  -5.236  -9.752
  298    HA2  GLY  42           HA2      GLY  42   1.175  -5.275 -12.223
  299    HA3  GLY  42           HA3      GLY  42   0.683  -4.333 -10.828
  300    H    VAL  43           H        VAL  43   3.226  -2.782 -10.845
  301    HA   VAL  43           HA       VAL  43   2.594  -0.571 -12.435
  302    HB   VAL  43           HB       VAL  43   5.363  -1.391 -11.418
  303   HG11  VAL  43          HG11      VAL  43   5.955   1.017 -11.548
  304   HG12  VAL  43          HG12      VAL  43   4.387   1.361 -12.285
  305   HG13  VAL  43          HG13      VAL  43   5.561   0.354 -13.135
  306   HG21  VAL  43          HG21      VAL  43   3.271   0.375 -10.080
  307   HG22  VAL  43          HG22      VAL  43   4.898   0.064  -9.467
  308   HG23  VAL  43          HG23      VAL  43   3.732  -1.255  -9.579
  309    HA   PRO  44           HA       PRO  44   3.757  -2.271 -16.511
  310    HB2  PRO  44           HB2      PRO  44   3.319  -0.038 -18.037
  311    HB3  PRO  44           HB3      PRO  44   2.002  -1.015 -17.375
  312    HG2  PRO  44           HG2      PRO  44   3.184   1.541 -16.290
  313    HG3  PRO  44           HG3      PRO  44   1.473   1.110 -16.506
  314    HD2  PRO  44           HD2      PRO  44   2.709   0.918 -14.096
  315    HD3  PRO  44           HD3      PRO  44   1.443  -0.231 -14.587
  316    H    ARG  45           H        ARG  45   5.102  -1.247 -18.524
  317    HA   ARG  45           HA       ARG  45   7.816  -1.175 -17.762
  318    HB2  ARG  45           HB2      ARG  45   6.529  -0.342 -20.403
  319    HB3  ARG  45           HB3      ARG  45   8.256  -0.602 -20.175
  320    HG2  ARG  45           HG2      ARG  45   6.109  -2.722 -19.839
  321    HG3  ARG  45           HG3      ARG  45   7.137  -2.526 -21.260
  322    HD2  ARG  45           HD2      ARG  45   8.141  -3.151 -18.456
  323    HD3  ARG  45           HD3      ARG  45   7.926  -4.334 -19.748
  324    HE   ARG  45           HE       ARG  45   9.598  -2.891 -21.019
  325   HH11  ARG  45          HH11      ARG  45   9.731  -3.114 -17.562
  326   HH12  ARG  45          HH12      ARG  45  11.449  -2.924 -17.530
  327   HH21  ARG  45          HH21      ARG  45  11.775  -2.630 -20.929
  328   HH22  ARG  45          HH22      ARG  45  12.586  -2.658 -19.402
  329    H    GLY  46           H        GLY  46   8.644   0.427 -16.536
  330    HA2  GLY  46           HA2      GLY  46   9.259   2.492 -15.743
  331    HA3  GLY  46           HA3      GLY  46   8.943   3.132 -17.349
  332    H    THR  47           H        THR  47   7.305   4.535 -17.538
  333    HA   THR  47           HA       THR  47   5.417   5.724 -17.298
  334    HB   THR  47           HB       THR  47   4.355   3.380 -15.676
  335    HG1  THR  47           HG1      THR  47   5.015   2.882 -17.854
  336   HG21  THR  47          HG21      THR  47   2.967   5.407 -15.352
  337   HG22  THR  47          HG22      THR  47   2.106   4.204 -16.309
  338   HG23  THR  47          HG23      THR  47   2.830   5.604 -17.103
  339    H    GLN  48           H        GLN  48   5.418   7.554 -16.167
  340    HA   GLN  48           HA       GLN  48   6.234   7.708 -13.398
  341    HB2  GLN  48           HB2      GLN  48   5.293   9.880 -15.320
  342    HB3  GLN  48           HB3      GLN  48   5.876  10.187 -13.691
  343    HG2  GLN  48           HG2      GLN  48   7.771  10.650 -14.928
  344    HG3  GLN  48           HG3      GLN  48   8.056   8.966 -14.513
  345   HE21  GLN  48          HE21      GLN  48   9.198  10.487 -16.679
  346   HE22  GLN  48          HE22      GLN  48   8.763   9.695 -18.150
  347    H    LEU  49           H        LEU  49   4.704   6.745 -12.135
  348    HA   LEU  49           HA       LEU  49   1.860   7.121 -12.362
  349    HB2  LEU  49           HB2      LEU  49   3.463   5.997 -10.025
  350    HB3  LEU  49           HB3      LEU  49   1.736   5.809 -10.278
  351    HG   LEU  49           HG       LEU  49   3.918   4.599 -12.019
  352   HD11  LEU  49          HD11      LEU  49   2.053   3.260 -10.032
  353   HD12  LEU  49          HD12      LEU  49   3.784   3.520  -9.817
  354   HD13  LEU  49          HD13      LEU  49   3.210   2.437 -11.083
  355   HD21  LEU  49          HD21      LEU  49   1.919   5.120 -13.359
  356   HD22  LEU  49          HD22      LEU  49   0.899   4.256 -12.205
  357   HD23  LEU  49          HD23      LEU  49   2.100   3.379 -13.155
  358    H    SER  50           H        SER  50   0.597   8.686 -11.410
  359    HA   SER  50           HA       SER  50   1.524  10.756  -9.687
  360    HB2  SER  50           HB2      SER  50  -0.543  11.073 -10.973
  361    HB3  SER  50           HB3      SER  50  -1.300   9.706 -10.161
  362    HG   SER  50           HG       SER  50  -1.693  12.037  -9.424
  363    H    GLN  51           H        GLN  51   0.881  11.078  -7.377
  364    HA   GLN  51           HA       GLN  51   1.783   8.920  -5.791
  365    HB2  GLN  51           HB2      GLN  51   2.084  11.321  -5.209
  366    HB3  GLN  51           HB3      GLN  51   0.360  11.460  -4.884
  367    HG2  GLN  51           HG2      GLN  51   0.526   9.986  -2.986
  368    HG3  GLN  51           HG3      GLN  51   2.189   9.570  -3.385
  369   HE21  GLN  51          HE21      GLN  51   0.102  12.088  -2.115
  370   HE22  GLN  51          HE22      GLN  51   1.354  13.006  -1.359
  371    H    VAL  52           H        VAL  52  -1.488   9.935  -6.628
  372    HA   VAL  52           HA       VAL  52  -2.889   8.150  -4.859
  373    HB   VAL  52           HB       VAL  52  -3.928   9.227  -7.535
  374   HG11  VAL  52          HG11      VAL  52  -6.164   8.963  -6.479
  375   HG12  VAL  52          HG12      VAL  52  -5.402   8.291  -5.033
  376   HG13  VAL  52          HG13      VAL  52  -5.301   7.427  -6.569
  377   HG21  VAL  52          HG21      VAL  52  -3.120  11.110  -6.163
  378   HG22  VAL  52          HG22      VAL  52  -4.096  10.552  -4.802
  379   HG23  VAL  52          HG23      VAL  52  -4.883  11.125  -6.275
  380    H    GLU  53           H        GLU  53  -1.908   7.952  -8.316
  381    HA   GLU  53           HA       GLU  53  -2.949   5.444  -8.976
  382    HB2  GLU  53           HB2      GLU  53  -0.407   6.749 -10.035
  383    HB3  GLU  53           HB3      GLU  53  -1.165   5.330 -10.752
  384    HG2  GLU  53           HG2      GLU  53  -3.214   6.705 -11.191
  385    HG3  GLU  53           HG3      GLU  53  -2.352   8.117 -10.581
  386    H    ILE  54           H        ILE  54   0.067   6.239  -7.308
  387    HA   ILE  54           HA       ILE  54   1.318   3.724  -7.305
  388    HB   ILE  54           HB       ILE  54   1.433   5.946  -5.213
  389   HG12  ILE  54          HG12      ILE  54   3.363   5.287  -7.504
  390   HG13  ILE  54          HG13      ILE  54   2.214   6.617  -7.496
  391   HG21  ILE  54          HG21      ILE  54   3.241   3.511  -5.501
  392   HG22  ILE  54          HG22      ILE  54   2.170   3.898  -4.146
  393   HG23  ILE  54          HG23      ILE  54   3.582   4.901  -4.464
  394   HD11  ILE  54          HD11      ILE  54   3.416   7.636  -5.613
  395   HD12  ILE  54          HD12      ILE  54   4.443   7.406  -7.028
  396   HD13  ILE  54          HD13      ILE  54   4.583   6.309  -5.656
  397    H    LEU  55           H        LEU  55  -0.878   5.154  -4.820
  398    HA   LEU  55           HA       LEU  55  -1.168   2.941  -3.119
  399    HB2  LEU  55           HB2      LEU  55  -3.199   5.098  -3.815
  400    HB3  LEU  55           HB3      LEU  55  -3.405   3.951  -2.500
  401    HG   LEU  55           HG       LEU  55  -1.240   6.079  -2.678
  402   HD11  LEU  55          HD11      LEU  55  -2.401   7.143  -0.786
  403   HD12  LEU  55          HD12      LEU  55  -3.662   5.910  -0.852
  404   HD13  LEU  55          HD13      LEU  55  -3.453   7.031  -2.198
  405   HD21  LEU  55          HD21      LEU  55  -1.772   4.065  -0.461
  406   HD22  LEU  55          HD22      LEU  55  -0.625   5.402  -0.379
  407   HD23  LEU  55          HD23      LEU  55  -0.365   4.098  -1.530
  408    H    GLN  56           H        GLN  56  -3.033   3.817  -6.009
  409    HA   GLN  56           HA       GLN  56  -4.992   1.773  -5.873
  410    HB2  GLN  56           HB2      GLN  56  -4.040   3.423  -8.249
  411    HB3  GLN  56           HB3      GLN  56  -5.516   2.456  -8.215
  412    HG2  GLN  56           HG2      GLN  56  -6.466   3.853  -6.475
  413    HG3  GLN  56           HG3      GLN  56  -4.960   4.754  -6.312
  414   HE21  GLN  56          HE21      GLN  56  -7.604   5.774  -6.865
  415   HE22  GLN  56          HE22      GLN  56  -7.503   6.606  -8.375
  416    H    ARG  57           H        ARG  57  -1.815   1.892  -7.457
  417    HA   ARG  57           HA       ARG  57  -1.946  -0.611  -8.795
  418    HB2  ARG  57           HB2      ARG  57   0.209   1.341  -8.124
  419    HB3  ARG  57           HB3      ARG  57   0.765  -0.313  -8.299
  420    HG2  ARG  57           HG2      ARG  57   1.050   0.859 -10.391
  421    HG3  ARG  57           HG3      ARG  57  -0.164  -0.397 -10.587
  422    HD2  ARG  57           HD2      ARG  57  -0.813   2.546 -10.185
  423    HD3  ARG  57           HD3      ARG  57  -0.693   1.767 -11.763
  424    HE   ARG  57           HE       ARG  57  -2.523   0.280 -10.337
  425   HH11  ARG  57          HH11      ARG  57  -2.377   3.538 -11.495
  426   HH12  ARG  57          HH12      ARG  57  -4.097   3.706 -11.512
  427   HH21  ARG  57          HH21      ARG  57  -4.700   0.531 -10.343
  428   HH22  ARG  57          HH22      ARG  57  -5.397   2.024 -10.871
  429    H    VAL  58           H        VAL  58  -0.960   0.288  -5.496
  430    HA   VAL  58           HA       VAL  58  -0.162  -2.307  -4.626
  431    HB   VAL  58           HB       VAL  58  -1.239  -0.008  -2.918
  432   HG11  VAL  58          HG11      VAL  58  -1.278  -2.146  -1.702
  433   HG12  VAL  58          HG12      VAL  58  -0.041  -1.082  -1.036
  434   HG13  VAL  58          HG13      VAL  58   0.421  -2.423  -2.089
  435   HG21  VAL  58          HG21      VAL  58   1.646  -0.678  -3.627
  436   HG22  VAL  58          HG22      VAL  58   1.124   0.601  -2.527
  437   HG23  VAL  58          HG23      VAL  58   0.718   0.690  -4.240
  438    H    ILE  59           H        ILE  59  -3.312  -0.610  -4.562
  439    HA   ILE  59           HA       ILE  59  -4.821  -2.462  -3.079
  440    HB   ILE  59           HB       ILE  59  -5.766  -0.645  -5.353
  441   HG12  ILE  59          HG12      ILE  59  -5.920  -0.189  -2.326
  442   HG13  ILE  59          HG13      ILE  59  -4.710   0.532  -3.378
  443   HG21  ILE  59          HG21      ILE  59  -8.054  -0.878  -4.385
  444   HG22  ILE  59          HG22      ILE  59  -7.440  -2.072  -3.241
  445   HG23  ILE  59          HG23      ILE  59  -7.431  -2.423  -4.969
  446   HD11  ILE  59          HD11      ILE  59  -6.468   1.740  -4.576
  447   HD12  ILE  59          HD12      ILE  59  -6.468   2.105  -2.851
  448   HD13  ILE  59          HD13      ILE  59  -7.682   1.015  -3.517
  449    H    ASP  60           H        ASP  60  -4.607  -2.183  -6.663
  450    HA   ASP  60           HA       ASP  60  -5.918  -4.612  -7.280
  451    HB2  ASP  60           HB2      ASP  60  -3.973  -2.943  -8.918
  452    HB3  ASP  60           HB3      ASP  60  -4.862  -4.318  -9.567
  453    H    TYR  61           H        TYR  61  -2.538  -3.971  -6.511
  454    HA   TYR  61           HA       TYR  61  -1.378  -6.411  -7.305
  455    HB2  TYR  61           HB2      TYR  61   0.157  -4.715  -6.708
  456    HB3  TYR  61           HB3      TYR  61  -0.684  -4.342  -5.212
  457    HD1  TYR  61           HD1      TYR  61   1.283  -7.125  -6.805
  458    HD2  TYR  61           HD2      TYR  61   0.236  -5.118  -3.182
  459    HE1  TYR  61           HE1      TYR  61   2.826  -8.562  -5.561
  460    HE2  TYR  61           HE2      TYR  61   1.786  -6.559  -1.949
  461    HH   TYR  61           HH       TYR  61   2.745  -8.828  -2.225
  462    H    ILE  62           H        ILE  62  -2.691  -5.492  -4.085
  463    HA   ILE  62           HA       ILE  62  -2.271  -8.066  -2.909
  464    HB   ILE  62           HB       ILE  62  -4.146  -5.866  -1.909
  465   HG12  ILE  62          HG12      ILE  62  -1.193  -6.279  -1.187
  466   HG13  ILE  62          HG13      ILE  62  -1.781  -5.031  -2.277
  467   HG21  ILE  62          HG21      ILE  62  -4.514  -8.028  -0.788
  468   HG22  ILE  62          HG22      ILE  62  -3.777  -6.879   0.325
  469   HG23  ILE  62          HG23      ILE  62  -2.793  -8.147  -0.405
  470   HD11  ILE  62          HD11      ILE  62  -3.033  -4.011  -0.424
  471   HD12  ILE  62          HD12      ILE  62  -1.305  -4.118  -0.090
  472   HD13  ILE  62          HD13      ILE  62  -2.418  -5.258   0.666
  473    H    LEU  63           H        LEU  63  -5.037  -6.556  -4.538
  474    HA   LEU  63           HA       LEU  63  -6.974  -8.586  -4.186
  475    HB2  LEU  63           HB2      LEU  63  -6.545  -6.627  -6.476
  476    HB3  LEU  63           HB3      LEU  63  -7.943  -7.687  -6.367
  477    HG   LEU  63           HG       LEU  63  -7.244  -5.549  -4.314
  478   HD11  LEU  63          HD11      LEU  63  -9.344  -5.478  -6.504
  479   HD12  LEU  63          HD12      LEU  63  -7.869  -4.513  -6.436
  480   HD13  LEU  63          HD13      LEU  63  -9.132  -4.267  -5.234
  481   HD21  LEU  63          HD21      LEU  63  -9.736  -7.272  -4.572
  482   HD22  LEU  63          HD22      LEU  63  -9.497  -5.969  -3.406
  483   HD23  LEU  63          HD23      LEU  63  -8.494  -7.415  -3.324
  484    H    ASP  64           H        ASP  64  -4.430  -8.199  -6.657
  485    HA   ASP  64           HA       ASP  64  -5.088 -10.399  -8.290
  486    HB2  ASP  64           HB2      ASP  64  -3.606  -8.571  -9.019
  487    HB3  ASP  64           HB3      ASP  64  -2.396  -9.049  -7.833
  488    H    LEU  65           H        LEU  65  -3.054 -10.180  -5.392
  489    HA   LEU  65           HA       LEU  65  -1.863 -12.749  -5.463
  490    HB2  LEU  65           HB2      LEU  65  -2.548 -11.034  -3.044
  491    HB3  LEU  65           HB3      LEU  65  -1.451 -12.406  -3.034
  492    HG   LEU  65           HG       LEU  65  -1.014  -9.767  -4.474
  493   HD11  LEU  65          HD11      LEU  65  -0.719  -9.603  -2.054
  494   HD12  LEU  65          HD12      LEU  65   0.827  -9.451  -2.881
  495   HD13  LEU  65          HD13      LEU  65   0.407 -10.965  -2.080
  496   HD21  LEU  65          HD21      LEU  65   1.222 -10.633  -5.085
  497   HD22  LEU  65          HD22      LEU  65  -0.070 -11.574  -5.827
  498   HD23  LEU  65          HD23      LEU  65   0.788 -12.214  -4.425
  499    H    GLN  66           H        GLN  66  -4.870 -11.611  -3.966
  500    HA   GLN  66           HA       GLN  66  -5.390 -14.283  -2.782
  501    HB2  GLN  66           HB2      GLN  66  -6.627 -11.585  -2.084
  502    HB3  GLN  66           HB3      GLN  66  -6.866 -13.100  -1.209
  503    HG2  GLN  66           HG2      GLN  66  -4.463 -13.133  -0.613
  504    HG3  GLN  66           HG3      GLN  66  -4.226 -11.621  -1.490
  505   HE21  GLN  66          HE21      GLN  66  -5.110  -9.702  -0.601
  506   HE22  GLN  66          HE22      GLN  66  -5.531  -9.590   1.068
  507    H    VAL  67           H        VAL  67  -7.260 -11.642  -4.354
  508    HA   VAL  67           HA       VAL  67  -9.598 -13.278  -4.778
  509    HB   VAL  67           HB       VAL  67  -8.968 -10.552  -6.004
  510   HG11  VAL  67          HG11      VAL  67 -11.648 -11.957  -5.649
  511   HG12  VAL  67          HG12      VAL  67 -10.802 -11.690  -7.175
  512   HG13  VAL  67          HG13      VAL  67 -11.424 -10.314  -6.264
  513   HG21  VAL  67          HG21      VAL  67 -10.413 -11.171  -3.396
  514   HG22  VAL  67          HG22      VAL  67 -10.272  -9.571  -4.129
  515   HG23  VAL  67          HG23      VAL  67  -8.829 -10.410  -3.562
  516    H    VAL  68           H        VAL  68  -9.381 -14.938  -6.180
  517    HA   VAL  68           HA       VAL  68  -7.827 -14.914  -8.594
  518    HB   VAL  68           HB       VAL  68  -9.930 -16.917  -7.608
  519   HG11  VAL  68          HG11      VAL  68  -8.914 -18.531  -9.191
  520   HG12  VAL  68          HG12      VAL  68  -7.874 -17.255  -9.831
  521   HG13  VAL  68          HG13      VAL  68  -9.625 -17.154 -10.037
  522   HG21  VAL  68          HG21      VAL  68  -8.020 -16.696  -6.061
  523   HG22  VAL  68          HG22      VAL  68  -6.890 -16.992  -7.384
  524   HG23  VAL  68          HG23      VAL  68  -7.992 -18.269  -6.863
  525    H1   MET   1           H1       MET   1   5.689 -12.941  19.400
  526    H2   MET   1           H2       MET   1   6.687 -14.173  18.814
  527    H3   MET   1           H3       MET   1   6.144 -12.958  17.770
  528    HA   MET   1           HA       MET   1   8.453 -12.631  18.386
  529    HB2  MET   1           HB2      MET   1   6.561 -10.546  19.582
  530    HB3  MET   1           HB3      MET   1   8.248 -10.260  19.168
  531    HG2  MET   1           HG2      MET   1   6.842  -9.313  17.458
  532    HG3  MET   1           HG3      MET   1   7.700 -10.699  16.781
  533    HE1  MET   1           HE1      MET   1   5.162  -9.310  15.414
  534    HE2  MET   1           HE2      MET   1   4.192 -10.698  14.927
  535    HE3  MET   1           HE3      MET   1   5.938 -10.720  14.685
  536    H    GLY   2           H        GLY   2   9.708 -13.686  19.892
  537    HA2  GLY   2           HA2      GLY   2   9.083 -13.811  22.725
  538    HA3  GLY   2           HA3      GLY   2  10.526 -14.426  21.935
  539    H    HIS   3           H        HIS   3  10.922 -13.247  24.331
  540    HA   HIS   3           HA       HIS   3  11.516 -10.416  24.072
  541    HB2  HIS   3           HB2      HIS   3  10.731 -11.266  26.233
  542    HB3  HIS   3           HB3      HIS   3  12.111 -12.353  26.341
  543    HD2  HIS   3           HD2      HIS   3  14.007 -11.319  27.975
  544    HE1  HIS   3           HE1      HIS   3  13.247  -7.232  27.210
  545    HE2  HIS   3           HE2      HIS   3  14.514  -8.875  28.647
  546    H    HIS   4           H        HIS   4  13.124 -10.016  22.648
  547    HA   HIS   4           HA       HIS   4  15.866 -10.959  23.313
  548    HB2  HIS   4           HB2      HIS   4  14.709 -10.433  20.532
  549    HB3  HIS   4           HB3      HIS   4  16.422 -10.705  20.852
  550    HD2  HIS   4           HD2      HIS   4  13.045 -12.751  20.936
  551    HE1  HIS   4           HE1      HIS   4  16.337 -15.400  20.776
  552    HE2  HIS   4           HE2      HIS   4  13.846 -15.164  20.443
  553    H    HIS   5           H        HIS   5  17.505  -9.362  23.238
  554    HA   HIS   5           HA       HIS   5  16.629  -6.596  23.483
  555    HB2  HIS   5           HB2      HIS   5  18.347  -7.469  25.032
  556    HB3  HIS   5           HB3      HIS   5  19.432  -7.796  23.682
  557    HD2  HIS   5           HD2      HIS   5  17.874  -4.649  25.500
  558    HE1  HIS   5           HE1      HIS   5  21.371  -3.503  23.423
  559    HE2  HIS   5           HE2      HIS   5  19.428  -2.693  24.816
  560    H    HIS   6           H        HIS   6  16.196  -5.532  21.630
  561    HA   HIS   6           HA       HIS   6  18.064  -5.689  19.327
  562    HB2  HIS   6           HB2      HIS   6  15.239  -4.534  19.451
  563    HB3  HIS   6           HB3      HIS   6  16.246  -4.630  18.008
  564    HD2  HIS   6           HD2      HIS   6  14.122  -6.986  20.317
  565    HE1  HIS   6           HE1      HIS   6  15.151  -9.069  16.788
  566    HE2  HIS   6           HE2      HIS   6  13.736  -9.095  18.873
  567    H    HIS   7           H        HIS   7  19.273  -3.973  18.790
  568    HA   HIS   7           HA       HIS   7  19.673  -1.668  20.333
  569    HB2  HIS   7           HB2      HIS   7  20.971  -0.850  18.298
  570    HB3  HIS   7           HB3      HIS   7  21.433  -2.436  18.894
  571    HD2  HIS   7           HD2      HIS   7  20.667  -4.628  17.228
  572    HE1  HIS   7           HE1      HIS   7  19.882  -2.160  13.892
  573    HE2  HIS   7           HE2      HIS   7  20.478  -4.491  14.655
  574    H    HIS   8           H        HIS   8  19.070   0.516  20.105
  575    HA   HIS   8           HA       HIS   8  16.458   1.129  19.243
  576    HB2  HIS   8           HB2      HIS   8  18.758   3.066  19.765
  577    HB3  HIS   8           HB3      HIS   8  17.058   3.507  19.672
  578    HD2  HIS   8           HD2      HIS   8  15.467   2.583  21.874
  579    HE1  HIS   8           HE1      HIS   8  18.840   1.849  24.306
  580    HE2  HIS   8           HE2      HIS   8  16.317   1.914  24.227
  581    H    SER   9           H        SER   9  19.600   1.839  17.735
  582    HA   SER   9           HA       SER   9  20.305   2.056  15.603
  583    HB2  SER   9           HB2      SER   9  18.963   0.030  15.176
  584    HB3  SER   9           HB3      SER   9  17.538   1.016  14.874
  585    HG   SER   9           HG       SER   9  18.331   0.580  12.902
  586    H    HIS  10           H        HIS  10  19.590   3.075  13.334
  587    HA   HIS  10           HA       HIS  10  17.653   5.211  13.404
  588    HB2  HIS  10           HB2      HIS  10  19.698   6.218  14.537
  589    HB3  HIS  10           HB3      HIS  10  20.602   5.973  13.053
  590    HD1  HIS  10           HD1      HIS  10  18.175   8.238  14.683
  591    HD2  HIS  10           HD2      HIS  10  19.789   7.719  10.885
  592    HE1  HIS  10           HE1      HIS  10  17.659  10.340  13.430
  593    HE2  HIS  10           HE2      HIS  10  18.606   9.991  11.140
  594    H    MET  11           H        MET  11  16.962   5.642  11.293
  595    HA   MET  11           HA       MET  11  18.554   4.787   8.972
  596    HB2  MET  11           HB2      MET  11  17.338   2.736   9.643
  597    HB3  MET  11           HB3      MET  11  15.813   3.600   9.572
  598    HG2  MET  11           HG2      MET  11  16.155   3.915   7.116
  599    HG3  MET  11           HG3      MET  11  17.626   2.947   7.233
  600    HE1  MET  11           HE1      MET  11  14.212   2.363   9.193
  601    HE2  MET  11           HE2      MET  11  13.400   1.243   8.100
  602    HE3  MET  11           HE3      MET  11  13.680   2.913   7.604
  603    H    GLY  12           H        GLY  12  15.381   6.022  10.045
  604    HA2  GLY  12           HA2      GLY  12  15.201   8.465   8.979
  605    HA3  GLY  12           HA3      GLY  12  14.952   7.489   7.540
  606    H    GLY  13           H        GLY  13  13.080   6.219   7.347
  607    HA2  GLY  13           HA2      GLY  13  10.690   7.291   8.363
  608    HA3  GLY  13           HA3      GLY  13  10.841   5.784   7.492
  609    H    GLY  14           H        GLY  14   9.409   6.849  10.078
  610    HA2  GLY  14           HA2      GLY  14   9.314   4.356  11.484
  611    HA3  GLY  14           HA3      GLY  14  10.315   5.513  12.354
  612    H    LYS  15           H        LYS  15   9.268   6.674  13.854
  613    HA   LYS  15           HA       LYS  15   6.309   6.829  13.816
  614    HB2  LYS  15           HB2      LYS  15   8.132   7.218  16.226
  615    HB3  LYS  15           HB3      LYS  15   6.399   6.906  16.227
  616    HG2  LYS  15           HG2      LYS  15   6.793   4.619  15.416
  617    HG3  LYS  15           HG3      LYS  15   8.527   4.939  15.332
  618    HD2  LYS  15           HD2      LYS  15   8.432   5.407  17.852
  619    HD3  LYS  15           HD3      LYS  15   6.792   4.757  17.820
  620    HE2  LYS  15           HE2      LYS  15   9.342   3.277  17.091
  621    HE3  LYS  15           HE3      LYS  15   8.353   3.030  18.529
  622    HZ1  LYS  15           HZ1      LYS  15   6.543   2.289  17.093
  623    HZ2  LYS  15           HZ2      LYS  15   7.923   1.339  16.901
  624    HZ3  LYS  15           HZ3      LYS  15   7.527   2.489  15.729
  625    H    GLY  16           H        GLY  16   5.738   8.781  12.909
  626    HA2  GLY  16           HA2      GLY  16   5.938  11.158  14.419
  627    HA3  GLY  16           HA3      GLY  16   7.114  11.249  13.115
  628    HA   PRO  17           HA       PRO  17   2.768  11.337  10.920
  629    HB2  PRO  17           HB2      PRO  17   0.486  11.119  12.342
  630    HB3  PRO  17           HB3      PRO  17   1.453   9.691  11.947
  631    HG2  PRO  17           HG2      PRO  17   1.371  11.262  14.523
  632    HG3  PRO  17           HG3      PRO  17   1.307   9.501  14.289
  633    HD2  PRO  17           HD2      PRO  17   3.617  10.866  14.935
  634    HD3  PRO  17           HD3      PRO  17   3.611   9.331  14.039
  635    H    ALA  18           H        ALA  18   0.590  12.855  11.047
  636    HA   ALA  18           HA       ALA  18   1.507  15.550  11.585
  637    HB1  ALA  18           HB1      ALA  18   0.196  15.038   9.557
  638    HB2  ALA  18           HB2      ALA  18  -0.609  16.261  10.541
  639    HB3  ALA  18           HB3      ALA  18  -1.188  14.593  10.557
  640    H    ALA  19           H        ALA  19   0.445  17.106  12.944
  641    HA   ALA  19           HA       ALA  19  -0.378  16.105  15.524
  642    HB1  ALA  19           HB1      ALA  19  -0.382  18.480  16.189
  643    HB2  ALA  19           HB2      ALA  19  -0.181  18.956  14.501
  644    HB3  ALA  19           HB3      ALA  19   1.097  18.059  15.320
  645    H    GLU  20           H        GLU  20  -1.992  17.805  12.851
  646    HA   GLU  20           HA       GLU  20  -4.621  16.915  13.776
  647    HB2  GLU  20           HB2      GLU  20  -5.640  19.161  13.590
  648    HB3  GLU  20           HB3      GLU  20  -4.404  19.136  14.841
  649    HG2  GLU  20           HG2      GLU  20  -2.818  20.243  13.315
  650    HG3  GLU  20           HG3      GLU  20  -4.034  20.245  12.041
  651    H    GLU  21           H        GLU  21  -6.342  17.631  12.048
  652    HA   GLU  21           HA       GLU  21  -5.220  17.019   9.367
  653    HB2  GLU  21           HB2      GLU  21  -7.304  15.787   8.911
  654    HB3  GLU  21           HB3      GLU  21  -6.525  15.157  10.357
  655    HG2  GLU  21           HG2      GLU  21  -8.121  16.479  11.755
  656    HG3  GLU  21           HG3      GLU  21  -8.936  17.004  10.284
  657    HA   PRO  22           HA       PRO  22  -7.621  20.631   7.830
  658    HB2  PRO  22           HB2      PRO  22  -7.676  20.125   5.174
  659    HB3  PRO  22           HB3      PRO  22  -6.159  20.524   5.993
  660    HG2  PRO  22           HG2      PRO  22  -7.231  17.812   5.219
  661    HG3  PRO  22           HG3      PRO  22  -5.599  18.477   4.979
  662    HD2  PRO  22           HD2      PRO  22  -6.244  16.811   7.068
  663    HD3  PRO  22           HD3      PRO  22  -4.960  18.033   7.168
  664    H    LEU  23           H        LEU  23  -9.583  20.907   6.136
  665    HA   LEU  23           HA       LEU  23 -11.838  19.401   7.063
  666    HB2  LEU  23           HB2      LEU  23 -11.559  21.368   4.758
  667    HB3  LEU  23           HB3      LEU  23 -13.092  20.685   5.273
  668    HG   LEU  23           HG       LEU  23 -11.315  22.458   6.998
  669   HD11  LEU  23          HD11      LEU  23 -13.905  23.143   5.570
  670   HD12  LEU  23          HD12      LEU  23 -12.297  23.733   5.148
  671   HD13  LEU  23          HD13      LEU  23 -13.028  24.199   6.682
  672   HD21  LEU  23          HD21      LEU  23 -13.236  22.518   8.559
  673   HD22  LEU  23          HD22      LEU  23 -12.622  20.881   8.362
  674   HD23  LEU  23          HD23      LEU  23 -14.105  21.366   7.540
  675    H    SER  24           H        SER  24 -12.359  17.378   6.415
  676    HA   SER  24           HA       SER  24 -11.469  16.187   3.950
  677    HB2  SER  24           HB2      SER  24 -11.864  14.773   5.927
  678    HB3  SER  24           HB3      SER  24 -13.575  15.194   5.912
  679    HG   SER  24           HG       SER  24 -12.382  14.064   3.622
  680    H    LEU  25           H        LEU  25 -12.258  16.803   2.053
  681    HA   LEU  25           HA       LEU  25 -14.982  17.903   1.760
  682    HB2  LEU  25           HB2      LEU  25 -12.634  17.914  -0.178
  683    HB3  LEU  25           HB3      LEU  25 -14.146  18.780  -0.391
  684    HG   LEU  25           HG       LEU  25 -12.086  19.347   1.782
  685   HD11  LEU  25          HD11      LEU  25 -12.752  20.962  -0.699
  686   HD12  LEU  25          HD12      LEU  25 -11.274  20.038  -0.425
  687   HD13  LEU  25          HD13      LEU  25 -11.631  21.440   0.581
  688   HD21  LEU  25          HD21      LEU  25 -13.440  21.336   2.326
  689   HD22  LEU  25          HD22      LEU  25 -14.348  19.853   2.593
  690   HD23  LEU  25          HD23      LEU  25 -14.666  20.832   1.158
  691    H    LEU  26           H        LEU  26 -12.814  15.449   0.392
  692    HA   LEU  26           HA       LEU  26 -14.964  13.615  -0.235
  693    HB2  LEU  26           HB2      LEU  26 -14.773  15.238  -2.253
  694    HB3  LEU  26           HB3      LEU  26 -13.199  14.541  -2.560
  695    HG   LEU  26           HG       LEU  26 -15.829  12.992  -2.659
  696   HD11  LEU  26          HD11      LEU  26 -15.602  13.049  -5.116
  697   HD12  LEU  26          HD12      LEU  26 -14.186  14.092  -4.961
  698   HD13  LEU  26          HD13      LEU  26 -15.768  14.663  -4.431
  699   HD21  LEU  26          HD21      LEU  26 -13.975  11.473  -2.188
  700   HD22  LEU  26          HD22      LEU  26 -13.050  12.126  -3.542
  701   HD23  LEU  26          HD23      LEU  26 -14.540  11.226  -3.839
  702    H    ASP  27           H        ASP  27 -11.627  14.369  -1.166
  703    HA   ASP  27           HA       ASP  27  -9.610  13.485  -0.835
  704    HB2  ASP  27           HB2      ASP  27 -10.898  12.222   1.622
  705    HB3  ASP  27           HB3      ASP  27  -9.165  12.323   1.326
  706    H    ASP  28           H        ASP  28 -10.010  12.355  -2.813
  707    HA   ASP  28           HA       ASP  28 -10.843   9.746  -3.192
  708    HB2  ASP  28           HB2      ASP  28 -10.243  11.492  -4.949
  709    HB3  ASP  28           HB3      ASP  28  -8.545  11.091  -4.696
  710    H    MET  29           H        MET  29  -7.674  10.927  -2.172
  711    HA   MET  29           HA       MET  29  -6.232   8.492  -2.231
  712    HB2  MET  29           HB2      MET  29  -5.723  10.891  -0.424
  713    HB3  MET  29           HB3      MET  29  -4.577   9.614  -0.814
  714    HG2  MET  29           HG2      MET  29  -4.881  10.365  -3.272
  715    HG3  MET  29           HG3      MET  29  -5.594  11.823  -2.582
  716    HE1  MET  29           HE1      MET  29  -1.219  10.464  -2.011
  717    HE2  MET  29           HE2      MET  29  -2.390   9.662  -3.069
  718    HE3  MET  29           HE3      MET  29  -2.553   9.552  -1.316
  719    H    ASN  30           H        ASN  30  -8.242  10.007   0.300
  720    HA   ASN  30           HA       ASN  30  -7.538   8.302   2.469
  721    HB2  ASN  30           HB2      ASN  30  -8.629  10.495   2.808
  722    HB3  ASN  30           HB3      ASN  30 -10.081   9.919   2.002
  723   HD21  ASN  30          HD21      ASN  30 -11.485   8.528   3.138
  724   HD22  ASN  30          HD22      ASN  30 -11.358   8.290   4.843
  725    H    HIS  31           H        HIS  31 -10.049   8.095  -0.033
  726    HA   HIS  31           HA       HIS  31 -11.324   5.724   0.866
  727    HB2  HIS  31           HB2      HIS  31 -11.110   6.865  -1.949
  728    HB3  HIS  31           HB3      HIS  31 -12.174   5.536  -1.491
  729    HD2  HIS  31           HD2      HIS  31 -12.247   9.288  -1.702
  730    HE1  HIS  31           HE1      HIS  31 -15.390   8.198   0.895
  731    HE2  HIS  31           HE2      HIS  31 -14.223  10.118  -0.260
  732    H    CYS  32           H        CYS  32  -8.517   6.266  -1.250
  733    HA   CYS  32           HA       CYS  32  -7.965   3.542  -1.879
  734    HB2  CYS  32           HB2      CYS  32  -6.103   5.949  -1.822
  735    HB3  CYS  32           HB3      CYS  32  -5.676   4.373  -2.489
  736    HG   CYS  32           HG       CYS  32  -7.839   6.684  -3.733
  737    H    TYR  33           H        TYR  33  -6.918   5.609   0.817
  738    HA   TYR  33           HA       TYR  33  -5.132   3.797   2.090
  739    HB2  TYR  33           HB2      TYR  33  -6.579   6.299   2.963
  740    HB3  TYR  33           HB3      TYR  33  -5.838   5.301   4.207
  741    HD1  TYR  33           HD1      TYR  33  -3.335   4.650   3.818
  742    HD2  TYR  33           HD2      TYR  33  -5.215   7.984   1.923
  743    HE1  TYR  33           HE1      TYR  33  -1.151   5.681   3.475
  744    HE2  TYR  33           HE2      TYR  33  -3.016   9.020   1.565
  745    HH   TYR  33           HH       TYR  33  -0.781   8.935   2.471
  746    H    SER  34           H        SER  34  -8.616   4.306   2.370
  747    HA   SER  34           HA       SER  34  -9.206   2.569   4.499
  748    HB2  SER  34           HB2      SER  34 -10.875   4.126   3.569
  749    HB3  SER  34           HB3      SER  34 -10.896   3.235   2.050
  750    HG   SER  34           HG       SER  34 -12.602   2.460   3.172
  751    H    ARG  35           H        ARG  35  -9.116   1.955   0.995
  752    HA   ARG  35           HA       ARG  35  -9.653  -0.800   0.968
  753    HB2  ARG  35           HB2      ARG  35  -8.031   0.917  -0.946
  754    HB3  ARG  35           HB3      ARG  35  -8.520  -0.738  -1.296
  755    HG2  ARG  35           HG2      ARG  35 -10.709   1.104  -0.484
  756    HG3  ARG  35           HG3      ARG  35  -9.948   1.469  -2.033
  757    HD2  ARG  35           HD2      ARG  35 -11.862   0.081  -2.436
  758    HD3  ARG  35           HD3      ARG  35 -10.416  -0.874  -2.759
  759    HE   ARG  35           HE       ARG  35 -11.595  -1.163  -0.112
  760   HH11  ARG  35          HH11      ARG  35 -11.344  -2.503  -3.304
  761   HH12  ARG  35          HH12      ARG  35 -12.024  -4.017  -2.823
  762   HH21  ARG  35          HH21      ARG  35 -12.478  -3.103   0.444
  763   HH22  ARG  35          HH22      ARG  35 -12.630  -4.364  -0.733
  764    H    LEU  36           H        LEU  36  -6.526   0.910   1.327
  765    HA   LEU  36           HA       LEU  36  -4.806  -1.313   1.328
  766    HB2  LEU  36           HB2      LEU  36  -4.574   1.231   2.988
  767    HB3  LEU  36           HB3      LEU  36  -3.285   0.056   2.776
  768    HG   LEU  36           HG       LEU  36  -4.473   1.855   0.633
  769   HD11  LEU  36          HD11      LEU  36  -2.950   3.024   2.129
  770   HD12  LEU  36          HD12      LEU  36  -2.232   2.845   0.532
  771   HD13  LEU  36          HD13      LEU  36  -1.700   1.806   1.854
  772   HD21  LEU  36          HD21      LEU  36  -2.339  -0.288   0.288
  773   HD22  LEU  36          HD22      LEU  36  -2.807   0.903  -0.929
  774   HD23  LEU  36          HD23      LEU  36  -3.969  -0.309  -0.399
  775    H    ARG  37           H        ARG  37  -6.354   0.297   4.163
  776    HA   ARG  37           HA       ARG  37  -5.637  -1.648   6.081
  777    HB2  ARG  37           HB2      ARG  37  -7.840   0.417   6.082
  778    HB3  ARG  37           HB3      ARG  37  -7.572  -0.675   7.439
  779    HG2  ARG  37           HG2      ARG  37  -5.102   0.214   7.373
  780    HG3  ARG  37           HG3      ARG  37  -5.781   1.542   6.424
  781    HD2  ARG  37           HD2      ARG  37  -5.655   2.088   8.826
  782    HD3  ARG  37           HD3      ARG  37  -7.324   2.081   8.243
  783    HE   ARG  37           HE       ARG  37  -6.511  -0.442   9.367
  784   HH11  ARG  37          HH11      ARG  37  -7.813   2.642  10.210
  785   HH12  ARG  37          HH12      ARG  37  -8.520   2.053  11.665
  786   HH21  ARG  37          HH21      ARG  37  -7.446  -1.165  11.216
  787   HH22  ARG  37          HH22      ARG  37  -8.299  -0.063  12.239
  788    H    GLU  38           H        GLU  38  -8.184  -1.759   3.678
  789    HA   GLU  38           HA       GLU  38  -9.775  -3.804   5.032
  790    HB2  GLU  38           HB2      GLU  38  -9.804  -2.764   2.166
  791    HB3  GLU  38           HB3      GLU  38 -10.890  -4.030   2.735
  792    HG2  GLU  38           HG2      GLU  38 -11.885  -2.474   4.365
  793    HG3  GLU  38           HG3      GLU  38 -10.777  -1.207   3.847
  794    H    LEU  39           H        LEU  39  -7.182  -3.673   2.696
  795    HA   LEU  39           HA       LEU  39  -7.202  -6.529   2.098
  796    HB2  LEU  39           HB2      LEU  39  -5.439  -4.233   1.179
  797    HB3  LEU  39           HB3      LEU  39  -5.254  -5.889   0.623
  798    HG   LEU  39           HG       LEU  39  -7.759  -4.210   0.203
  799   HD11  LEU  39          HD11      LEU  39  -5.877  -3.293  -1.081
  800   HD12  LEU  39          HD12      LEU  39  -7.096  -4.001  -2.139
  801   HD13  LEU  39          HD13      LEU  39  -5.596  -4.876  -1.813
  802   HD21  LEU  39          HD21      LEU  39  -8.455  -5.993  -1.347
  803   HD22  LEU  39          HD22      LEU  39  -8.255  -6.615   0.287
  804   HD23  LEU  39          HD23      LEU  39  -7.019  -6.932  -0.934
  805    H    VAL  40           H        VAL  40  -5.641  -4.411   4.333
  806    HA   VAL  40           HA       VAL  40  -3.544  -6.396   4.998
  807    HB   VAL  40           HB       VAL  40  -3.758  -3.494   5.944
  808   HG11  VAL  40          HG11      VAL  40  -1.451  -5.469   6.212
  809   HG12  VAL  40          HG12      VAL  40  -2.479  -4.881   7.518
  810   HG13  VAL  40          HG13      VAL  40  -1.400  -3.764   6.682
  811   HG21  VAL  40          HG21      VAL  40  -2.040  -4.659   3.710
  812   HG22  VAL  40          HG22      VAL  40  -1.918  -3.009   4.334
  813   HG23  VAL  40          HG23      VAL  40  -3.400  -3.539   3.531
  814    HA   PRO  41           HA       PRO  41  -6.308  -7.145   8.663
  815    HB2  PRO  41           HB2      PRO  41  -5.679  -9.753   9.046
  816    HB3  PRO  41           HB3      PRO  41  -6.784  -9.255   7.753
  817    HG2  PRO  41           HG2      PRO  41  -3.828  -9.868   7.573
  818    HG3  PRO  41           HG3      PRO  41  -5.152 -10.463   6.542
  819    HD2  PRO  41           HD2      PRO  41  -3.570  -8.359   5.824
  820    HD3  PRO  41           HD3      PRO  41  -5.273  -8.469   5.337
  821    H    GLY  42           H        GLY  42  -2.930  -7.051   8.177
  822    HA2  GLY  42           HA2      GLY  42  -2.036  -7.859  10.813
  823    HA3  GLY  42           HA3      GLY  42  -1.058  -7.174   9.528
  824    H    VAL  43           H        VAL  43  -3.855  -5.328  10.372
  825    HA   VAL  43           HA       VAL  43  -2.364  -3.118  11.411
  826    HB   VAL  43           HB       VAL  43  -5.379  -3.623  11.359
  827   HG11  VAL  43          HG11      VAL  43  -5.657  -1.175  11.668
  828   HG12  VAL  43          HG12      VAL  43  -3.914  -1.009  11.904
  829   HG13  VAL  43          HG13      VAL  43  -4.877  -1.934  13.057
  830   HG21  VAL  43          HG21      VAL  43  -3.629  -2.015   9.443
  831   HG22  VAL  43          HG22      VAL  43  -5.389  -2.141   9.364
  832   HG23  VAL  43          HG23      VAL  43  -4.392  -3.572   9.106
  833    HA   PRO  44           HA       PRO  44  -2.002  -4.448  15.754
  834    HB2  PRO  44           HB2      PRO  44  -1.894  -1.857  16.885
  835    HB3  PRO  44           HB3      PRO  44  -0.517  -2.780  16.274
  836    HG2  PRO  44           HG2      PRO  44  -2.149  -0.665  14.877
  837    HG3  PRO  44           HG3      PRO  44  -0.387  -0.909  14.876
  838    HD2  PRO  44           HD2      PRO  44  -1.842  -1.675  12.778
  839    HD3  PRO  44           HD3      PRO  44  -0.521  -2.713  13.359
  840    H    ARG  45           H        ARG  45  -3.128  -4.363  17.803
  841    HA   ARG  45           HA       ARG  45  -5.891  -4.767  17.448
  842    HB2  ARG  45           HB2      ARG  45  -4.421  -6.006  19.061
  843    HB3  ARG  45           HB3      ARG  45  -4.359  -4.585  20.086
  844    HG2  ARG  45           HG2      ARG  45  -7.057  -5.756  19.418
  845    HG3  ARG  45           HG3      ARG  45  -6.044  -6.602  20.580
  846    HD2  ARG  45           HD2      ARG  45  -6.028  -4.672  22.056
  847    HD3  ARG  45           HD3      ARG  45  -6.857  -3.688  20.844
  848    HE   ARG  45           HE       ARG  45  -8.649  -5.604  21.170
  849   HH11  ARG  45          HH11      ARG  45  -6.921  -3.943  23.665
  850   HH12  ARG  45          HH12      ARG  45  -8.237  -4.062  24.775
  851   HH21  ARG  45          HH21      ARG  45 -10.291  -5.728  22.612
  852   HH22  ARG  45          HH22      ARG  45 -10.107  -5.054  24.193
  853    H    GLY  46           H        GLY  46  -7.285  -3.163  17.075
  854    HA2  GLY  46           HA2      GLY  46  -8.799  -1.510  17.578
  855    HA3  GLY  46           HA3      GLY  46  -8.052  -1.342  19.157
  856    H    THR  47           H        THR  47  -5.652  -0.967  16.837
  857    HA   THR  47           HA       THR  47  -5.583   1.936  17.253
  858    HB   THR  47           HB       THR  47  -3.497   0.155  15.901
  859    HG1  THR  47           HG1      THR  47  -4.055   0.722  18.594
  860   HG21  THR  47          HG21      THR  47  -1.928   2.009  16.387
  861   HG22  THR  47          HG22      THR  47  -3.245   2.960  17.077
  862   HG23  THR  47          HG23      THR  47  -3.246   2.571  15.356
  863    H    GLN  48           H        GLN  48  -6.074   3.398  15.721
  864    HA   GLN  48           HA       GLN  48  -7.328   2.534  13.259
  865    HB2  GLN  48           HB2      GLN  48  -8.168   4.398  14.789
  866    HB3  GLN  48           HB3      GLN  48  -6.832   5.385  14.218
  867    HG2  GLN  48           HG2      GLN  48  -8.682   6.094  12.943
  868    HG3  GLN  48           HG3      GLN  48  -7.786   5.044  11.850
  869   HE21  GLN  48          HE21      GLN  48 -10.573   5.788  11.716
  870   HE22  GLN  48          HE22      GLN  48 -11.489   4.329  11.793
  871    H    LEU  49           H        LEU  49  -4.237   3.933  14.143
  872    HA   LEU  49           HA       LEU  49  -2.343   4.539  13.060
  873    HB2  LEU  49           HB2      LEU  49  -3.506   3.179  10.599
  874    HB3  LEU  49           HB3      LEU  49  -1.832   3.661  10.803
  875    HG   LEU  49           HG       LEU  49  -3.256   1.484  12.388
  876   HD11  LEU  49          HD11      LEU  49  -1.121   1.229  10.245
  877   HD12  LEU  49          HD12      LEU  49  -2.825   0.803  10.070
  878   HD13  LEU  49          HD13      LEU  49  -1.807  -0.096  11.192
  879   HD21  LEU  49          HD21      LEU  49  -1.565   2.594  13.782
  880   HD22  LEU  49          HD22      LEU  49  -0.348   2.355  12.526
  881   HD23  LEU  49          HD23      LEU  49  -1.049   0.964  13.353
  882    H    SER  50           H        SER  50  -1.802   6.600  12.438
  883    HA   SER  50           HA       SER  50  -3.908   8.406  11.770
  884    HB2  SER  50           HB2      SER  50  -0.922   8.999  11.796
  885    HB3  SER  50           HB3      SER  50  -2.221  10.191  11.834
  886    HG   SER  50           HG       SER  50  -1.237   8.545  13.848
  887    H    GLN  51           H        GLN  51  -0.871   7.790   9.909
  888    HA   GLN  51           HA       GLN  51  -2.254   7.752   7.383
  889    HB2  GLN  51           HB2      GLN  51  -1.064   9.816   6.436
  890    HB3  GLN  51           HB3      GLN  51  -2.373  10.128   7.566
  891    HG2  GLN  51           HG2      GLN  51  -0.717  10.536   9.367
  892    HG3  GLN  51           HG3      GLN  51   0.589  10.248   8.221
  893   HE21  GLN  51          HE21      GLN  51   1.023  11.837   6.646
  894   HE22  GLN  51          HE22      GLN  51   0.397  13.437   6.759
  895    H    VAL  52           H        VAL  52   1.017   8.418   8.754
  896    HA   VAL  52           HA       VAL  52   2.393   7.252   6.496
  897    HB   VAL  52           HB       VAL  52   3.695   7.724   9.217
  898   HG11  VAL  52          HG11      VAL  52   5.700   8.181   7.832
  899   HG12  VAL  52          HG12      VAL  52   4.757   7.876   6.369
  900   HG13  VAL  52          HG13      VAL  52   5.045   6.571   7.524
  901   HG21  VAL  52          HG21      VAL  52   2.446   9.785   8.728
  902   HG22  VAL  52          HG22      VAL  52   3.165   9.856   7.118
  903   HG23  VAL  52          HG23      VAL  52   4.182  10.060   8.545
  904    H    GLU  53           H        GLU  53   1.515   6.251   9.718
  905    HA   GLU  53           HA       GLU  53   2.893   3.852  10.021
  906    HB2  GLU  53           HB2      GLU  53   0.139   4.454  11.178
  907    HB3  GLU  53           HB3      GLU  53   1.335   3.346  11.819
  908    HG2  GLU  53           HG2      GLU  53   1.839   5.040  13.239
  909    HG3  GLU  53           HG3      GLU  53   2.770   5.674  11.890
  910    H    ILE  54           H        ILE  54  -0.106   4.569   8.321
  911    HA   ILE  54           HA       ILE  54  -0.953   1.921   7.746
  912    HB   ILE  54           HB       ILE  54  -1.401   4.486   6.147
  913   HG12  ILE  54          HG12      ILE  54  -3.192   3.082   8.200
  914   HG13  ILE  54          HG13      ILE  54  -2.349   4.608   8.433
  915   HG21  ILE  54          HG21      ILE  54  -1.750   2.557   4.673
  916   HG22  ILE  54          HG22      ILE  54  -3.300   3.307   5.040
  917   HG23  ILE  54          HG23      ILE  54  -2.836   1.807   5.852
  918   HD11  ILE  54          HD11      ILE  54  -4.609   4.091   6.508
  919   HD12  ILE  54          HD12      ILE  54  -3.749   5.626   6.684
  920   HD13  ILE  54          HD13      ILE  54  -4.690   4.981   8.030
  921    H    LEU  55           H        LEU  55   1.067   4.222   5.853
  922    HA   LEU  55           HA       LEU  55   1.571   2.596   3.615
  923    HB2  LEU  55           HB2      LEU  55   3.295   4.780   4.828
  924    HB3  LEU  55           HB3      LEU  55   3.550   4.092   3.232
  925    HG   LEU  55           HG       LEU  55   1.091   5.669   4.095
  926   HD11  LEU  55          HD11      LEU  55   3.059   7.107   3.898
  927   HD12  LEU  55          HD12      LEU  55   1.925   7.427   2.588
  928   HD13  LEU  55          HD13      LEU  55   3.381   6.479   2.279
  929   HD21  LEU  55          HD21      LEU  55   0.438   5.600   1.713
  930   HD22  LEU  55          HD22      LEU  55   0.497   3.984   2.409
  931   HD23  LEU  55          HD23      LEU  55   1.805   4.539   1.363
  932    H    GLN  56           H        GLN  56   3.593   3.075   6.515
  933    HA   GLN  56           HA       GLN  56   5.627   1.210   5.907
  934    HB2  GLN  56           HB2      GLN  56   4.669   2.303   8.592
  935    HB3  GLN  56           HB3      GLN  56   6.124   1.326   8.396
  936    HG2  GLN  56           HG2      GLN  56   7.080   3.053   6.889
  937    HG3  GLN  56           HG3      GLN  56   5.629   4.031   7.105
  938   HE21  GLN  56          HE21      GLN  56   6.977   5.738   7.899
  939   HE22  GLN  56          HE22      GLN  56   7.604   5.699   9.502
  940    H    ARG  57           H        ARG  57   2.501   0.817   7.544
  941    HA   ARG  57           HA       ARG  57   2.759  -1.867   8.424
  942    HB2  ARG  57           HB2      ARG  57   0.932  -0.239   9.092
  943    HB3  ARG  57           HB3      ARG  57   0.203  -0.466   7.513
  944    HG2  ARG  57           HG2      ARG  57  -1.051  -1.817   8.995
  945    HG3  ARG  57           HG3      ARG  57  -0.021  -2.946   8.115
  946    HD2  ARG  57           HD2      ARG  57   0.637  -1.851  10.867
  947    HD3  ARG  57           HD3      ARG  57  -0.229  -3.359  10.599
  948    HE   ARG  57           HE       ARG  57   1.858  -4.056   9.324
  949   HH11  ARG  57          HH11      ARG  57   2.103  -1.768  11.905
  950   HH12  ARG  57          HH12      ARG  57   3.628  -2.377  12.434
  951   HH21  ARG  57          HH21      ARG  57   3.823  -4.791  10.006
  952   HH22  ARG  57          HH22      ARG  57   4.593  -4.052  11.365
  953    H    VAL  58           H        VAL  58   1.656  -0.473   5.354
  954    HA   VAL  58           HA       VAL  58   0.851  -2.879   4.081
  955    HB   VAL  58           HB       VAL  58   1.628  -0.173   2.891
  956   HG11  VAL  58          HG11      VAL  58   0.530  -0.909   0.787
  957   HG12  VAL  58          HG12      VAL  58   0.337  -2.532   1.460
  958   HG13  VAL  58          HG13      VAL  58   1.950  -1.883   1.167
  959   HG21  VAL  58          HG21      VAL  58  -1.122  -1.418   3.351
  960   HG22  VAL  58          HG22      VAL  58  -0.811   0.159   2.620
  961   HG23  VAL  58          HG23      VAL  58  -0.397  -0.122   4.308
  962    H    ILE  59           H        ILE  59   3.935  -1.014   3.917
  963    HA   ILE  59           HA       ILE  59   5.336  -2.609   2.076
  964    HB   ILE  59           HB       ILE  59   6.451  -1.089   4.479
  965   HG12  ILE  59          HG12      ILE  59   6.224  -0.213   1.554
  966   HG13  ILE  59          HG13      ILE  59   5.180   0.336   2.860
  967   HG21  ILE  59          HG21      ILE  59   7.957  -2.122   2.035
  968   HG22  ILE  59          HG22      ILE  59   8.114  -2.730   3.684
  969   HG23  ILE  59          HG23      ILE  59   8.642  -1.094   3.297
  970   HD11  ILE  59          HD11      ILE  59   7.091   1.390   3.950
  971   HD12  ILE  59          HD12      ILE  59   6.849   1.990   2.310
  972   HD13  ILE  59          HD13      ILE  59   8.141   0.838   2.641
  973    H    ASP  60           H        ASP  60   5.368  -2.808   5.651
  974    HA   ASP  60           HA       ASP  60   6.906  -5.125   5.993
  975    HB2  ASP  60           HB2      ASP  60   6.363  -3.570   7.822
  976    HB3  ASP  60           HB3      ASP  60   4.661  -4.010   7.732
  977    H    TYR  61           H        TYR  61   3.400  -4.781   5.560
  978    HA   TYR  61           HA       TYR  61   2.507  -7.414   5.875
  979    HB2  TYR  61           HB2      TYR  61   0.909  -5.615   5.748
  980    HB3  TYR  61           HB3      TYR  61   1.499  -5.097   4.181
  981    HD1  TYR  61           HD1      TYR  61  -0.354  -7.871   5.890
  982    HD2  TYR  61           HD2      TYR  61   0.460  -5.907   2.168
  983    HE1  TYR  61           HE1      TYR  61  -2.131  -9.165   4.811
  984    HE2  TYR  61           HE2      TYR  61  -1.331  -7.209   1.105
  985    HH   TYR  61           HH       TYR  61  -3.631  -8.937   2.830
  986    H    ILE  62           H        ILE  62   3.573  -5.759   2.897
  987    HA   ILE  62           HA       ILE  62   3.216  -7.926   1.101
  988    HB   ILE  62           HB       ILE  62   5.029  -5.481   0.844
  989   HG12  ILE  62          HG12      ILE  62   2.201  -5.917  -0.267
  990   HG13  ILE  62          HG13      ILE  62   2.581  -4.941   1.144
  991   HG21  ILE  62          HG21      ILE  62   4.947  -5.908  -1.609
  992   HG22  ILE  62          HG22      ILE  62   4.078  -7.412  -1.305
  993   HG23  ILE  62          HG23      ILE  62   5.736  -7.218  -0.732
  994   HD11  ILE  62          HD11      ILE  62   3.502  -4.386  -1.675
  995   HD12  ILE  62          HD12      ILE  62   3.853  -3.395  -0.254
  996   HD13  ILE  62          HD13      ILE  62   2.193  -3.568  -0.821
  997    H    LEU  63           H        LEU  63   6.088  -6.790   2.901
  998    HA   LEU  63           HA       LEU  63   8.004  -8.612   1.897
  999    HB2  LEU  63           HB2      LEU  63   7.850  -7.272   4.627
 1000    HB3  LEU  63           HB3      LEU  63   9.272  -8.094   3.997
 1001    HG   LEU  63           HG       LEU  63   8.022  -5.600   2.776
 1002   HD11  LEU  63          HD11      LEU  63  10.546  -5.855   4.437
 1003   HD12  LEU  63          HD12      LEU  63   9.035  -5.098   4.944
 1004   HD13  LEU  63          HD13      LEU  63   9.976  -4.386   3.637
 1005   HD21  LEU  63          HD21      LEU  63  10.613  -7.017   2.041
 1006   HD22  LEU  63          HD22      LEU  63  10.032  -5.496   1.355
 1007   HD23  LEU  63          HD23      LEU  63   9.134  -6.987   1.072
 1008    H    ASP  64           H        ASP  64   5.788  -8.822   4.642
 1009    HA   ASP  64           HA       ASP  64   6.619 -11.317   5.677
 1010    HB2  ASP  64           HB2      ASP  64   5.319  -9.608   6.944
 1011    HB3  ASP  64           HB3      ASP  64   3.919  -9.923   5.928
 1012    H    LEU  65           H        LEU  65   4.338 -10.477   3.117
 1013    HA   LEU  65           HA       LEU  65   3.283 -13.133   2.732
 1014    HB2  LEU  65           HB2      LEU  65   3.328 -10.754   0.836
 1015    HB3  LEU  65           HB3      LEU  65   2.429 -12.239   0.562
 1016    HG   LEU  65           HG       LEU  65   1.914 -10.178   2.731
 1017   HD11  LEU  65          HD11      LEU  65   1.111  -9.485   0.548
 1018   HD12  LEU  65          HD12      LEU  65  -0.250  -9.882   1.591
 1019   HD13  LEU  65          HD13      LEU  65   0.255 -11.017   0.340
 1020   HD21  LEU  65          HD21      LEU  65   0.509 -12.840   2.320
 1021   HD22  LEU  65          HD22      LEU  65  -0.005 -11.569   3.431
 1022   HD23  LEU  65          HD23      LEU  65   1.529 -12.392   3.691
 1023    H    GLN  66           H        GLN  66   5.714 -11.189   0.972
 1024    HA   GLN  66           HA       GLN  66   6.430 -13.538  -0.675
 1025    HB2  GLN  66           HB2      GLN  66   6.995 -10.594  -1.209
 1026    HB3  GLN  66           HB3      GLN  66   7.516 -11.923  -2.238
 1027    HG2  GLN  66           HG2      GLN  66   5.007 -12.480  -2.484
 1028    HG3  GLN  66           HG3      GLN  66   4.710 -10.886  -1.787
 1029   HE21  GLN  66          HE21      GLN  66   5.406  -9.025  -2.998
 1030   HE22  GLN  66          HE22      GLN  66   5.707  -9.120  -4.692
 1031    H    VAL  67           H        VAL  67   8.497 -10.699  -0.006
 1032    HA   VAL  67           HA       VAL  67  10.696 -12.585   0.598
 1033    HB   VAL  67           HB       VAL  67  12.224 -10.795  -0.392
 1034   HG11  VAL  67          HG11      VAL  67  11.630 -12.809  -1.651
 1035   HG12  VAL  67          HG12      VAL  67  11.771 -11.427  -2.738
 1036   HG13  VAL  67          HG13      VAL  67  10.175 -12.024  -2.270
 1037   HG21  VAL  67          HG21      VAL  67  10.709  -8.841  -0.250
 1038   HG22  VAL  67          HG22      VAL  67   9.612  -9.585  -1.414
 1039   HG23  VAL  67          HG23      VAL  67  11.232  -9.098  -1.915
 1040    H    VAL  68           H        VAL  68  11.520 -12.474   2.577
 1041    HA   VAL  68           HA       VAL  68  10.755 -10.434   4.451
 1042    HB   VAL  68           HB       VAL  68  12.302 -11.666   6.074
 1043   HG11  VAL  68          HG11      VAL  68  10.786 -13.615   6.293
 1044   HG12  VAL  68          HG12      VAL  68  10.135 -13.293   4.683
 1045   HG13  VAL  68          HG13      VAL  68   9.898 -12.121   5.981
 1046   HG21  VAL  68          HG21      VAL  68  13.158 -13.890   5.433
 1047   HG22  VAL  68          HG22      VAL  68  13.875 -12.643   4.415
 1048   HG23  VAL  68          HG23      VAL  68  12.583 -13.660   3.778
  Start of MODEL    3
    1    H1   MET   1           H1       MET   1 -12.378 -32.274   6.685
    2    H2   MET   1           H2       MET   1 -11.757 -31.148   5.595
    3    H3   MET   1           H3       MET   1 -13.189 -30.820   6.419
    4    HA   MET   1           HA       MET   1 -12.038 -30.796   8.521
    5    HB2  MET   1           HB2      MET   1  -9.521 -31.110   6.835
    6    HB3  MET   1           HB3      MET   1  -9.564 -30.848   8.575
    7    HG2  MET   1           HG2      MET   1 -10.602 -33.294   7.122
    8    HG3  MET   1           HG3      MET   1  -9.107 -33.187   8.057
    9    HE1  MET   1           HE1      MET   1 -11.359 -35.442   8.541
   10    HE2  MET   1           HE2      MET   1 -11.415 -35.466  10.303
   11    HE3  MET   1           HE3      MET   1  -9.863 -35.352   9.475
   12    H    GLY   2           H        GLY   2 -11.054 -29.340   5.420
   13    HA2  GLY   2           HA2      GLY   2 -10.238 -26.790   6.443
   14    HA3  GLY   2           HA3      GLY   2 -10.555 -27.197   4.768
   15    H    HIS   3           H        HIS   3 -11.341 -24.851   6.602
   16    HA   HIS   3           HA       HIS   3 -14.279 -24.922   6.468
   17    HB2  HIS   3           HB2      HIS   3 -14.231 -22.818   7.728
   18    HB3  HIS   3           HB3      HIS   3 -13.224 -24.019   8.517
   19    HD2  HIS   3           HD2      HIS   3 -10.380 -23.542   8.214
   20    HE1  HIS   3           HE1      HIS   3 -10.971 -19.438   7.390
   21    HE2  HIS   3           HE2      HIS   3  -9.260 -21.254   7.776
   22    H    HIS   4           H        HIS   4 -15.540 -23.409   5.308
   23    HA   HIS   4           HA       HIS   4 -14.310 -21.618   3.346
   24    HB2  HIS   4           HB2      HIS   4 -14.380 -23.727   2.098
   25    HB3  HIS   4           HB3      HIS   4 -16.070 -23.977   2.526
   26    HD2  HIS   4           HD2      HIS   4 -13.960 -21.462   0.293
   27    HE1  HIS   4           HE1      HIS   4 -17.939 -21.678  -1.138
   28    HE2  HIS   4           HE2      HIS   4 -15.614 -20.815  -1.598
   29    H    HIS   5           H        HIS   5 -15.623 -19.936   2.757
   30    HA   HIS   5           HA       HIS   5 -18.456 -19.781   3.135
   31    HB2  HIS   5           HB2      HIS   5 -18.457 -18.023   4.913
   32    HB3  HIS   5           HB3      HIS   5 -17.806 -19.544   5.511
   33    HD2  HIS   5           HD2      HIS   5 -15.085 -19.521   6.199
   34    HE1  HIS   5           HE1      HIS   5 -14.607 -15.353   5.642
   35    HE2  HIS   5           HE2      HIS   5 -13.648 -17.427   6.719
   36    H    HIS   6           H        HIS   6 -18.930 -17.112   3.117
   37    HA   HIS   6           HA       HIS   6 -17.122 -15.630   1.402
   38    HB2  HIS   6           HB2      HIS   6 -18.417 -17.192  -0.162
   39    HB3  HIS   6           HB3      HIS   6 -19.883 -16.331   0.289
   40    HD2  HIS   6           HD2      HIS   6 -16.480 -15.580  -1.569
   41    HE1  HIS   6           HE1      HIS   6 -19.419 -12.803  -2.801
   42    HE2  HIS   6           HE2      HIS   6 -17.155 -13.787  -3.307
   43    H    HIS   7           H        HIS   7 -18.055 -13.420   0.879
   44    HA   HIS   7           HA       HIS   7 -20.214 -12.470   2.622
   45    HB2  HIS   7           HB2      HIS   7 -18.225 -12.142   4.017
   46    HB3  HIS   7           HB3      HIS   7 -17.375 -11.350   2.695
   47    HD2  HIS   7           HD2      HIS   7 -17.326  -8.687   3.147
   48    HE1  HIS   7           HE1      HIS   7 -21.136  -8.344   4.949
   49    HE2  HIS   7           HE2      HIS   7 -18.993  -7.128   4.367
   50    H    HIS   8           H        HIS   8 -21.426 -10.932   1.644
   51    HA   HIS   8           HA       HIS   8 -20.678  -9.998  -1.045
   52    HB2  HIS   8           HB2      HIS   8 -23.064  -9.302  -1.223
   53    HB3  HIS   8           HB3      HIS   8 -22.890 -11.005  -0.831
   54    HD2  HIS   8           HD2      HIS   8 -24.511  -7.810   0.610
   55    HE1  HIS   8           HE1      HIS   8 -25.072 -10.964   3.372
   56    HE2  HIS   8           HE2      HIS   8 -25.592  -8.545   2.845
   57    H    SER   9           H        SER   9 -20.746  -7.802  -1.661
   58    HA   SER   9           HA       SER   9 -20.819  -5.734   0.462
   59    HB2  SER   9           HB2      SER   9 -18.432  -6.256  -0.054
   60    HB3  SER   9           HB3      SER   9 -18.718  -5.888  -1.753
   61    HG   SER   9           HG       SER   9 -17.836  -4.198  -0.157
   62    H    HIS  10           H        HIS  10 -20.833  -3.452  -0.665
   63    HA   HIS  10           HA       HIS  10 -22.379  -3.382  -3.153
   64    HB2  HIS  10           HB2      HIS  10 -24.008  -3.650  -1.182
   65    HB3  HIS  10           HB3      HIS  10 -23.493  -2.059  -0.635
   66    HD1  HIS  10           HD1      HIS  10 -24.164  -0.013  -2.194
   67    HD2  HIS  10           HD2      HIS  10 -25.827  -3.661  -3.280
   68    HE1  HIS  10           HE1      HIS  10 -25.993   0.535  -3.808
   69    HE2  HIS  10           HE2      HIS  10 -26.828  -1.692  -4.604
   70    H    MET  11           H        MET  11 -22.153  -1.455  -4.282
   71    HA   MET  11           HA       MET  11 -19.976   0.291  -3.509
   72    HB2  MET  11           HB2      MET  11 -20.253   1.304  -5.737
   73    HB3  MET  11           HB3      MET  11 -20.180  -0.449  -5.841
   74    HG2  MET  11           HG2      MET  11 -22.618  -0.549  -6.128
   75    HG3  MET  11           HG3      MET  11 -22.718   1.206  -5.992
   76    HE1  MET  11           HE1      MET  11 -20.120   2.139  -7.667
   77    HE2  MET  11           HE2      MET  11 -21.708   2.894  -7.807
   78    HE3  MET  11           HE3      MET  11 -20.849   2.369  -9.255
   79    H    GLY  12           H        GLY  12 -20.076   2.603  -3.530
   80    HA2  GLY  12           HA2      GLY  12 -22.517   4.105  -3.382
   81    HA3  GLY  12           HA3      GLY  12 -21.817   3.830  -1.788
   82    H    GLY  13           H        GLY  13 -21.732   6.244  -1.828
   83    HA2  GLY  13           HA2      GLY  13 -20.479   8.155  -1.748
   84    HA3  GLY  13           HA3      GLY  13 -19.078   7.119  -1.934
   85    H    GLY  14           H        GLY  14 -17.811   7.757  -3.558
   86    HA2  GLY  14           HA2      GLY  14 -18.126   7.895  -6.205
   87    HA3  GLY  14           HA3      GLY  14 -18.785   9.458  -5.735
   88    H    LYS  15           H        LYS  15 -15.882   7.547  -6.083
   89    HA   LYS  15           HA       LYS  15 -13.996   9.358  -4.907
   90    HB2  LYS  15           HB2      LYS  15 -13.686   7.066  -6.892
   91    HB3  LYS  15           HB3      LYS  15 -12.311   8.024  -6.348
   92    HG2  LYS  15           HG2      LYS  15 -12.703   7.340  -4.038
   93    HG3  LYS  15           HG3      LYS  15 -14.142   6.453  -4.526
   94    HD2  LYS  15           HD2      LYS  15 -12.360   4.859  -4.191
   95    HD3  LYS  15           HD3      LYS  15 -12.703   4.942  -5.916
   96    HE2  LYS  15           HE2      LYS  15 -10.421   6.475  -4.625
   97    HE3  LYS  15           HE3      LYS  15 -10.235   4.836  -5.243
   98    HZ1  LYS  15           HZ1      LYS  15 -10.869   5.655  -7.449
   99    HZ2  LYS  15           HZ2      LYS  15  -9.506   6.462  -6.859
  100    HZ3  LYS  15           HZ3      LYS  15 -11.009   7.225  -6.840
  101    H    GLY  16           H        GLY  16 -14.031  11.431  -5.645
  102    HA2  GLY  16           HA2      GLY  16 -13.094  11.964  -8.366
  103    HA3  GLY  16           HA3      GLY  16 -14.699  12.565  -7.984
  104    HA   PRO  17           HA       PRO  17 -12.992  16.306  -6.084
  105    HB2  PRO  17           HB2      PRO  17 -14.788  15.692  -3.729
  106    HB3  PRO  17           HB3      PRO  17 -14.600  17.199  -4.645
  107    HG2  PRO  17           HG2      PRO  17 -16.736  15.659  -5.060
  108    HG3  PRO  17           HG3      PRO  17 -15.916  16.425  -6.442
  109    HD2  PRO  17           HD2      PRO  17 -15.758  13.561  -5.488
  110    HD3  PRO  17           HD3      PRO  17 -15.845  14.193  -7.148
  111    H    ALA  18           H        ALA  18 -10.940  16.144  -5.394
  112    HA   ALA  18           HA       ALA  18 -10.211  14.555  -3.003
  113    HB1  ALA  18           HB1      ALA  18  -9.804  13.168  -5.008
  114    HB2  ALA  18           HB2      ALA  18  -8.296  13.583  -4.194
  115    HB3  ALA  18           HB3      ALA  18  -8.761  14.425  -5.677
  116    H    ALA  19           H        ALA  19  -8.916  15.662  -1.647
  117    HA   ALA  19           HA       ALA  19  -7.655  18.163  -2.345
  118    HB1  ALA  19           HB1      ALA  19  -6.863  18.151  -0.016
  119    HB2  ALA  19           HB2      ALA  19  -7.441  16.493   0.181
  120    HB3  ALA  19           HB3      ALA  19  -8.589  17.798  -0.108
  121    H    GLU  20           H        GLU  20  -5.530  18.563  -2.757
  122    HA   GLU  20           HA       GLU  20  -3.675  16.349  -3.241
  123    HB2  GLU  20           HB2      GLU  20  -3.341  19.360  -3.617
  124    HB3  GLU  20           HB3      GLU  20  -2.204  18.128  -4.168
  125    HG2  GLU  20           HG2      GLU  20  -3.820  17.248  -5.758
  126    HG3  GLU  20           HG3      GLU  20  -5.089  18.284  -5.115
  127    H    GLU  21           H        GLU  21  -1.389  16.569  -2.413
  128    HA   GLU  21           HA       GLU  21  -1.292  16.518   0.375
  129    HB2  GLU  21           HB2      GLU  21   1.157  16.313   0.195
  130    HB3  GLU  21           HB3      GLU  21   0.329  15.261  -0.937
  131    HG2  GLU  21           HG2      GLU  21   1.610  17.905  -1.692
  132    HG3  GLU  21           HG3      GLU  21   2.405  16.343  -1.830
  133    HA   PRO  22           HA       PRO  22  -1.035  21.007   1.140
  134    HB2  PRO  22           HB2      PRO  22  -1.269  20.461   4.015
  135    HB3  PRO  22           HB3      PRO  22  -2.479  21.130   2.920
  136    HG2  PRO  22           HG2      PRO  22  -2.708  18.641   4.058
  137    HG3  PRO  22           HG3      PRO  22  -3.436  19.063   2.493
  138    HD2  PRO  22           HD2      PRO  22  -0.840  17.609   3.047
  139    HD3  PRO  22           HD3      PRO  22  -2.126  17.210   1.879
  140    H    LEU  23           H        LEU  23   1.376  20.085   0.528
  141    HA   LEU  23           HA       LEU  23   3.577  20.401   0.653
  142    HB2  LEU  23           HB2      LEU  23   2.895  22.324   2.900
  143    HB3  LEU  23           HB3      LEU  23   4.475  22.209   2.142
  144    HG   LEU  23           HG       LEU  23   1.914  23.025   0.707
  145   HD11  LEU  23          HD11      LEU  23   4.218  24.759   1.625
  146   HD12  LEU  23          HD12      LEU  23   2.583  24.748   2.290
  147   HD13  LEU  23          HD13      LEU  23   2.856  25.293   0.637
  148   HD21  LEU  23          HD21      LEU  23   3.385  23.651  -1.179
  149   HD22  LEU  23          HD22      LEU  23   3.471  21.925  -0.840
  150   HD23  LEU  23          HD23      LEU  23   4.778  22.991  -0.318
  151    H    SER  24           H        SER  24   5.571  20.386   2.256
  152    HA   SER  24           HA       SER  24   5.316  18.578   4.525
  153    HB2  SER  24           HB2      SER  24   6.725  16.774   3.500
  154    HB3  SER  24           HB3      SER  24   5.206  16.984   2.627
  155    HG   SER  24           HG       SER  24   7.498  16.969   1.521
  156    H    LEU  25           H        LEU  25   7.365  18.219   5.616
  157    HA   LEU  25           HA       LEU  25   9.414  20.298   5.097
  158    HB2  LEU  25           HB2      LEU  25   8.193  20.025   7.366
  159    HB3  LEU  25           HB3      LEU  25   9.134  18.567   7.597
  160    HG   LEU  25           HG       LEU  25  10.394  21.320   7.223
  161   HD11  LEU  25          HD11      LEU  25   8.973  21.362   9.224
  162   HD12  LEU  25          HD12      LEU  25  10.675  21.426   9.667
  163   HD13  LEU  25          HD13      LEU  25   9.776  19.917   9.847
  164   HD21  LEU  25          HD21      LEU  25  11.950  19.472   6.765
  165   HD22  LEU  25          HD22      LEU  25  11.591  18.754   8.337
  166   HD23  LEU  25          HD23      LEU  25  12.403  20.319   8.241
  167    H    LEU  26           H        LEU  26   9.375  16.904   6.294
  168    HA   LEU  26           HA       LEU  26  11.627  16.219   4.476
  169    HB2  LEU  26           HB2      LEU  26  12.133  16.391   7.001
  170    HB3  LEU  26           HB3      LEU  26  11.144  14.963   7.216
  171    HG   LEU  26           HG       LEU  26  13.611  14.978   5.427
  172   HD11  LEU  26          HD11      LEU  26  14.312  15.654   7.681
  173   HD12  LEU  26          HD12      LEU  26  14.914  14.047   7.288
  174   HD13  LEU  26          HD13      LEU  26  13.529  14.228   8.369
  175   HD21  LEU  26          HD21      LEU  26  13.613  12.537   5.768
  176   HD22  LEU  26          HD22      LEU  26  12.097  13.072   5.051
  177   HD23  LEU  26          HD23      LEU  26  12.160  12.660   6.765
  178    H    ASP  27           H        ASP  27  10.927  14.850   2.936
  179    HA   ASP  27           HA       ASP  27   8.299  13.682   3.039
  180    HB2  ASP  27           HB2      ASP  27  10.484  13.615   0.918
  181    HB3  ASP  27           HB3      ASP  27   8.884  12.906   0.696
  182    H    ASP  28           H        ASP  28   8.669  12.218   4.857
  183    HA   ASP  28           HA       ASP  28  10.197   9.806   4.587
  184    HB2  ASP  28           HB2      ASP  28   9.390  10.828   6.774
  185    HB3  ASP  28           HB3      ASP  28   7.756  10.319   6.362
  186    H    MET  29           H        MET  29   6.864  10.765   3.886
  187    HA   MET  29           HA       MET  29   5.713   8.245   3.378
  188    HB2  MET  29           HB2      MET  29   4.864  10.881   2.105
  189    HB3  MET  29           HB3      MET  29   3.876   9.440   2.297
  190    HG2  MET  29           HG2      MET  29   4.182   9.751   4.816
  191    HG3  MET  29           HG3      MET  29   4.823  11.345   4.428
  192    HE1  MET  29           HE1      MET  29   1.726   8.983   4.452
  193    HE2  MET  29           HE2      MET  29   1.839   9.310   2.719
  194    HE3  MET  29           HE3      MET  29   0.487   9.953   3.651
  195    H    ASN  30           H        ASN  30   7.427  10.506   1.251
  196    HA   ASN  30           HA       ASN  30   6.934   9.365  -1.261
  197    HB2  ASN  30           HB2      ASN  30   8.012  11.577  -0.909
  198    HB3  ASN  30           HB3      ASN  30   9.455  10.781  -0.292
  199   HD21  ASN  30          HD21      ASN  30  10.824  11.564  -1.859
  200   HD22  ASN  30          HD22      ASN  30  10.735  11.112  -3.520
  201    H    HIS  31           H        HIS  31   9.483   8.578   1.116
  202    HA   HIS  31           HA       HIS  31  10.748   6.551  -0.482
  203    HB2  HIS  31           HB2      HIS  31  10.964   7.125   2.498
  204    HB3  HIS  31           HB3      HIS  31  11.975   5.968   1.628
  205    HD2  HIS  31           HD2      HIS  31  11.906   9.671   2.449
  206    HE1  HIS  31           HE1      HIS  31  14.654   9.176  -0.715
  207    HE2  HIS  31           HE2      HIS  31  13.558  10.831   0.833
  208    H    CYS  32           H        CYS  32   8.180   6.517   1.936
  209    HA   CYS  32           HA       CYS  32   7.826   3.702   2.141
  210    HB2  CYS  32           HB2      CYS  32   5.736   5.907   2.404
  211    HB3  CYS  32           HB3      CYS  32   5.542   4.243   2.948
  212    HG   CYS  32           HG       CYS  32   7.074   6.803   4.451
  213    H    TYR  33           H        TYR  33   6.489   6.102  -0.086
  214    HA   TYR  33           HA       TYR  33   4.840   4.382  -1.637
  215    HB2  TYR  33           HB2      TYR  33   5.939   7.180  -2.025
  216    HB3  TYR  33           HB3      TYR  33   5.086   6.387  -3.343
  217    HD1  TYR  33           HD1      TYR  33   2.838   5.096  -2.295
  218    HD2  TYR  33           HD2      TYR  33   4.515   8.774  -0.922
  219    HE1  TYR  33           HE1      TYR  33   0.656   5.780  -1.489
  220    HE2  TYR  33           HE2      TYR  33   2.311   9.458  -0.082
  221    HH   TYR  33           HH       TYR  33  -0.025   8.973  -0.468
  222    H    SER  34           H        SER  34   8.197   5.410  -1.919
  223    HA   SER  34           HA       SER  34   8.858   4.259  -4.405
  224    HB2  SER  34           HB2      SER  34  10.393   5.812  -3.266
  225    HB3  SER  34           HB3      SER  34  10.608   4.671  -1.941
  226    HG   SER  34           HG       SER  34  11.770   4.729  -4.437
  227    H    ARG  35           H        ARG  35   9.041   2.936  -1.099
  228    HA   ARG  35           HA       ARG  35  10.014   0.372  -1.682
  229    HB2  ARG  35           HB2      ARG  35   8.451   1.405   0.660
  230    HB3  ARG  35           HB3      ARG  35   9.070  -0.253   0.569
  231    HG2  ARG  35           HG2      ARG  35  11.352   0.624   0.199
  232    HG3  ARG  35           HG3      ARG  35  10.734   2.274   0.361
  233    HD2  ARG  35           HD2      ARG  35  11.702   1.627   2.419
  234    HD3  ARG  35           HD3      ARG  35   9.958   1.685   2.636
  235    HE   ARG  35           HE       ARG  35  10.835  -0.945   1.983
  236   HH11  ARG  35          HH11      ARG  35  10.585   1.222   4.679
  237   HH12  ARG  35          HH12      ARG  35  10.691  -0.059   5.830
  238   HH21  ARG  35          HH21      ARG  35  10.992  -2.527   3.477
  239   HH22  ARG  35          HH22      ARG  35  10.931  -2.147   5.163
  240    H    LEU  36           H        LEU  36   6.647   1.501  -1.330
  241    HA   LEU  36           HA       LEU  36   5.242  -0.847  -1.888
  242    HB2  LEU  36           HB2      LEU  36   4.628   2.027  -2.703
  243    HB3  LEU  36           HB3      LEU  36   3.488   0.708  -2.894
  244    HG   LEU  36           HG       LEU  36   4.578   1.675  -0.219
  245   HD11  LEU  36          HD11      LEU  36   2.344   2.615   0.187
  246   HD12  LEU  36          HD12      LEU  36   1.847   2.162  -1.446
  247   HD13  LEU  36          HD13      LEU  36   3.114   3.367  -1.209
  248   HD21  LEU  36          HD21      LEU  36   4.003  -0.715  -0.156
  249   HD22  LEU  36          HD22      LEU  36   2.398  -0.366  -0.804
  250   HD23  LEU  36          HD23      LEU  36   2.857   0.226   0.794
  251    H    ARG  37           H        ARG  37   6.389   1.633  -4.182
  252    HA   ARG  37           HA       ARG  37   5.613   0.466  -6.604
  253    HB2  ARG  37           HB2      ARG  37   6.290   2.855  -6.144
  254    HB3  ARG  37           HB3      ARG  37   7.967   2.327  -6.170
  255    HG2  ARG  37           HG2      ARG  37   7.742   1.628  -8.503
  256    HG3  ARG  37           HG3      ARG  37   6.028   2.052  -8.489
  257    HD2  ARG  37           HD2      ARG  37   7.294   3.799  -9.578
  258    HD3  ARG  37           HD3      ARG  37   6.635   4.417  -8.065
  259    HE   ARG  37           HE       ARG  37   9.289   3.429  -7.711
  260   HH11  ARG  37          HH11      ARG  37   7.589   6.181  -8.928
  261   HH12  ARG  37          HH12      ARG  37   8.930   7.241  -8.699
  262   HH21  ARG  37          HH21      ARG  37  10.987   4.826  -7.440
  263   HH22  ARG  37          HH22      ARG  37  10.810   6.491  -7.857
  264    H    GLU  38           H        GLU  38   8.432  -0.186  -4.604
  265    HA   GLU  38           HA       GLU  38  10.055  -1.497  -6.596
  266    HB2  GLU  38           HB2      GLU  38  10.142  -1.694  -3.552
  267    HB3  GLU  38           HB3      GLU  38  11.348  -2.400  -4.622
  268    HG2  GLU  38           HG2      GLU  38  10.748   0.557  -4.357
  269    HG3  GLU  38           HG3      GLU  38  12.100  -0.284  -3.611
  270    H    LEU  39           H        LEU  39   7.725  -2.571  -4.187
  271    HA   LEU  39           HA       LEU  39   8.061  -5.404  -4.712
  272    HB2  LEU  39           HB2      LEU  39   5.966  -3.960  -3.038
  273    HB3  LEU  39           HB3      LEU  39   6.322  -5.682  -2.992
  274    HG   LEU  39           HG       LEU  39   8.238  -3.467  -2.141
  275   HD11  LEU  39          HD11      LEU  39   6.740  -5.428  -0.384
  276   HD12  LEU  39          HD12      LEU  39   6.375  -3.712  -0.557
  277   HD13  LEU  39          HD13      LEU  39   7.906  -4.215   0.156
  278   HD21  LEU  39          HD21      LEU  39   8.613  -6.479  -1.966
  279   HD22  LEU  39          HD22      LEU  39   9.698  -5.262  -1.290
  280   HD23  LEU  39          HD23      LEU  39   9.487  -5.375  -3.035
  281    H    VAL  40           H        VAL  40   6.021  -2.840  -5.907
  282    HA   VAL  40           HA       VAL  40   4.046  -4.652  -7.114
  283    HB   VAL  40           HB       VAL  40   4.189  -1.599  -7.278
  284   HG11  VAL  40          HG11      VAL  40   1.900  -3.482  -8.011
  285   HG12  VAL  40          HG12      VAL  40   2.890  -2.558  -9.142
  286   HG13  VAL  40          HG13      VAL  40   1.820  -1.716  -8.024
  287   HG21  VAL  40          HG21      VAL  40   2.528  -3.346  -5.416
  288   HG22  VAL  40          HG22      VAL  40   2.395  -1.590  -5.562
  289   HG23  VAL  40          HG23      VAL  40   3.888  -2.314  -4.961
  290    HA   PRO  41           HA       PRO  41   6.579  -4.331 -10.980
  291    HB2  PRO  41           HB2      PRO  41   5.872  -6.676 -12.105
  292    HB3  PRO  41           HB3      PRO  41   6.955  -6.638 -10.705
  293    HG2  PRO  41           HG2      PRO  41   3.992  -7.204 -10.788
  294    HG3  PRO  41           HG3      PRO  41   5.271  -8.075  -9.914
  295    HD2  PRO  41           HD2      PRO  41   3.641  -6.159  -8.753
  296    HD3  PRO  41           HD3      PRO  41   5.263  -6.563  -8.157
  297    H    GLY  42           H        GLY  42   3.229  -4.195 -10.407
  298    HA2  GLY  42           HA2      GLY  42   2.289  -4.112 -13.168
  299    HA3  GLY  42           HA3      GLY  42   1.331  -3.878 -11.716
  300    H    VAL  43           H        VAL  43   4.212  -2.189 -12.955
  301    HA   VAL  43           HA       VAL  43   2.766   0.397 -12.902
  302    HB   VAL  43           HB       VAL  43   5.777  -0.119 -12.695
  303   HG11  VAL  43          HG11      VAL  43   5.983   2.310 -12.211
  304   HG12  VAL  43          HG12      VAL  43   4.259   2.521 -12.526
  305   HG13  VAL  43          HG13      VAL  43   5.338   2.018 -13.828
  306   HG21  VAL  43          HG21      VAL  43   5.551   0.660 -10.339
  307   HG22  VAL  43          HG22      VAL  43   4.609  -0.799 -10.638
  308   HG23  VAL  43          HG23      VAL  43   3.798   0.765 -10.545
  309    HA   PRO  44           HA       PRO  44   3.319  -0.053 -17.450
  310    HB2  PRO  44           HB2      PRO  44   1.701   2.437 -17.610
  311    HB3  PRO  44           HB3      PRO  44   1.358   0.839 -18.278
  312    HG2  PRO  44           HG2      PRO  44  -0.042   1.826 -16.181
  313    HG3  PRO  44           HG3      PRO  44   0.328   0.093 -16.322
  314    HD2  PRO  44           HD2      PRO  44   1.721   2.200 -14.652
  315    HD3  PRO  44           HD3      PRO  44   1.220   0.553 -14.197
  316    H    ARG  45           H        ARG  45   5.165   0.639 -18.433
  317    HA   ARG  45           HA       ARG  45   6.706   2.851 -17.434
  318    HB2  ARG  45           HB2      ARG  45   7.144   0.918 -19.740
  319    HB3  ARG  45           HB3      ARG  45   8.257   2.242 -19.430
  320    HG2  ARG  45           HG2      ARG  45   9.185   0.245 -18.465
  321    HG3  ARG  45           HG3      ARG  45   8.689   1.302 -17.148
  322    HD2  ARG  45           HD2      ARG  45   6.661  -0.069 -16.806
  323    HD3  ARG  45           HD3      ARG  45   7.144  -1.114 -18.151
  324    HE   ARG  45           HE       ARG  45   9.258  -1.046 -16.325
  325   HH11  ARG  45          HH11      ARG  45   5.992  -2.202 -16.298
  326   HH12  ARG  45          HH12      ARG  45   6.371  -3.510 -15.238
  327   HH21  ARG  45          HH21      ARG  45   9.697  -2.710 -14.979
  328   HH22  ARG  45          HH22      ARG  45   8.437  -3.792 -14.492
  329    H    GLY  46           H        GLY  46   6.514   4.932 -18.001
  330    HA2  GLY  46           HA2      GLY  46   6.545   6.689 -19.668
  331    HA3  GLY  46           HA3      GLY  46   5.494   5.716 -20.687
  332    H    THR  47           H        THR  47   4.037   5.101 -17.961
  333    HA   THR  47           HA       THR  47   1.924   7.020 -18.270
  334    HB   THR  47           HB       THR  47   2.390   4.792 -16.233
  335    HG1  THR  47           HG1      THR  47   0.335   4.818 -18.158
  336   HG21  THR  47          HG21      THR  47  -0.116   6.508 -16.559
  337   HG22  THR  47          HG22      THR  47   0.914   6.419 -15.126
  338   HG23  THR  47          HG23      THR  47  -0.034   5.015 -15.619
  339    H    GLN  48           H        GLN  48   4.348   6.442 -15.705
  340    HA   GLN  48           HA       GLN  48   5.060   7.540 -13.885
  341    HB2  GLN  48           HB2      GLN  48   5.455   9.460 -15.392
  342    HB3  GLN  48           HB3      GLN  48   3.806  10.021 -15.129
  343    HG2  GLN  48           HG2      GLN  48   4.344  10.373 -12.713
  344    HG3  GLN  48           HG3      GLN  48   6.006   9.868 -13.033
  345   HE21  GLN  48          HE21      GLN  48   7.328  11.241 -14.340
  346   HE22  GLN  48          HE22      GLN  48   6.963  12.916 -14.528
  347    H    LEU  49           H        LEU  49   4.362   7.615 -11.812
  348    HA   LEU  49           HA       LEU  49   1.430   7.631 -11.313
  349    HB2  LEU  49           HB2      LEU  49   3.636   6.330  -9.664
  350    HB3  LEU  49           HB3      LEU  49   1.909   6.186  -9.381
  351    HG   LEU  49           HG       LEU  49   3.387   5.078 -11.801
  352   HD11  LEU  49          HD11      LEU  49   3.959   3.862  -9.739
  353   HD12  LEU  49          HD12      LEU  49   3.001   2.862 -10.828
  354   HD13  LEU  49          HD13      LEU  49   2.243   3.592  -9.410
  355   HD21  LEU  49          HD21      LEU  49   1.293   3.924 -12.360
  356   HD22  LEU  49          HD22      LEU  49   1.075   5.671 -12.380
  357   HD23  LEU  49          HD23      LEU  49   0.473   4.725 -11.017
  358    H    SER  50           H        SER  50   0.620   9.256 -10.038
  359    HA   SER  50           HA       SER  50   2.286  10.928  -8.312
  360    HB2  SER  50           HB2      SER  50   0.229  12.123  -7.773
  361    HB3  SER  50           HB3      SER  50   0.209  11.805  -9.507
  362    HG   SER  50           HG       SER  50  -1.740  11.104  -8.972
  363    H    GLN  51           H        GLN  51   1.337  11.220  -5.902
  364    HA   GLN  51           HA       GLN  51   1.727   8.838  -4.452
  365    HB2  GLN  51           HB2      GLN  51   0.315  11.381  -3.556
  366    HB3  GLN  51           HB3      GLN  51   0.842  10.096  -2.474
  367    HG2  GLN  51           HG2      GLN  51   3.204  10.505  -3.218
  368    HG3  GLN  51           HG3      GLN  51   2.629  11.873  -4.168
  369   HE21  GLN  51          HE21      GLN  51   1.898  13.748  -3.047
  370   HE22  GLN  51          HE22      GLN  51   2.300  14.027  -1.395
  371    H    VAL  52           H        VAL  52  -1.272  10.316  -5.649
  372    HA   VAL  52           HA       VAL  52  -3.110   8.544  -4.337
  373    HB   VAL  52           HB       VAL  52  -3.643   9.987  -6.985
  374   HG11  VAL  52          HG11      VAL  52  -5.356   8.347  -6.345
  375   HG12  VAL  52          HG12      VAL  52  -6.001   9.984  -6.221
  376   HG13  VAL  52          HG13      VAL  52  -5.531   9.110  -4.758
  377   HG21  VAL  52          HG21      VAL  52  -2.762  11.653  -5.415
  378   HG22  VAL  52          HG22      VAL  52  -3.919  11.136  -4.185
  379   HG23  VAL  52          HG23      VAL  52  -4.494  11.906  -5.666
  380    H    GLU  53           H        GLU  53  -1.658   8.577  -7.605
  381    HA   GLU  53           HA       GLU  53  -2.980   6.330  -8.678
  382    HB2  GLU  53           HB2      GLU  53  -0.243   7.445  -9.415
  383    HB3  GLU  53           HB3      GLU  53  -1.161   6.301 -10.386
  384    HG2  GLU  53           HG2      GLU  53  -1.937   9.165  -9.762
  385    HG3  GLU  53           HG3      GLU  53  -1.365   8.540 -11.307
  386    H    ILE  54           H        ILE  54   0.067   6.569  -6.853
  387    HA   ILE  54           HA       ILE  54   0.904   3.880  -7.048
  388    HB   ILE  54           HB       ILE  54   1.428   5.917  -4.833
  389   HG12  ILE  54          HG12      ILE  54   3.239   4.978  -7.121
  390   HG13  ILE  54          HG13      ILE  54   2.346   6.492  -7.105
  391   HG21  ILE  54          HG21      ILE  54   1.751   3.736  -3.825
  392   HG22  ILE  54          HG22      ILE  54   3.344   4.424  -4.138
  393   HG23  ILE  54          HG23      ILE  54   2.704   3.171  -5.208
  394   HD11  ILE  54          HD11      ILE  54   4.678   6.838  -6.582
  395   HD12  ILE  54          HD12      ILE  54   4.570   5.733  -5.214
  396   HD13  ILE  54          HD13      ILE  54   3.673   7.255  -5.195
  397    H    LEU  55           H        LEU  55  -1.094   5.498  -4.508
  398    HA   LEU  55           HA       LEU  55  -1.678   3.381  -2.823
  399    HB2  LEU  55           HB2      LEU  55  -3.565   5.572  -3.775
  400    HB3  LEU  55           HB3      LEU  55  -3.923   4.499  -2.433
  401    HG   LEU  55           HG       LEU  55  -1.628   6.494  -2.504
  402   HD11  LEU  55          HD11      LEU  55  -2.918   7.774  -0.840
  403   HD12  LEU  55          HD12      LEU  55  -4.261   6.639  -0.997
  404   HD13  LEU  55          HD13      LEU  55  -3.786   7.643  -2.368
  405   HD21  LEU  55          HD21      LEU  55  -1.345   5.956  -0.114
  406   HD22  LEU  55          HD22      LEU  55  -1.058   4.550  -1.136
  407   HD23  LEU  55          HD23      LEU  55  -2.578   4.697  -0.248
  408    H    GLN  56           H        GLN  56  -3.318   4.223  -5.846
  409    HA   GLN  56           HA       GLN  56  -5.270   2.155  -5.818
  410    HB2  GLN  56           HB2      GLN  56  -4.200   3.841  -8.117
  411    HB3  GLN  56           HB3      GLN  56  -5.647   2.832  -8.200
  412    HG2  GLN  56           HG2      GLN  56  -6.745   4.198  -6.482
  413    HG3  GLN  56           HG3      GLN  56  -5.282   5.160  -6.274
  414   HE21  GLN  56          HE21      GLN  56  -4.717   6.646  -7.905
  415   HE22  GLN  56          HE22      GLN  56  -5.848   7.190  -9.087
  416    H    ARG  57           H        ARG  57  -2.016   2.346  -7.345
  417    HA   ARG  57           HA       ARG  57  -2.163  -0.124  -8.781
  418    HB2  ARG  57           HB2      ARG  57   0.308   1.368  -7.815
  419    HB3  ARG  57           HB3      ARG  57   0.328   0.035  -8.956
  420    HG2  ARG  57           HG2      ARG  57  -0.899   2.769  -9.418
  421    HG3  ARG  57           HG3      ARG  57   0.615   2.177 -10.091
  422    HD2  ARG  57           HD2      ARG  57  -0.977   2.017 -11.855
  423    HD3  ARG  57           HD3      ARG  57  -0.770   0.370 -11.264
  424    HE   ARG  57           HE       ARG  57  -2.927   0.411 -10.366
  425   HH11  ARG  57          HH11      ARG  57  -2.255   3.480 -11.829
  426   HH12  ARG  57          HH12      ARG  57  -3.911   3.958 -11.782
  427   HH21  ARG  57          HH21      ARG  57  -5.007   1.083 -10.291
  428   HH22  ARG  57          HH22      ARG  57  -5.439   2.639 -10.917
  429    H    VAL  58           H        VAL  58  -1.158   0.684  -5.510
  430    HA   VAL  58           HA       VAL  58  -0.102  -1.856  -4.774
  431    HB   VAL  58           HB       VAL  58  -1.229   0.397  -3.046
  432   HG11  VAL  58          HG11      VAL  58  -1.304  -1.701  -1.777
  433   HG12  VAL  58          HG12      VAL  58  -0.035  -0.656  -1.144
  434   HG13  VAL  58          HG13      VAL  58   0.386  -2.031  -2.169
  435   HG21  VAL  58          HG21      VAL  58   1.138   0.985  -2.655
  436   HG22  VAL  58          HG22      VAL  58   0.757   1.035  -4.374
  437   HG23  VAL  58          HG23      VAL  58   1.656  -0.330  -3.713
  438    H    ILE  59           H        ILE  59  -3.369  -0.382  -4.452
  439    HA   ILE  59           HA       ILE  59  -4.695  -2.509  -3.182
  440    HB   ILE  59           HB       ILE  59  -5.783  -0.521  -5.230
  441   HG12  ILE  59          HG12      ILE  59  -6.013  -0.507  -2.175
  442   HG13  ILE  59          HG13      ILE  59  -4.876   0.469  -3.095
  443   HG21  ILE  59          HG21      ILE  59  -7.374  -2.365  -3.398
  444   HG22  ILE  59          HG22      ILE  59  -7.287  -2.469  -5.156
  445   HG23  ILE  59          HG23      ILE  59  -8.060  -1.080  -4.396
  446   HD11  ILE  59          HD11      ILE  59  -7.881   0.680  -3.220
  447   HD12  ILE  59          HD12      ILE  59  -6.735   1.670  -4.129
  448   HD13  ILE  59          HD13      ILE  59  -6.784   1.766  -2.371
  449    H    ASP  60           H        ASP  60  -4.344  -1.882  -6.705
  450    HA   ASP  60           HA       ASP  60  -5.531  -4.167  -7.762
  451    HB2  ASP  60           HB2      ASP  60  -3.116  -2.641  -8.836
  452    HB3  ASP  60           HB3      ASP  60  -4.056  -3.797  -9.773
  453    H    TYR  61           H        TYR  61  -2.164  -3.703  -6.787
  454    HA   TYR  61           HA       TYR  61  -1.043  -6.161  -7.478
  455    HB2  TYR  61           HB2      TYR  61   0.346  -4.259  -6.858
  456    HB3  TYR  61           HB3      TYR  61  -0.342  -4.216  -5.240
  457    HD1  TYR  61           HD1      TYR  61   1.754  -6.339  -7.512
  458    HD2  TYR  61           HD2      TYR  61   0.712  -5.451  -3.458
  459    HE1  TYR  61           HE1      TYR  61   3.558  -7.795  -6.732
  460    HE2  TYR  61           HE2      TYR  61   2.536  -6.911  -2.689
  461    HH   TYR  61           HH       TYR  61   4.975  -8.046  -4.758
  462    H    ILE  62           H        ILE  62  -2.506  -5.181  -4.355
  463    HA   ILE  62           HA       ILE  62  -2.101  -7.685  -3.047
  464    HB   ILE  62           HB       ILE  62  -4.093  -5.477  -2.325
  465   HG12  ILE  62          HG12      ILE  62  -1.258  -5.947  -1.248
  466   HG13  ILE  62          HG13      ILE  62  -1.691  -4.695  -2.403
  467   HG21  ILE  62          HG21      ILE  62  -2.989  -7.729  -0.586
  468   HG22  ILE  62          HG22      ILE  62  -4.641  -7.616  -1.196
  469   HG23  ILE  62          HG23      ILE  62  -4.052  -6.428  -0.035
  470   HD11  ILE  62          HD11      ILE  62  -1.438  -3.793  -0.169
  471   HD12  ILE  62          HD12      ILE  62  -2.675  -4.887   0.446
  472   HD13  ILE  62          HD13      ILE  62  -3.108  -3.626  -0.711
  473    H    LEU  63           H        LEU  63  -4.725  -6.407  -5.073
  474    HA   LEU  63           HA       LEU  63  -6.617  -8.491  -4.632
  475    HB2  LEU  63           HB2      LEU  63  -6.210  -6.698  -7.054
  476    HB3  LEU  63           HB3      LEU  63  -7.587  -7.768  -6.846
  477    HG   LEU  63           HG       LEU  63  -6.913  -5.396  -5.061
  478   HD11  LEU  63          HD11      LEU  63  -8.901  -4.318  -6.025
  479   HD12  LEU  63          HD12      LEU  63  -9.121  -5.689  -7.116
  480   HD13  LEU  63          HD13      LEU  63  -7.689  -4.667  -7.256
  481   HD21  LEU  63          HD21      LEU  63  -8.000  -7.150  -3.747
  482   HD22  LEU  63          HD22      LEU  63  -9.306  -7.262  -4.931
  483   HD23  LEU  63          HD23      LEU  63  -9.099  -5.792  -3.978
  484    H    ASP  64           H        ASP  64  -3.841  -8.233  -6.857
  485    HA   ASP  64           HA       ASP  64  -4.198 -10.710  -8.205
  486    HB2  ASP  64           HB2      ASP  64  -1.737  -8.999  -7.691
  487    HB3  ASP  64           HB3      ASP  64  -1.648 -10.497  -8.603
  488    H    LEU  65           H        LEU  65  -2.680  -9.892  -5.114
  489    HA   LEU  65           HA       LEU  65  -1.443 -12.424  -4.596
  490    HB2  LEU  65           HB2      LEU  65  -2.341 -10.301  -2.608
  491    HB3  LEU  65           HB3      LEU  65  -1.234 -11.620  -2.260
  492    HG   LEU  65           HG       LEU  65  -0.708  -9.257  -4.104
  493   HD11  LEU  65          HD11      LEU  65  -0.571  -8.650  -1.748
  494   HD12  LEU  65          HD12      LEU  65   1.032  -8.643  -2.476
  495   HD13  LEU  65          HD13      LEU  65   0.547  -9.984  -1.442
  496   HD21  LEU  65          HD21      LEU  65   1.571 -10.145  -4.407
  497   HD22  LEU  65          HD22      LEU  65   0.360 -11.246  -5.058
  498   HD23  LEU  65          HD23      LEU  65   1.131 -11.603  -3.512
  499    H    GLN  66           H        GLN  66  -4.619 -11.120  -3.995
  500    HA   GLN  66           HA       GLN  66  -5.532 -13.375  -2.361
  501    HB2  GLN  66           HB2      GLN  66  -7.043 -10.924  -3.374
  502    HB3  GLN  66           HB3      GLN  66  -7.652 -12.089  -2.198
  503    HG2  GLN  66           HG2      GLN  66  -6.001 -11.399  -0.560
  504    HG3  GLN  66           HG3      GLN  66  -5.180 -10.380  -1.744
  505   HE21  GLN  66          HE21      GLN  66  -6.249  -8.468  -2.450
  506   HE22  GLN  66          HE22      GLN  66  -7.445  -7.707  -1.474
  507    H    VAL  67           H        VAL  67  -7.225 -14.781  -2.963
  508    HA   VAL  67           HA       VAL  67  -7.822 -15.052  -5.848
  509    HB   VAL  67           HB       VAL  67  -8.673 -17.308  -5.310
  510   HG11  VAL  67          HG11      VAL  67  -6.282 -17.073  -5.837
  511   HG12  VAL  67          HG12      VAL  67  -6.543 -18.389  -4.696
  512   HG13  VAL  67          HG13      VAL  67  -5.905 -16.844  -4.127
  513   HG21  VAL  67          HG21      VAL  67  -7.949 -16.713  -2.402
  514   HG22  VAL  67          HG22      VAL  67  -8.469 -18.278  -3.031
  515   HG23  VAL  67          HG23      VAL  67  -9.581 -16.912  -3.050
  516    H    VAL  68           H        VAL  68 -10.177 -15.976  -6.203
  517    HA   VAL  68           HA       VAL  68 -12.067 -14.035  -5.094
  518    HB   VAL  68           HB       VAL  68 -13.720 -15.028  -6.752
  519   HG11  VAL  68          HG11      VAL  68 -11.112 -13.947  -7.900
  520   HG12  VAL  68          HG12      VAL  68 -12.452 -12.989  -7.266
  521   HG13  VAL  68          HG13      VAL  68 -12.676 -13.953  -8.723
  522   HG21  VAL  68          HG21      VAL  68 -12.733 -17.275  -6.999
  523   HG22  VAL  68          HG22      VAL  68 -11.294 -16.583  -7.748
  524   HG23  VAL  68          HG23      VAL  68 -12.856 -16.477  -8.567
  525    H1   MET   1           H1       MET   1   0.178  23.010  13.951
  526    H2   MET   1           H2       MET   1   0.900  23.977  15.127
  527    H3   MET   1           H3       MET   1   1.484  24.005  13.541
  528    HA   MET   1           HA       MET   1  -1.178  24.918  14.471
  529    HB2  MET   1           HB2      MET   1   1.255  26.479  13.497
  530    HB3  MET   1           HB3      MET   1  -0.332  27.196  13.747
  531    HG2  MET   1           HG2      MET   1   1.362  25.898  15.894
  532    HG3  MET   1           HG3      MET   1   1.161  27.633  15.644
  533    HE1  MET   1           HE1      MET   1  -1.164  28.934  16.061
  534    HE2  MET   1           HE2      MET   1  -2.656  28.125  16.541
  535    HE3  MET   1           HE3      MET   1  -1.979  27.846  14.937
  536    H    GLY   2           H        GLY   2   0.992  24.427  11.677
  537    HA2  GLY   2           HA2      GLY   2  -0.785  25.402   9.658
  538    HA3  GLY   2           HA3      GLY   2   0.651  24.429   9.408
  539    H    HIS   3           H        HIS   3  -2.775  24.272  10.239
  540    HA   HIS   3           HA       HIS   3  -3.014  21.565   9.063
  541    HB2  HIS   3           HB2      HIS   3  -2.897  21.196  11.467
  542    HB3  HIS   3           HB3      HIS   3  -4.055  22.483  11.786
  543    HD2  HIS   3           HD2      HIS   3  -4.011  18.772  10.489
  544    HE1  HIS   3           HE1      HIS   3  -7.983  19.900  11.418
  545    HE2  HIS   3           HE2      HIS   3  -6.425  17.960  10.966
  546    H    HIS   4           H        HIS   4  -4.896  24.300  10.416
  547    HA   HIS   4           HA       HIS   4  -7.331  23.619   9.099
  548    HB2  HIS   4           HB2      HIS   4  -6.476  26.171  10.520
  549    HB3  HIS   4           HB3      HIS   4  -8.120  25.845   9.976
  550    HD2  HIS   4           HD2      HIS   4  -5.628  24.665  12.765
  551    HE1  HIS   4           HE1      HIS   4  -9.464  23.064  13.545
  552    HE2  HIS   4           HE2      HIS   4  -7.064  23.174  14.314
  553    H    HIS   5           H        HIS   5  -7.877  23.948   7.069
  554    HA   HIS   5           HA       HIS   5  -7.595  26.384   5.642
  555    HB2  HIS   5           HB2      HIS   5  -5.246  25.481   5.332
  556    HB3  HIS   5           HB3      HIS   5  -5.924  24.065   4.533
  557    HD2  HIS   5           HD2      HIS   5  -6.257  24.367   1.842
  558    HE1  HIS   5           HE1      HIS   5  -5.836  28.565   1.720
  559    HE2  HIS   5           HE2      HIS   5  -5.949  26.449   0.347
  560    H    HIS   6           H        HIS   6  -9.174  26.464   4.053
  561    HA   HIS   6           HA       HIS   6 -10.945  24.127   3.795
  562    HB2  HIS   6           HB2      HIS   6 -11.343  27.049   3.026
  563    HB3  HIS   6           HB3      HIS   6 -12.557  25.791   2.811
  564    HD2  HIS   6           HD2      HIS   6 -10.893  27.858   5.695
  565    HE1  HIS   6           HE1      HIS   6 -14.245  25.772   7.209
  566    HE2  HIS   6           HE2      HIS   6 -12.311  27.290   7.786
  567    H    HIS   7           H        HIS   7  -8.848  23.373   2.444
  568    HA   HIS   7           HA       HIS   7  -9.050  24.016  -0.385
  569    HB2  HIS   7           HB2      HIS   7  -7.366  22.102  -0.647
  570    HB3  HIS   7           HB3      HIS   7  -6.833  23.492   0.286
  571    HD2  HIS   7           HD2      HIS   7  -6.795  19.770   0.540
  572    HE1  HIS   7           HE1      HIS   7  -6.468  21.197   4.499
  573    HE2  HIS   7           HE2      HIS   7  -6.504  19.142   3.031
  574    H    HIS   8           H        HIS   8 -11.254  23.588  -0.714
  575    HA   HIS   8           HA       HIS   8 -12.370  20.914  -0.450
  576    HB2  HIS   8           HB2      HIS   8 -13.707  23.009  -0.039
  577    HB3  HIS   8           HB3      HIS   8 -13.545  23.428  -1.738
  578    HD2  HIS   8           HD2      HIS   8 -15.397  22.262  -3.416
  579    HE1  HIS   8           HE1      HIS   8 -17.255  19.901  -0.449
  580    HE2  HIS   8           HE2      HIS   8 -17.503  20.922  -2.744
  581    H    SER   9           H        SER   9 -10.529  20.073  -1.834
  582    HA   SER   9           HA       SER   9  -9.789  18.978  -3.669
  583    HB2  SER   9           HB2      SER   9 -12.118  18.183  -3.851
  584    HB3  SER   9           HB3      SER   9 -12.543  19.589  -4.821
  585    HG   SER   9           HG       SER   9 -11.033  18.808  -6.399
  586    H    HIS  10           H        HIS  10 -10.043  22.198  -3.676
  587    HA   HIS  10           HA       HIS  10  -9.399  23.981  -4.851
  588    HB2  HIS  10           HB2      HIS  10  -7.365  22.376  -5.294
  589    HB3  HIS  10           HB3      HIS  10  -8.003  22.253  -6.926
  590    HD1  HIS  10           HD1      HIS  10  -5.301  23.712  -5.658
  591    HD2  HIS  10           HD2      HIS  10  -8.582  25.473  -7.494
  592    HE1  HIS  10           HE1      HIS  10  -4.497  25.929  -6.483
  593    HE2  HIS  10           HE2      HIS  10  -6.470  26.950  -7.653
  594    H    MET  11           H        MET  11  -9.896  21.682  -7.614
  595    HA   MET  11           HA       MET  11 -12.030  23.439  -8.696
  596    HB2  MET  11           HB2      MET  11 -10.351  21.311 -10.105
  597    HB3  MET  11           HB3      MET  11 -11.662  22.208 -10.863
  598    HG2  MET  11           HG2      MET  11  -9.612  23.203 -11.563
  599    HG3  MET  11           HG3      MET  11 -10.361  24.316 -10.422
  600    HE1  MET  11           HE1      MET  11  -7.414  21.782 -11.041
  601    HE2  MET  11           HE2      MET  11  -8.277  20.989  -9.722
  602    HE3  MET  11           HE3      MET  11  -6.682  21.686  -9.439
  603    H    GLY  12           H        GLY  12 -11.275  19.927  -8.466
  604    HA2  GLY  12           HA2      GLY  12 -12.688  18.110  -8.059
  605    HA3  GLY  12           HA3      GLY  12 -14.060  19.209  -7.950
  606    H    GLY  13           H        GLY  13 -15.251  17.712  -9.301
  607    HA2  GLY  13           HA2      GLY  13 -16.313  17.611 -11.416
  608    HA3  GLY  13           HA3      GLY  13 -14.828  18.123 -12.196
  609    H    GLY  14           H        GLY  14 -13.839  15.797 -10.103
  610    HA2  GLY  14           HA2      GLY  14 -13.511  13.770 -12.116
  611    HA3  GLY  14           HA3      GLY  14 -12.998  13.679 -10.442
  612    H    LYS  15           H        LYS  15 -14.247  11.596 -12.067
  613    HA   LYS  15           HA       LYS  15 -16.521  10.894 -10.309
  614    HB2  LYS  15           HB2      LYS  15 -16.468  10.649 -13.351
  615    HB3  LYS  15           HB3      LYS  15 -17.636   9.799 -12.347
  616    HG2  LYS  15           HG2      LYS  15 -17.355  12.820 -12.526
  617    HG3  LYS  15           HG3      LYS  15 -18.575  11.856 -13.363
  618    HD2  LYS  15           HD2      LYS  15 -19.459  11.100 -11.150
  619    HD3  LYS  15           HD3      LYS  15 -18.265  12.121 -10.345
  620    HE2  LYS  15           HE2      LYS  15 -19.292  14.125 -11.380
  621    HE3  LYS  15           HE3      LYS  15 -20.497  13.093 -12.162
  622    HZ1  LYS  15           HZ1      LYS  15 -21.348  14.085 -10.128
  623    HZ2  LYS  15           HZ2      LYS  15 -20.107  13.375  -9.231
  624    HZ3  LYS  15           HZ3      LYS  15 -21.265  12.403  -9.983
  625    H    GLY  16           H        GLY  16 -16.690   8.714  -9.784
  626    HA2  GLY  16           HA2      GLY  16 -15.553   6.510 -11.066
  627    HA3  GLY  16           HA3      GLY  16 -14.383   7.056  -9.871
  628    HA   PRO  17           HA       PRO  17 -18.023   4.462  -7.885
  629    HB2  PRO  17           HB2      PRO  17 -17.052   1.884  -7.998
  630    HB3  PRO  17           HB3      PRO  17 -18.077   2.583  -9.260
  631    HG2  PRO  17           HG2      PRO  17 -15.074   2.326  -9.196
  632    HG3  PRO  17           HG3      PRO  17 -16.200   1.946 -10.520
  633    HD2  PRO  17           HD2      PRO  17 -14.803   4.272 -10.460
  634    HD3  PRO  17           HD3      PRO  17 -16.449   4.197 -11.121
  635    H    ALA  18           H        ALA  18 -17.956   3.906  -5.706
  636    HA   ALA  18           HA       ALA  18 -15.375   3.670  -4.293
  637    HB1  ALA  18           HB1      ALA  18 -15.829   6.102  -4.470
  638    HB2  ALA  18           HB2      ALA  18 -15.896   5.551  -2.796
  639    HB3  ALA  18           HB3      ALA  18 -17.390   5.872  -3.682
  640    H    ALA  19           H        ALA  19 -16.046   3.815  -1.747
  641    HA   ALA  19           HA       ALA  19 -18.454   2.150  -1.227
  642    HB1  ALA  19           HB1      ALA  19 -17.252   1.229   0.727
  643    HB2  ALA  19           HB2      ALA  19 -15.834   2.200   0.321
  644    HB3  ALA  19           HB3      ALA  19 -16.366   0.918  -0.768
  645    H    GLU  20           H        GLU  20 -18.761   2.451   1.461
  646    HA   GLU  20           HA       GLU  20 -19.698   5.159   1.760
  647    HB2  GLU  20           HB2      GLU  20 -19.592   2.880   3.776
  648    HB3  GLU  20           HB3      GLU  20 -20.433   4.409   4.026
  649    HG2  GLU  20           HG2      GLU  20 -21.875   3.881   2.032
  650    HG3  GLU  20           HG3      GLU  20 -21.089   2.306   1.938
  651    H    GLU  21           H        GLU  21 -18.396   6.801   2.264
  652    HA   GLU  21           HA       GLU  21 -15.903   6.539   3.749
  653    HB2  GLU  21           HB2      GLU  21 -15.698   8.994   3.302
  654    HB3  GLU  21           HB3      GLU  21 -15.966   8.057   1.837
  655    HG2  GLU  21           HG2      GLU  21 -18.403   8.680   1.947
  656    HG3  GLU  21           HG3      GLU  21 -18.028   9.730   3.310
  657    HA   PRO  22           HA       PRO  22 -17.670   7.734   7.831
  658    HB2  PRO  22           HB2      PRO  22 -14.983   8.944   8.398
  659    HB3  PRO  22           HB3      PRO  22 -15.840   7.668   9.273
  660    HG2  PRO  22           HG2      PRO  22 -13.690   7.101   7.755
  661    HG3  PRO  22           HG3      PRO  22 -15.074   5.986   7.842
  662    HD2  PRO  22           HD2      PRO  22 -14.378   7.981   5.675
  663    HD3  PRO  22           HD3      PRO  22 -14.923   6.295   5.518
  664    H    LEU  23           H        LEU  23 -18.294   9.733   8.952
  665    HA   LEU  23           HA       LEU  23 -18.718  11.981   7.276
  666    HB2  LEU  23           HB2      LEU  23 -18.987  11.806  10.299
  667    HB3  LEU  23           HB3      LEU  23 -19.565  13.141   9.318
  668    HG   LEU  23           HG       LEU  23 -20.643  10.302   9.387
  669   HD11  LEU  23          HD11      LEU  23 -21.454  11.758  11.182
  670   HD12  LEU  23          HD12      LEU  23 -22.753  11.368  10.058
  671   HD13  LEU  23          HD13      LEU  23 -21.984  12.955   9.997
  672   HD21  LEU  23          HD21      LEU  23 -21.402  12.484   7.413
  673   HD22  LEU  23          HD22      LEU  23 -22.263  10.959   7.630
  674   HD23  LEU  23          HD23      LEU  23 -20.606  10.954   7.034
  675    H    SER  24           H        SER  24 -16.978  12.899   6.483
  676    HA   SER  24           HA       SER  24 -15.207  14.654   7.846
  677    HB2  SER  24           HB2      SER  24 -13.088  13.340   7.529
  678    HB3  SER  24           HB3      SER  24 -14.175  12.523   8.650
  679    HG   SER  24           HG       SER  24 -14.883  11.463   6.480
  680    H    LEU  25           H        LEU  25 -13.019  14.545   5.996
  681    HA   LEU  25           HA       LEU  25 -14.028  15.677   3.603
  682    HB2  LEU  25           HB2      LEU  25 -11.288  14.520   4.212
  683    HB3  LEU  25           HB3      LEU  25 -11.657  15.468   2.781
  684    HG   LEU  25           HG       LEU  25 -11.753  16.477   5.658
  685   HD11  LEU  25          HD11      LEU  25  -9.834  17.882   5.046
  686   HD12  LEU  25          HD12      LEU  25  -9.792  17.150   3.441
  687   HD13  LEU  25          HD13      LEU  25  -9.451  16.170   4.867
  688   HD21  LEU  25          HD21      LEU  25 -12.297  17.999   3.080
  689   HD22  LEU  25          HD22      LEU  25 -12.175  18.711   4.689
  690   HD23  LEU  25          HD23      LEU  25 -13.484  17.591   4.327
  691    H    LEU  26           H        LEU  26 -13.987  14.899   1.434
  692    HA   LEU  26           HA       LEU  26 -14.833  12.177   1.053
  693    HB2  LEU  26           HB2      LEU  26 -15.602  14.302  -0.225
  694    HB3  LEU  26           HB3      LEU  26 -14.122  14.165  -1.155
  695    HG   LEU  26           HG       LEU  26 -16.239  11.965  -1.081
  696   HD11  LEU  26          HD11      LEU  26 -17.053  12.811  -3.246
  697   HD12  LEU  26          HD12      LEU  26 -15.972  14.201  -3.114
  698   HD13  LEU  26          HD13      LEU  26 -17.282  13.987  -1.953
  699   HD21  LEU  26          HD21      LEU  26 -14.041  11.166  -1.840
  700   HD22  LEU  26          HD22      LEU  26 -13.972  12.441  -3.056
  701   HD23  LEU  26          HD23      LEU  26 -15.193  11.171  -3.174
  702    H    ASP  27           H        ASP  27 -12.387  13.865  -0.864
  703    HA   ASP  27           HA       ASP  27 -10.442  13.383  -1.781
  704    HB2  ASP  27           HB2      ASP  27  -9.875  12.111   0.912
  705    HB3  ASP  27           HB3      ASP  27  -8.656  12.628  -0.250
  706    H    ASP  28           H        ASP  28 -10.296  12.083  -3.453
  707    HA   ASP  28           HA       ASP  28 -10.773   9.400  -3.814
  708    HB2  ASP  28           HB2      ASP  28 -10.019  11.230  -5.507
  709    HB3  ASP  28           HB3      ASP  28  -8.368  10.792  -5.085
  710    H    MET  29           H        MET  29  -7.930  10.918  -2.374
  711    HA   MET  29           HA       MET  29  -6.217   8.688  -2.074
  712    HB2  MET  29           HB2      MET  29  -6.366  11.103  -0.215
  713    HB3  MET  29           HB3      MET  29  -4.990  10.035  -0.456
  714    HG2  MET  29           HG2      MET  29  -5.114  10.859  -2.938
  715    HG3  MET  29           HG3      MET  29  -6.050  12.188  -2.257
  716    HE1  MET  29           HE1      MET  29  -2.928  10.197  -0.735
  717    HE2  MET  29           HE2      MET  29  -1.626  11.253  -1.285
  718    HE3  MET  29           HE3      MET  29  -2.608  10.377  -2.462
  719    H    ASN  30           H        ASN  30  -8.680  10.108   0.096
  720    HA   ASN  30           HA       ASN  30  -8.202   8.542   2.400
  721    HB2  ASN  30           HB2      ASN  30  -9.371  10.593   2.718
  722    HB3  ASN  30           HB3      ASN  30 -10.553  10.217   1.472
  723   HD21  ASN  30          HD21      ASN  30 -12.420   9.188   2.061
  724   HD22  ASN  30          HD22      ASN  30 -12.786   8.690   3.673
  725    H    HIS  31           H        HIS  31 -10.561   8.079  -0.248
  726    HA   HIS  31           HA       HIS  31 -11.756   5.692   0.730
  727    HB2  HIS  31           HB2      HIS  31 -11.495   6.790  -2.096
  728    HB3  HIS  31           HB3      HIS  31 -12.380   5.311  -1.736
  729    HD2  HIS  31           HD2      HIS  31 -12.636   9.144  -0.778
  730    HE1  HIS  31           HE1      HIS  31 -16.456   7.350  -0.612
  731    HE2  HIS  31           HE2      HIS  31 -15.138   9.467  -0.214
  732    H    CYS  32           H        CYS  32  -8.874   6.213  -1.269
  733    HA   CYS  32           HA       CYS  32  -8.262   3.468  -1.762
  734    HB2  CYS  32           HB2      CYS  32  -6.461   5.920  -1.750
  735    HB3  CYS  32           HB3      CYS  32  -5.966   4.326  -2.315
  736    HG   CYS  32           HG       CYS  32  -7.366   6.702  -4.015
  737    H    TYR  33           H        TYR  33  -7.296   5.713   0.836
  738    HA   TYR  33           HA       TYR  33  -5.530   3.987   2.241
  739    HB2  TYR  33           HB2      TYR  33  -7.012   6.524   2.949
  740    HB3  TYR  33           HB3      TYR  33  -6.219   5.625   4.237
  741    HD1  TYR  33           HD1      TYR  33  -3.705   4.770   3.262
  742    HD2  TYR  33           HD2      TYR  33  -5.704   8.433   2.352
  743    HE1  TYR  33           HE1      TYR  33  -1.546   5.835   2.871
  744    HE2  TYR  33           HE2      TYR  33  -3.528   9.511   1.944
  745    HH   TYR  33           HH       TYR  33  -0.638   7.773   1.631
  746    H    SER  34           H        SER  34  -9.021   4.500   2.448
  747    HA   SER  34           HA       SER  34  -9.676   2.944   4.684
  748    HB2  SER  34           HB2      SER  34 -11.364   4.327   3.514
  749    HB3  SER  34           HB3      SER  34 -11.265   3.289   2.094
  750    HG   SER  34           HG       SER  34 -12.133   1.584   3.336
  751    H    ARG  35           H        ARG  35  -9.469   2.002   1.268
  752    HA   ARG  35           HA       ARG  35  -9.977  -0.748   1.553
  753    HB2  ARG  35           HB2      ARG  35  -8.534   0.821  -0.608
  754    HB3  ARG  35           HB3      ARG  35  -8.871  -0.901  -0.752
  755    HG2  ARG  35           HG2      ARG  35 -11.167   0.900  -0.092
  756    HG3  ARG  35           HG3      ARG  35 -10.525   0.981  -1.734
  757    HD2  ARG  35           HD2      ARG  35 -12.365  -0.577  -1.715
  758    HD3  ARG  35           HD3      ARG  35 -10.876  -1.497  -1.931
  759    HE   ARG  35           HE       ARG  35 -12.127  -1.261   0.736
  760   HH11  ARG  35          HH11      ARG  35 -10.971  -3.315  -1.800
  761   HH12  ARG  35          HH12      ARG  35 -11.400  -4.761  -0.959
  762   HH21  ARG  35          HH21      ARG  35 -12.683  -3.132   1.756
  763   HH22  ARG  35          HH22      ARG  35 -12.350  -4.658   1.013
  764    H    LEU  36           H        LEU  36  -6.840   1.006   1.503
  765    HA   LEU  36           HA       LEU  36  -5.128  -1.208   1.686
  766    HB2  LEU  36           HB2      LEU  36  -4.815   1.538   2.940
  767    HB3  LEU  36           HB3      LEU  36  -3.533   0.342   2.874
  768    HG   LEU  36           HG       LEU  36  -4.822   1.712   0.482
  769   HD11  LEU  36          HD11      LEU  36  -2.624   2.759   0.155
  770   HD12  LEU  36          HD12      LEU  36  -2.029   1.997   1.632
  771   HD13  LEU  36          HD13      LEU  36  -3.324   3.195   1.712
  772   HD21  LEU  36          HD21      LEU  36  -3.144   0.552  -0.910
  773   HD22  LEU  36          HD22      LEU  36  -4.232  -0.589  -0.130
  774   HD23  LEU  36          HD23      LEU  36  -2.598  -0.366   0.498
  775    H    ARG  37           H        ARG  37  -6.568   0.699   4.373
  776    HA   ARG  37           HA       ARG  37  -5.746  -0.825   6.565
  777    HB2  ARG  37           HB2      ARG  37  -8.288   0.781   6.165
  778    HB3  ARG  37           HB3      ARG  37  -7.838   0.066   7.710
  779    HG2  ARG  37           HG2      ARG  37  -5.786   1.446   7.761
  780    HG3  ARG  37           HG3      ARG  37  -6.234   2.164   6.209
  781    HD2  ARG  37           HD2      ARG  37  -8.270   3.094   7.192
  782    HD3  ARG  37           HD3      ARG  37  -7.913   2.318   8.735
  783    HE   ARG  37           HE       ARG  37  -5.740   3.848   8.391
  784   HH11  ARG  37          HH11      ARG  37  -9.094   4.680   8.073
  785   HH12  ARG  37          HH12      ARG  37  -8.845   6.292   8.639
  786   HH21  ARG  37          HH21      ARG  37  -5.478   5.919   9.117
  787   HH22  ARG  37          HH22      ARG  37  -6.839   6.977   9.218
  788    H    GLU  38           H        GLU  38  -8.344  -1.479   4.258
  789    HA   GLU  38           HA       GLU  38  -9.567  -3.613   5.836
  790    HB2  GLU  38           HB2      GLU  38 -10.018  -2.710   2.958
  791    HB3  GLU  38           HB3      GLU  38 -10.977  -3.948   3.770
  792    HG2  GLU  38           HG2      GLU  38 -11.789  -2.305   5.403
  793    HG3  GLU  38           HG3      GLU  38 -10.765  -1.060   4.691
  794    H    LEU  39           H        LEU  39  -7.185  -3.357   3.267
  795    HA   LEU  39           HA       LEU  39  -7.144  -6.198   2.625
  796    HB2  LEU  39           HB2      LEU  39  -5.374  -3.911   1.679
  797    HB3  LEU  39           HB3      LEU  39  -5.286  -5.554   1.063
  798    HG   LEU  39           HG       LEU  39  -7.685  -3.694   0.772
  799   HD11  LEU  39          HD11      LEU  39  -5.838  -2.939  -0.619
  800   HD12  LEU  39          HD12      LEU  39  -7.131  -3.595  -1.617
  801   HD13  LEU  39          HD13      LEU  39  -5.675  -4.550  -1.325
  802   HD21  LEU  39          HD21      LEU  39  -7.295  -6.478  -0.377
  803   HD22  LEU  39          HD22      LEU  39  -8.645  -5.394  -0.716
  804   HD23  LEU  39          HD23      LEU  39  -8.421  -6.028   0.910
  805    H    VAL  40           H        VAL  40  -5.527  -4.125   4.884
  806    HA   VAL  40           HA       VAL  40  -3.365  -6.008   5.438
  807    HB   VAL  40           HB       VAL  40  -4.194  -3.584   7.115
  808   HG11  VAL  40          HG11      VAL  40  -2.819  -5.196   8.376
  809   HG12  VAL  40          HG12      VAL  40  -1.909  -3.718   8.065
  810   HG13  VAL  40          HG13      VAL  40  -1.588  -5.166   7.109
  811   HG21  VAL  40          HG21      VAL  40  -2.082  -3.736   4.922
  812   HG22  VAL  40          HG22      VAL  40  -2.345  -2.358   5.996
  813   HG23  VAL  40          HG23      VAL  40  -3.604  -2.843   4.861
  814    HA   PRO  41           HA       PRO  41  -6.430  -8.216   8.039
  815    HB2  PRO  41           HB2      PRO  41  -5.373 -10.672   7.906
  816    HB3  PRO  41           HB3      PRO  41  -6.025  -9.906   6.450
  817    HG2  PRO  41           HG2      PRO  41  -3.153 -10.175   7.321
  818    HG3  PRO  41           HG3      PRO  41  -3.863 -10.414   5.711
  819    HD2  PRO  41           HD2      PRO  41  -2.614  -8.058   6.577
  820    HD3  PRO  41           HD3      PRO  41  -3.738  -8.166   5.207
  821    H    GLY  42           H        GLY  42  -3.732  -6.881   9.121
  822    HA2  GLY  42           HA2      GLY  42  -3.629  -8.369  11.702
  823    HA3  GLY  42           HA3      GLY  42  -2.183  -7.773  10.904
  824    H    VAL  43           H        VAL  43  -5.243  -6.005  11.116
  825    HA   VAL  43           HA       VAL  43  -3.929  -3.845  12.638
  826    HB   VAL  43           HB       VAL  43  -6.680  -3.829  11.297
  827   HG11  VAL  43          HG11      VAL  43  -6.505  -2.169  13.110
  828   HG12  VAL  43          HG12      VAL  43  -6.568  -1.365  11.543
  829   HG13  VAL  43          HG13      VAL  43  -5.030  -1.512  12.395
  830   HG21  VAL  43          HG21      VAL  43  -4.926  -4.116   9.597
  831   HG22  VAL  43          HG22      VAL  43  -4.039  -2.729  10.236
  832   HG23  VAL  43          HG23      VAL  43  -5.622  -2.496   9.487
  833    HA   PRO  44           HA       PRO  44  -6.211  -5.407  16.347
  834    HB2  PRO  44           HB2      PRO  44  -4.795  -3.162  17.722
  835    HB3  PRO  44           HB3      PRO  44  -4.774  -4.893  18.093
  836    HG2  PRO  44           HG2      PRO  44  -2.625  -3.680  17.002
  837    HG3  PRO  44           HG3      PRO  44  -3.070  -5.339  16.544
  838    HD2  PRO  44           HD2      PRO  44  -3.608  -2.753  15.062
  839    HD3  PRO  44           HD3      PRO  44  -3.003  -4.307  14.434
  840    H    ARG  45           H        ARG  45  -8.151  -4.723  17.235
  841    HA   ARG  45           HA       ARG  45  -9.498  -2.417  16.222
  842    HB2  ARG  45           HB2      ARG  45 -10.200  -4.512  18.290
  843    HB3  ARG  45           HB3      ARG  45 -11.224  -3.098  18.108
  844    HG2  ARG  45           HG2      ARG  45 -12.151  -4.981  16.881
  845    HG3  ARG  45           HG3      ARG  45 -11.693  -3.698  15.772
  846    HD2  ARG  45           HD2      ARG  45  -9.733  -5.935  16.236
  847    HD3  ARG  45           HD3      ARG  45 -11.151  -6.262  15.243
  848    HE   ARG  45           HE       ARG  45  -9.163  -4.144  14.632
  849   HH11  ARG  45          HH11      ARG  45 -11.334  -6.592  13.535
  850   HH12  ARG  45          HH12      ARG  45 -10.905  -6.380  11.874
  851   HH21  ARG  45          HH21      ARG  45  -8.644  -3.885  12.501
  852   HH22  ARG  45          HH22      ARG  45  -9.392  -4.873  11.299
  853    H    GLY  46           H        GLY  46  -8.867  -0.427  16.810
  854    HA2  GLY  46           HA2      GLY  46  -9.239   1.258  18.631
  855    HA3  GLY  46           HA3      GLY  46  -8.276   0.215  19.665
  856    H    THR  47           H        THR  47  -6.530  -0.358  17.209
  857    HA   THR  47           HA       THR  47  -4.542   1.669  17.671
  858    HB   THR  47           HB       THR  47  -4.600  -0.639  15.671
  859    HG1  THR  47           HG1      THR  47  -3.581  -0.350  18.312
  860   HG21  THR  47          HG21      THR  47  -2.139  -0.380  15.537
  861   HG22  THR  47          HG22      THR  47  -2.227   1.061  16.552
  862   HG23  THR  47          HG23      THR  47  -2.954   1.067  14.944
  863    H    GLN  48           H        GLN  48  -5.078   3.659  16.918
  864    HA   GLN  48           HA       GLN  48  -6.380   4.187  14.411
  865    HB2  GLN  48           HB2      GLN  48  -4.947   6.104  16.303
  866    HB3  GLN  48           HB3      GLN  48  -5.994   6.581  14.969
  867    HG2  GLN  48           HG2      GLN  48  -7.902   5.424  16.094
  868    HG3  GLN  48           HG3      GLN  48  -6.842   5.049  17.450
  869   HE21  GLN  48          HE21      GLN  48  -9.303   6.606  17.455
  870   HE22  GLN  48          HE22      GLN  48  -8.888   8.167  18.059
  871    H    LEU  49           H        LEU  49  -5.259   3.600  12.612
  872    HA   LEU  49           HA       LEU  49  -2.405   3.821  12.324
  873    HB2  LEU  49           HB2      LEU  49  -4.532   3.273  10.215
  874    HB3  LEU  49           HB3      LEU  49  -2.803   3.082   9.979
  875    HG   LEU  49           HG       LEU  49  -4.562   1.426  11.827
  876   HD11  LEU  49          HD11      LEU  49  -4.854   0.865   9.458
  877   HD12  LEU  49          HD12      LEU  49  -4.036  -0.439  10.314
  878   HD13  LEU  49          HD13      LEU  49  -3.108   0.647   9.277
  879   HD21  LEU  49          HD21      LEU  49  -2.361   1.700  12.876
  880   HD22  LEU  49          HD22      LEU  49  -1.559   1.196  11.387
  881   HD23  LEU  49          HD23      LEU  49  -2.558   0.052  12.286
  882    H    SER  50           H        SER  50  -1.531   5.849  12.239
  883    HA   SER  50           HA       SER  50  -2.629   8.161  11.009
  884    HB2  SER  50           HB2      SER  50   0.300   7.492  11.565
  885    HB3  SER  50           HB3      SER  50  -0.316   9.098  11.171
  886    HG   SER  50           HG       SER  50  -0.049   8.727  13.447
  887    H    GLN  51           H        GLN  51  -1.587   9.297   9.072
  888    HA   GLN  51           HA       GLN  51  -2.208   7.974   6.722
  889    HB2  GLN  51           HB2      GLN  51  -0.269  10.304   6.997
  890    HB3  GLN  51           HB3      GLN  51  -1.113   9.846   5.522
  891    HG2  GLN  51           HG2      GLN  51  -3.265  10.409   6.549
  892    HG3  GLN  51           HG3      GLN  51  -2.457  10.797   8.066
  893   HE21  GLN  51          HE21      GLN  51  -0.201  12.186   6.769
  894   HE22  GLN  51          HE22      GLN  51  -0.839  13.679   6.193
  895    H    VAL  52           H        VAL  52   1.082   8.514   8.000
  896    HA   VAL  52           HA       VAL  52   2.433   7.030   5.946
  897    HB   VAL  52           HB       VAL  52   3.588   7.601   8.713
  898   HG11  VAL  52          HG11      VAL  52   4.905   7.282   5.983
  899   HG12  VAL  52          HG12      VAL  52   4.933   6.106   7.299
  900   HG13  VAL  52          HG13      VAL  52   5.753   7.655   7.491
  901   HG21  VAL  52          HG21      VAL  52   2.654   9.712   7.863
  902   HG22  VAL  52          HG22      VAL  52   3.531   9.506   6.348
  903   HG23  VAL  52          HG23      VAL  52   4.420   9.764   7.851
  904    H    GLU  53           H        GLU  53   1.356   6.252   9.256
  905    HA   GLU  53           HA       GLU  53   2.516   3.712   9.567
  906    HB2  GLU  53           HB2      GLU  53   0.069   4.981  10.834
  907    HB3  GLU  53           HB3      GLU  53   0.629   3.384  11.308
  908    HG2  GLU  53           HG2      GLU  53   2.310   5.904  11.473
  909    HG3  GLU  53           HG3      GLU  53   1.397   5.221  12.816
  910    H    ILE  54           H        ILE  54  -0.477   4.610   7.942
  911    HA   ILE  54           HA       ILE  54  -1.583   2.065   7.452
  912    HB   ILE  54           HB       ILE  54  -1.584   4.564   5.689
  913   HG12  ILE  54          HG12      ILE  54  -3.765   3.544   7.582
  914   HG13  ILE  54          HG13      ILE  54  -2.634   4.835   7.969
  915   HG21  ILE  54          HG21      ILE  54  -3.537   3.605   4.507
  916   HG22  ILE  54          HG22      ILE  54  -3.372   2.108   5.432
  917   HG23  ILE  54          HG23      ILE  54  -2.105   2.599   4.306
  918   HD11  ILE  54          HD11      ILE  54  -4.784   5.721   7.328
  919   HD12  ILE  54          HD12      ILE  54  -4.698   4.895   5.773
  920   HD13  ILE  54          HD13      ILE  54  -3.557   6.189   6.152
  921    H    LEU  55           H        LEU  55   0.686   4.007   5.481
  922    HA   LEU  55           HA       LEU  55   1.232   2.144   3.452
  923    HB2  LEU  55           HB2      LEU  55   3.113   4.279   4.532
  924    HB3  LEU  55           HB3      LEU  55   3.226   3.503   2.961
  925    HG   LEU  55           HG       LEU  55   1.009   5.390   3.859
  926   HD11  LEU  55          HD11      LEU  55   1.926   6.956   2.190
  927   HD12  LEU  55          HD12      LEU  55   3.237   5.827   1.840
  928   HD13  LEU  55          HD13      LEU  55   3.114   6.571   3.436
  929   HD21  LEU  55          HD21      LEU  55   1.366   4.023   1.164
  930   HD22  LEU  55          HD22      LEU  55   0.167   5.263   1.537
  931   HD23  LEU  55          HD23      LEU  55   0.089   3.696   2.341
  932    H    GLN  56           H        GLN  56   2.826   2.661   6.587
  933    HA   GLN  56           HA       GLN  56   5.038   0.942   6.316
  934    HB2  GLN  56           HB2      GLN  56   3.522   1.710   8.847
  935    HB3  GLN  56           HB3      GLN  56   5.102   0.938   8.824
  936    HG2  GLN  56           HG2      GLN  56   4.444   3.710   7.795
  937    HG3  GLN  56           HG3      GLN  56   5.312   3.318   9.278
  938   HE21  GLN  56          HE21      GLN  56   6.183   4.933   7.049
  939   HE22  GLN  56          HE22      GLN  56   7.627   4.219   6.447
  940    H    ARG  57           H        ARG  57   1.734   0.282   7.498
  941    HA   ARG  57           HA       ARG  57   2.198  -2.435   8.269
  942    HB2  ARG  57           HB2      ARG  57  -0.395  -0.973   7.640
  943    HB3  ARG  57           HB3      ARG  57  -0.325  -2.598   8.306
  944    HG2  ARG  57           HG2      ARG  57   0.852  -0.175   9.697
  945    HG3  ARG  57           HG3      ARG  57  -0.789  -0.747   9.971
  946    HD2  ARG  57           HD2      ARG  57   0.672  -1.530  11.765
  947    HD3  ARG  57           HD3      ARG  57   0.116  -2.903  10.819
  948    HE   ARG  57           HE       ARG  57   2.287  -3.392  10.332
  949   HH11  ARG  57          HH11      ARG  57   2.303  -0.038  11.248
  950   HH12  ARG  57          HH12      ARG  57   4.030   0.045  11.226
  951   HH21  ARG  57          HH21      ARG  57   4.467  -3.225  10.321
  952   HH22  ARG  57          HH22      ARG  57   5.229  -1.723  10.703
  953    H    VAL  58           H        VAL  58   1.214  -0.914   5.240
  954    HA   VAL  58           HA       VAL  58   0.476  -3.345   3.897
  955    HB   VAL  58           HB       VAL  58   1.212  -0.633   2.700
  956   HG11  VAL  58          HG11      VAL  58   0.007  -1.408   0.675
  957   HG12  VAL  58          HG12      VAL  58  -0.198  -3.003   1.407
  958   HG13  VAL  58          HG13      VAL  58   1.417  -2.407   1.021
  959   HG21  VAL  58          HG21      VAL  58  -0.731  -0.489   4.215
  960   HG22  VAL  58          HG22      VAL  58  -1.535  -1.797   3.350
  961   HG23  VAL  58          HG23      VAL  58  -1.235  -0.253   2.541
  962    H    ILE  59           H        ILE  59   3.463  -1.311   3.760
  963    HA   ILE  59           HA       ILE  59   4.975  -2.869   1.963
  964    HB   ILE  59           HB       ILE  59   6.068  -1.260   4.330
  965   HG12  ILE  59          HG12      ILE  59   5.691  -0.290   1.453
  966   HG13  ILE  59          HG13      ILE  59   4.588   0.085   2.769
  967   HG21  ILE  59          HG21      ILE  59   7.782  -2.750   3.379
  968   HG22  ILE  59          HG22      ILE  59   8.164  -1.075   2.995
  969   HG23  ILE  59          HG23      ILE  59   7.466  -2.124   1.760
  970   HD11  ILE  59          HD11      ILE  59   6.089   1.925   2.317
  971   HD12  ILE  59          HD12      ILE  59   7.489   0.898   2.619
  972   HD13  ILE  59          HD13      ILE  59   6.372   1.281   3.933
  973    H    ASP  60           H        ASP  60   4.877  -2.939   5.523
  974    HA   ASP  60           HA       ASP  60   6.676  -5.043   6.023
  975    HB2  ASP  60           HB2      ASP  60   5.926  -3.398   7.707
  976    HB3  ASP  60           HB3      ASP  60   4.299  -4.058   7.653
  977    H    TYR  61           H        TYR  61   3.175  -5.098   5.446
  978    HA   TYR  61           HA       TYR  61   2.595  -7.821   5.869
  979    HB2  TYR  61           HB2      TYR  61   0.749  -6.322   5.632
  980    HB3  TYR  61           HB3      TYR  61   1.349  -5.675   4.113
  981    HD1  TYR  61           HD1      TYR  61   0.081  -8.916   5.578
  982    HD2  TYR  61           HD2      TYR  61   0.313  -6.412   2.111
  983    HE1  TYR  61           HE1      TYR  61  -1.401 -10.449   4.368
  984    HE2  TYR  61           HE2      TYR  61  -1.186  -7.951   0.909
  985    HH   TYR  61           HH       TYR  61  -1.852 -10.331   1.010
  986    H    ILE  62           H        ILE  62   3.543  -6.150   2.844
  987    HA   ILE  62           HA       ILE  62   3.450  -8.480   1.188
  988    HB   ILE  62           HB       ILE  62   4.866  -5.826   0.663
  989   HG12  ILE  62          HG12      ILE  62   2.053  -6.657  -0.228
  990   HG13  ILE  62          HG13      ILE  62   2.369  -5.633   1.165
  991   HG21  ILE  62          HG21      ILE  62   3.972  -7.978  -1.304
  992   HG22  ILE  62          HG22      ILE  62   5.642  -7.598  -0.873
  993   HG23  ILE  62          HG23      ILE  62   4.667  -6.415  -1.742
  994   HD11  ILE  62          HD11      ILE  62   3.356  -3.937  -0.303
  995   HD12  ILE  62          HD12      ILE  62   1.697  -4.325  -0.758
  996   HD13  ILE  62          HD13      ILE  62   3.040  -4.970  -1.703
  997    H    LEU  63           H        LEU  63   6.081  -6.842   2.938
  998    HA   LEU  63           HA       LEU  63   8.254  -8.444   2.025
  999    HB2  LEU  63           HB2      LEU  63   7.882  -6.794   4.550
 1000    HB3  LEU  63           HB3      LEU  63   9.393  -7.597   4.152
 1001    HG   LEU  63           HG       LEU  63   8.087  -5.394   2.503
 1002   HD11  LEU  63          HD11      LEU  63  10.536  -5.306   4.294
 1003   HD12  LEU  63          HD12      LEU  63   8.981  -4.532   4.603
 1004   HD13  LEU  63          HD13      LEU  63   9.975  -3.992   3.251
 1005   HD21  LEU  63          HD21      LEU  63  10.754  -6.799   2.081
 1006   HD22  LEU  63          HD22      LEU  63  10.168  -5.406   1.170
 1007   HD23  LEU  63          HD23      LEU  63   9.323  -6.946   1.055
 1008    H    ASP  64           H        ASP  64   5.886  -8.889   4.601
 1009    HA   ASP  64           HA       ASP  64   7.099 -11.134   5.875
 1010    HB2  ASP  64           HB2      ASP  64   5.318  -9.779   6.937
 1011    HB3  ASP  64           HB3      ASP  64   4.163 -10.318   5.726
 1012    H    LEU  65           H        LEU  65   4.890 -10.812   3.126
 1013    HA   LEU  65           HA       LEU  65   4.473 -13.616   2.659
 1014    HB2  LEU  65           HB2      LEU  65   4.199 -11.275   0.732
 1015    HB3  LEU  65           HB3      LEU  65   3.545 -12.887   0.481
 1016    HG   LEU  65           HG       LEU  65   2.670 -10.929   2.643
 1017   HD11  LEU  65          HD11      LEU  65   1.893 -10.250   0.434
 1018   HD12  LEU  65          HD12      LEU  65   0.544 -10.812   1.415
 1019   HD13  LEU  65          HD13      LEU  65   1.208 -11.854   0.156
 1020   HD21  LEU  65          HD21      LEU  65   0.892 -12.565   3.184
 1021   HD22  LEU  65          HD22      LEU  65   2.499 -13.216   3.496
 1022   HD23  LEU  65          HD23      LEU  65   1.611 -13.720   2.056
 1023    H    GLN  66           H        GLN  66   6.573 -11.185   1.193
 1024    HA   GLN  66           HA       GLN  66   8.112 -13.126  -0.373
 1025    HB2  GLN  66           HB2      GLN  66   8.328 -10.091  -0.115
 1026    HB3  GLN  66           HB3      GLN  66   9.281 -11.077  -1.219
 1027    HG2  GLN  66           HG2      GLN  66   7.240 -11.726  -2.434
 1028    HG3  GLN  66           HG3      GLN  66   6.259 -10.782  -1.311
 1029   HE21  GLN  66          HE21      GLN  66   6.582 -10.527  -4.227
 1030   HE22  GLN  66          HE22      GLN  66   7.093  -8.903  -4.504
 1031    H    VAL  67           H        VAL  67  10.685 -11.942  -0.236
 1032    HA   VAL  67           HA       VAL  67  11.574 -12.486   2.516
 1033    HB   VAL  67           HB       VAL  67  13.896 -12.397   1.562
 1034   HG11  VAL  67          HG11      VAL  67  13.772 -14.544   0.326
 1035   HG12  VAL  67          HG12      VAL  67  12.026 -14.352   0.161
 1036   HG13  VAL  67          HG13      VAL  67  12.743 -14.557   1.760
 1037   HG21  VAL  67          HG21      VAL  67  14.232 -12.371  -0.897
 1038   HG22  VAL  67          HG22      VAL  67  13.517 -10.862  -0.336
 1039   HG23  VAL  67          HG23      VAL  67  12.508 -12.068  -1.137
 1040    H    VAL  68           H        VAL  68  12.466 -10.960   3.861
 1041    HA   VAL  68           HA       VAL  68  12.057  -8.139   3.247
 1042    HB   VAL  68           HB       VAL  68  13.198  -9.390   5.797
 1043   HG11  VAL  68          HG11      VAL  68  12.102  -6.586   5.324
 1044   HG12  VAL  68          HG12      VAL  68  13.793  -7.014   5.584
 1045   HG13  VAL  68          HG13      VAL  68  12.625  -7.239   6.883
 1046   HG21  VAL  68          HG21      VAL  68  10.330  -8.545   5.209
 1047   HG22  VAL  68          HG22      VAL  68  10.937  -9.136   6.757
 1048   HG23  VAL  68          HG23      VAL  68  10.909 -10.205   5.356
  Start of MODEL    4
    1    H1   MET   1           H1       MET   1  -1.388 -11.524  11.298
    2    H2   MET   1           H2       MET   1  -2.070 -12.723  12.274
    3    H3   MET   1           H3       MET   1  -2.117 -11.109  12.765
    4    HA   MET   1           HA       MET   1  -3.528 -10.525  10.940
    5    HB2  MET   1           HB2      MET   1  -4.531 -12.366   9.533
    6    HB3  MET   1           HB3      MET   1  -2.818 -12.097   9.263
    7    HG2  MET   1           HG2      MET   1  -2.307 -14.069  10.683
    8    HG3  MET   1           HG3      MET   1  -4.038 -14.357  10.861
    9    HE1  MET   1           HE1      MET   1  -1.875 -14.576   6.770
   10    HE2  MET   1           HE2      MET   1  -1.062 -14.104   8.261
   11    HE3  MET   1           HE3      MET   1  -2.282 -13.047   7.548
   12    H    GLY   2           H        GLY   2  -5.803 -10.526  11.223
   13    HA2  GLY   2           HA2      GLY   2  -6.611 -11.302  13.905
   14    HA3  GLY   2           HA3      GLY   2  -7.499 -10.302  12.770
   15    H    HIS   3           H        HIS   3  -9.444 -11.204  12.501
   16    HA   HIS   3           HA       HIS   3  -9.769 -14.044  11.854
   17    HB2  HIS   3           HB2      HIS   3  -9.870 -13.638  14.428
   18    HB3  HIS   3           HB3      HIS   3 -11.379 -12.790  14.128
   19    HD2  HIS   3           HD2      HIS   3  -9.932 -16.450  13.825
   20    HE1  HIS   3           HE1      HIS   3 -14.153 -16.606  13.946
   21    HE2  HIS   3           HE2      HIS   3 -12.023 -17.943  14.144
   22    H    HIS   4           H        HIS   4 -12.640 -14.034  12.001
   23    HA   HIS   4           HA       HIS   4 -13.279 -12.610   9.570
   24    HB2  HIS   4           HB2      HIS   4 -14.919 -14.498  11.306
   25    HB3  HIS   4           HB3      HIS   4 -15.415 -13.915   9.720
   26    HD2  HIS   4           HD2      HIS   4 -12.493 -16.164  11.199
   27    HE1  HIS   4           HE1      HIS   4 -13.371 -17.339   7.236
   28    HE2  HIS   4           HE2      HIS   4 -12.164 -17.957   9.364
   29    H    HIS   5           H        HIS   5 -12.985 -11.020  12.203
   30    HA   HIS   5           HA       HIS   5 -15.649 -10.028  12.769
   31    HB2  HIS   5           HB2      HIS   5 -14.461  -8.410  14.311
   32    HB3  HIS   5           HB3      HIS   5 -14.162 -10.105  14.658
   33    HD2  HIS   5           HD2      HIS   5 -12.216  -6.886  13.770
   34    HE1  HIS   5           HE1      HIS   5  -9.469 -10.075  14.075
   35    HE2  HIS   5           HE2      HIS   5  -9.740  -7.618  13.601
   36    H    HIS   6           H        HIS   6 -16.162  -9.438  10.562
   37    HA   HIS   6           HA       HIS   6 -14.977  -6.911   9.565
   38    HB2  HIS   6           HB2      HIS   6 -16.806  -8.859   8.101
   39    HB3  HIS   6           HB3      HIS   6 -15.958  -7.487   7.395
   40    HD2  HIS   6           HD2      HIS   6 -12.960  -7.870   7.865
   41    HE1  HIS   6           HE1      HIS   6 -13.488 -11.999   7.116
   42    HE2  HIS   6           HE2      HIS   6 -11.847 -10.073   7.078
   43    H    HIS   7           H        HIS   7 -16.165  -5.051   9.531
   44    HA   HIS   7           HA       HIS   7 -18.871  -4.976  10.609
   45    HB2  HIS   7           HB2      HIS   7 -18.643  -2.582  10.609
   46    HB3  HIS   7           HB3      HIS   7 -17.075  -3.209  11.090
   47    HD2  HIS   7           HD2      HIS   7 -18.671  -1.029   8.350
   48    HE1  HIS   7           HE1      HIS   7 -14.594  -1.495   7.383
   49    HE2  HIS   7           HE2      HIS   7 -16.656  -0.073   7.053
   50    H    HIS   8           H        HIS   8 -20.487  -3.451   9.332
   51    HA   HIS   8           HA       HIS   8 -20.197  -3.556   6.416
   52    HB2  HIS   8           HB2      HIS   8 -21.483  -5.624   7.051
   53    HB3  HIS   8           HB3      HIS   8 -22.720  -4.601   7.778
   54    HD2  HIS   8           HD2      HIS   8 -21.090  -4.821   4.167
   55    HE1  HIS   8           HE1      HIS   8 -25.241  -4.100   3.838
   56    HE2  HIS   8           HE2      HIS   8 -23.121  -4.650   2.577
   57    H    SER   9           H        SER   9 -21.140  -1.889   5.355
   58    HA   SER   9           HA       SER   9 -23.112  -0.103   6.500
   59    HB2  SER   9           HB2      SER   9 -21.034   0.814   7.522
   60    HB3  SER   9           HB3      SER   9 -20.292   0.949   5.931
   61    HG   SER   9           HG       SER   9 -21.121   2.883   5.968
   62    H    HIS  10           H        HIS  10 -23.526   1.745   4.913
   63    HA   HIS  10           HA       HIS  10 -22.644   1.452   2.181
   64    HB2  HIS  10           HB2      HIS  10 -24.997   1.292   1.236
   65    HB3  HIS  10           HB3      HIS  10 -24.423  -0.168   2.026
   66    HD1  HIS  10           HD1      HIS  10 -27.212   2.193   2.016
   67    HD2  HIS  10           HD2      HIS  10 -25.634  -0.577   4.679
   68    HE1  HIS  10           HE1      HIS  10 -29.004   1.790   3.710
   69    HE2  HIS  10           HE2      HIS  10 -28.100  -0.014   5.187
   70    H    MET  11           H        MET  11 -21.776   3.455   2.610
   71    HA   MET  11           HA       MET  11 -23.571   5.765   2.350
   72    HB2  MET  11           HB2      MET  11 -23.181   5.528   4.793
   73    HB3  MET  11           HB3      MET  11 -21.444   5.511   4.531
   74    HG2  MET  11           HG2      MET  11 -21.602   7.843   3.645
   75    HG3  MET  11           HG3      MET  11 -23.320   7.839   4.055
   76    HE1  MET  11           HE1      MET  11 -21.731  10.205   6.769
   77    HE2  MET  11           HE2      MET  11 -22.978  10.061   5.530
   78    HE3  MET  11           HE3      MET  11 -21.275  10.056   5.071
   79    H    GLY  12           H        GLY  12 -22.701   7.353   1.045
   80    HA2  GLY  12           HA2      GLY  12 -19.838   7.556   0.499
   81    HA3  GLY  12           HA3      GLY  12 -20.821   6.993  -0.847
   82    H    GLY  13           H        GLY  13 -19.976   9.716   1.160
   83    HA2  GLY  13           HA2      GLY  13 -21.755  11.614  -0.188
   84    HA3  GLY  13           HA3      GLY  13 -20.544  11.986   1.032
   85    H    GLY  14           H        GLY  14 -18.271  11.963   0.401
   86    HA2  GLY  14           HA2      GLY  14 -16.449  12.399  -0.907
   87    HA3  GLY  14           HA3      GLY  14 -17.168  11.261  -2.021
   88    H    LYS  15           H        LYS  15 -16.912  14.710  -1.185
   89    HA   LYS  15           HA       LYS  15 -16.919  15.422  -4.007
   90    HB2  LYS  15           HB2      LYS  15 -19.348  15.414  -3.392
   91    HB3  LYS  15           HB3      LYS  15 -19.028  16.634  -2.168
   92    HG2  LYS  15           HG2      LYS  15 -18.401  18.259  -3.881
   93    HG3  LYS  15           HG3      LYS  15 -18.550  17.036  -5.144
   94    HD2  LYS  15           HD2      LYS  15 -20.831  18.063  -3.404
   95    HD3  LYS  15           HD3      LYS  15 -20.524  18.543  -5.074
   96    HE2  LYS  15           HE2      LYS  15 -20.928  16.249  -5.835
   97    HE3  LYS  15           HE3      LYS  15 -21.167  15.710  -4.172
   98    HZ1  LYS  15           HZ1      LYS  15 -23.098  17.121  -4.012
   99    HZ2  LYS  15           HZ2      LYS  15 -23.257  16.089  -5.341
  100    HZ3  LYS  15           HZ3      LYS  15 -22.848  17.710  -5.574
  101    H    GLY  16           H        GLY  16 -14.962  16.349  -3.936
  102    HA2  GLY  16           HA2      GLY  16 -14.468  18.959  -3.412
  103    HA3  GLY  16           HA3      GLY  16 -14.083  18.206  -1.869
  104    HA   PRO  17           HA       PRO  17 -10.738  16.410  -4.854
  105    HB2  PRO  17           HB2      PRO  17 -11.212  17.114  -7.645
  106    HB3  PRO  17           HB3      PRO  17 -11.306  15.521  -6.891
  107    HG2  PRO  17           HG2      PRO  17 -13.504  16.873  -7.878
  108    HG3  PRO  17           HG3      PRO  17 -13.590  15.652  -6.592
  109    HD2  PRO  17           HD2      PRO  17 -13.531  18.668  -6.338
  110    HD3  PRO  17           HD3      PRO  17 -14.574  17.486  -5.506
  111    H    ALA  18           H        ALA  18  -9.966  18.329  -3.628
  112    HA   ALA  18           HA       ALA  18  -8.049  19.847  -5.146
  113    HB1  ALA  18           HB1      ALA  18 -10.035  21.278  -5.508
  114    HB2  ALA  18           HB2      ALA  18  -8.828  22.111  -4.530
  115    HB3  ALA  18           HB3      ALA  18 -10.262  21.419  -3.766
  116    H    ALA  19           H        ALA  19  -8.871  18.187  -2.492
  117    HA   ALA  19           HA       ALA  19  -7.855  19.721  -0.295
  118    HB1  ALA  19           HB1      ALA  19  -8.408  16.739  -0.498
  119    HB2  ALA  19           HB2      ALA  19  -9.568  17.972  -0.007
  120    HB3  ALA  19           HB3      ALA  19  -8.155  17.647   0.996
  121    H    GLU  20           H        GLU  20  -5.737  20.286  -0.323
  122    HA   GLU  20           HA       GLU  20  -3.647  18.183  -0.617
  123    HB2  GLU  20           HB2      GLU  20  -3.382  21.165  -1.240
  124    HB3  GLU  20           HB3      GLU  20  -2.092  19.975  -1.372
  125    HG2  GLU  20           HG2      GLU  20  -3.415  18.815  -3.161
  126    HG3  GLU  20           HG3      GLU  20  -4.610  20.108  -3.066
  127    H    GLU  21           H        GLU  21  -3.134  17.665   1.491
  128    HA   GLU  21           HA       GLU  21  -2.920  19.686   3.575
  129    HB2  GLU  21           HB2      GLU  21  -2.289  17.795   5.056
  130    HB3  GLU  21           HB3      GLU  21  -3.803  17.505   4.208
  131    HG2  GLU  21           HG2      GLU  21  -2.725  15.964   2.669
  132    HG3  GLU  21           HG3      GLU  21  -1.136  16.342   3.336
  133    HA   PRO  22           HA       PRO  22   1.462  20.505   2.795
  134    HB2  PRO  22           HB2      PRO  22   2.136  21.799   5.109
  135    HB3  PRO  22           HB3      PRO  22   1.111  22.542   3.874
  136    HG2  PRO  22           HG2      PRO  22   0.294  21.166   6.433
  137    HG3  PRO  22           HG3      PRO  22  -0.287  22.703   5.754
  138    HD2  PRO  22           HD2      PRO  22  -1.671  20.365   5.478
  139    HD3  PRO  22           HD3      PRO  22  -1.714  21.644   4.246
  140    H    LEU  23           H        LEU  23   3.127  19.073   2.875
  141    HA   LEU  23           HA       LEU  23   3.256  16.875   4.680
  142    HB2  LEU  23           HB2      LEU  23   5.384  17.950   2.786
  143    HB3  LEU  23           HB3      LEU  23   5.468  16.398   3.606
  144    HG   LEU  23           HG       LEU  23   3.428  17.200   1.489
  145   HD11  LEU  23          HD11      LEU  23   5.689  15.181   1.356
  146   HD12  LEU  23          HD12      LEU  23   5.638  16.744   0.542
  147   HD13  LEU  23          HD13      LEU  23   4.496  15.482   0.089
  148   HD21  LEU  23          HD21      LEU  23   2.594  14.873   1.602
  149   HD22  LEU  23          HD22      LEU  23   2.340  15.728   3.120
  150   HD23  LEU  23          HD23      LEU  23   3.654  14.557   2.980
  151    H    SER  24           H        SER  24   4.473  16.518   6.496
  152    HA   SER  24           HA       SER  24   6.054  18.766   7.635
  153    HB2  SER  24           HB2      SER  24   3.778  18.748   8.636
  154    HB3  SER  24           HB3      SER  24   3.989  17.065   9.119
  155    HG   SER  24           HG       SER  24   4.450  18.406  10.861
  156    H    LEU  25           H        LEU  25   7.366  18.094   9.512
  157    HA   LEU  25           HA       LEU  25   8.996  16.959  10.544
  158    HB2  LEU  25           HB2      LEU  25   7.147  15.424  11.175
  159    HB3  LEU  25           HB3      LEU  25   7.454  14.458   9.743
  160    HG   LEU  25           HG       LEU  25   9.710  13.864  10.641
  161   HD11  LEU  25          HD11      LEU  25  10.151  15.836  12.027
  162   HD12  LEU  25          HD12      LEU  25  10.297  14.365  12.982
  163   HD13  LEU  25          HD13      LEU  25   8.857  15.374  13.139
  164   HD21  LEU  25          HD21      LEU  25   7.813  12.355  11.030
  165   HD22  LEU  25          HD22      LEU  25   7.416  13.206  12.524
  166   HD23  LEU  25          HD23      LEU  25   8.933  12.315  12.390
  167    H    LEU  26           H        LEU  26   8.437  14.567   7.936
  168    HA   LEU  26           HA       LEU  26  10.866  15.205   6.503
  169    HB2  LEU  26           HB2      LEU  26  11.635  13.966   8.564
  170    HB3  LEU  26           HB3      LEU  26  10.721  12.576   8.041
  171    HG   LEU  26           HG       LEU  26  12.783  13.573   6.095
  172   HD11  LEU  26          HD11      LEU  26  14.683  12.546   7.253
  173   HD12  LEU  26          HD12      LEU  26  13.665  12.205   8.656
  174   HD13  LEU  26          HD13      LEU  26  14.003  13.872   8.193
  175   HD21  LEU  26          HD21      LEU  26  11.499  11.522   5.612
  176   HD22  LEU  26          HD22      LEU  26  12.136  10.757   7.067
  177   HD23  LEU  26          HD23      LEU  26  13.222  11.175   5.736
  178    H    ASP  27           H        ASP  27  11.211  13.550   4.704
  179    HA   ASP  27           HA       ASP  27   8.786  13.066   3.254
  180    HB2  ASP  27           HB2      ASP  27  11.666  12.224   2.656
  181    HB3  ASP  27           HB3      ASP  27  10.334  12.216   1.503
  182    H    ASP  28           H        ASP  28   8.850  11.449   5.737
  183    HA   ASP  28           HA       ASP  28   9.418   8.748   5.417
  184    HB2  ASP  28           HB2      ASP  28   7.195  10.134   6.970
  185    HB3  ASP  28           HB3      ASP  28   7.525   8.409   7.110
  186    H    MET  29           H        MET  29   6.465  10.507   4.546
  187    HA   MET  29           HA       MET  29   4.928   8.401   3.505
  188    HB2  MET  29           HB2      MET  29   3.831  10.464   3.959
  189    HB3  MET  29           HB3      MET  29   4.973  11.395   3.003
  190    HG2  MET  29           HG2      MET  29   3.945  10.826   0.981
  191    HG3  MET  29           HG3      MET  29   3.185   9.385   1.650
  192    HE1  MET  29           HE1      MET  29   0.906   9.300   2.771
  193    HE2  MET  29           HE2      MET  29   0.130  10.685   3.542
  194    HE3  MET  29           HE3      MET  29   1.680  10.094   4.147
  195    H    ASN  30           H        ASN  30   7.177  10.618   1.820
  196    HA   ASN  30           HA       ASN  30   6.852   9.540  -0.800
  197    HB2  ASN  30           HB2      ASN  30   9.206  11.133   0.303
  198    HB3  ASN  30           HB3      ASN  30   8.814  10.912  -1.402
  199   HD21  ASN  30          HD21      ASN  30   9.071  13.394   0.043
  200   HD22  ASN  30          HD22      ASN  30   7.555  14.211  -0.086
  201    H    HIS  31           H        HIS  31   8.978   8.736   1.857
  202    HA   HIS  31           HA       HIS  31  10.883   7.089   0.546
  203    HB2  HIS  31           HB2      HIS  31  11.160   8.091   2.843
  204    HB3  HIS  31           HB3      HIS  31   9.925   6.997   3.453
  205    HD2  HIS  31           HD2      HIS  31  13.657   7.172   3.218
  206    HE1  HIS  31           HE1      HIS  31  12.703   3.055   3.528
  207    HE2  HIS  31           HE2      HIS  31  14.574   4.751   3.398
  208    H    CYS  32           H        CYS  32   7.964   6.357   2.438
  209    HA   CYS  32           HA       CYS  32   7.830   3.588   2.086
  210    HB2  CYS  32           HB2      CYS  32   5.588   5.590   2.564
  211    HB3  CYS  32           HB3      CYS  32   5.407   3.840   2.699
  212    HG   CYS  32           HG       CYS  32   6.462   5.989   4.946
  213    H    TYR  33           H        TYR  33   6.407   6.206   0.143
  214    HA   TYR  33           HA       TYR  33   4.975   4.643  -1.712
  215    HB2  TYR  33           HB2      TYR  33   5.943   7.488  -1.649
  216    HB3  TYR  33           HB3      TYR  33   5.388   6.857  -3.197
  217    HD1  TYR  33           HD1      TYR  33   3.126   5.227  -2.654
  218    HD2  TYR  33           HD2      TYR  33   4.222   8.869  -0.712
  219    HE1  TYR  33           HE1      TYR  33   0.783   5.659  -2.136
  220    HE2  TYR  33           HE2      TYR  33   1.870   9.289  -0.186
  221    HH   TYR  33           HH       TYR  33  -0.285   8.680  -0.869
  222    H    SER  34           H        SER  34   8.337   5.823  -1.841
  223    HA   SER  34           HA       SER  34   9.017   4.947  -4.435
  224    HB2  SER  34           HB2      SER  34  10.821   5.117  -1.978
  225    HB3  SER  34           HB3      SER  34  11.381   4.988  -3.650
  226    HG   SER  34           HG       SER  34  10.332   7.149  -2.275
  227    H    ARG  35           H        ARG  35   9.257   3.287  -1.296
  228    HA   ARG  35           HA       ARG  35  10.303   0.829  -2.231
  229    HB2  ARG  35           HB2      ARG  35  10.527   1.650   0.074
  230    HB3  ARG  35           HB3      ARG  35   8.791   1.486   0.326
  231    HG2  ARG  35           HG2      ARG  35   8.907  -0.774   0.617
  232    HG3  ARG  35           HG3      ARG  35  10.141  -0.983  -0.621
  233    HD2  ARG  35           HD2      ARG  35  11.046  -1.629   1.496
  234    HD3  ARG  35           HD3      ARG  35  11.844  -0.151   0.979
  235    HE   ARG  35           HE       ARG  35   9.923   0.825   2.562
  236   HH11  ARG  35          HH11      ARG  35  12.137  -1.774   3.124
  237   HH12  ARG  35          HH12      ARG  35  12.176  -1.499   4.829
  238   HH21  ARG  35          HH21      ARG  35   9.998   1.149   4.744
  239   HH22  ARG  35          HH22      ARG  35  10.992   0.129   5.728
  240    H    LEU  36           H        LEU  36   6.933   1.937  -1.714
  241    HA   LEU  36           HA       LEU  36   5.586  -0.511  -2.120
  242    HB2  LEU  36           HB2      LEU  36   4.694   2.340  -2.708
  243    HB3  LEU  36           HB3      LEU  36   3.632   0.954  -2.907
  244    HG   LEU  36           HG       LEU  36   4.830   1.936  -0.292
  245   HD11  LEU  36          HD11      LEU  36   2.511   2.437   0.340
  246   HD12  LEU  36          HD12      LEU  36   1.963   1.943  -1.263
  247   HD13  LEU  36          HD13      LEU  36   3.012   3.351  -1.082
  248   HD21  LEU  36          HD21      LEU  36   4.710  -0.520  -0.255
  249   HD22  LEU  36          HD22      LEU  36   3.017  -0.463  -0.754
  250   HD23  LEU  36          HD23      LEU  36   3.497   0.174   0.820
  251    H    ARG  37           H        ARG  37   6.357   2.077  -4.455
  252    HA   ARG  37           HA       ARG  37   5.377   0.980  -6.806
  253    HB2  ARG  37           HB2      ARG  37   6.117   3.316  -6.507
  254    HB3  ARG  37           HB3      ARG  37   7.791   2.783  -6.425
  255    HG2  ARG  37           HG2      ARG  37   7.738   2.055  -8.732
  256    HG3  ARG  37           HG3      ARG  37   6.009   2.387  -8.848
  257    HD2  ARG  37           HD2      ARG  37   6.394   4.771  -8.643
  258    HD3  ARG  37           HD3      ARG  37   8.108   4.505  -8.305
  259    HE   ARG  37           HE       ARG  37   8.007   3.400 -10.664
  260   HH11  ARG  37          HH11      ARG  37   6.376   6.327  -9.777
  261   HH12  ARG  37          HH12      ARG  37   6.522   6.983 -11.365
  262   HH21  ARG  37          HH21      ARG  37   8.171   4.271 -12.643
  263   HH22  ARG  37          HH22      ARG  37   7.501   5.832 -12.969
  264    H    GLU  38           H        GLU  38   8.284   0.194  -5.087
  265    HA   GLU  38           HA       GLU  38   9.588  -1.284  -7.231
  266    HB2  GLU  38           HB2      GLU  38  10.264  -0.953  -4.275
  267    HB3  GLU  38           HB3      GLU  38  11.249  -1.887  -5.401
  268    HG2  GLU  38           HG2      GLU  38  11.764   0.092  -6.701
  269    HG3  GLU  38           HG3      GLU  38  10.636   1.062  -5.755
  270    H    LEU  39           H        LEU  39   7.782  -2.025  -4.259
  271    HA   LEU  39           HA       LEU  39   8.089  -4.901  -4.460
  272    HB2  LEU  39           HB2      LEU  39   6.350  -3.180  -2.655
  273    HB3  LEU  39           HB3      LEU  39   6.481  -4.926  -2.519
  274    HG   LEU  39           HG       LEU  39   8.759  -2.952  -2.092
  275   HD11  LEU  39          HD11      LEU  39   7.233  -4.604  -0.059
  276   HD12  LEU  39          HD12      LEU  39   7.130  -2.855  -0.273
  277   HD13  LEU  39          HD13      LEU  39   8.636  -3.585   0.278
  278   HD21  LEU  39          HD21      LEU  39   8.764  -5.979  -1.766
  279   HD22  LEU  39          HD22      LEU  39  10.085  -4.889  -1.335
  280   HD23  LEU  39          HD23      LEU  39   9.609  -5.064  -3.021
  281    H    VAL  40           H        VAL  40   6.060  -2.683  -6.001
  282    HA   VAL  40           HA       VAL  40   3.978  -4.698  -6.604
  283    HB   VAL  40           HB       VAL  40   3.996  -1.705  -7.245
  284   HG11  VAL  40          HG11      VAL  40   2.641  -2.945  -8.877
  285   HG12  VAL  40          HG12      VAL  40   1.600  -1.988  -7.824
  286   HG13  VAL  40          HG13      VAL  40   1.744  -3.731  -7.575
  287   HG21  VAL  40          HG21      VAL  40   2.494  -3.209  -5.063
  288   HG22  VAL  40          HG22      VAL  40   2.286  -1.499  -5.456
  289   HG23  VAL  40          HG23      VAL  40   3.835  -2.077  -4.834
  290    HA   PRO  41           HA       PRO  41   6.202  -5.056 -10.679
  291    HB2  PRO  41           HB2      PRO  41   5.305  -7.603 -11.200
  292    HB3  PRO  41           HB3      PRO  41   6.750  -7.280 -10.232
  293    HG2  PRO  41           HG2      PRO  41   3.942  -7.876  -9.297
  294    HG3  PRO  41           HG3      PRO  41   5.481  -8.561  -8.721
  295    HD2  PRO  41           HD2      PRO  41   4.229  -6.558  -7.393
  296    HD3  PRO  41           HD3      PRO  41   5.998  -6.658  -7.456
  297    H    GLY  42           H        GLY  42   5.221  -4.717 -12.683
  298    HA2  GLY  42           HA2      GLY  42   3.267  -4.721 -14.157
  299    HA3  GLY  42           HA3      GLY  42   2.249  -4.450 -12.751
  300    H    VAL  43           H        VAL  43   4.365  -2.488 -11.708
  301    HA   VAL  43           HA       VAL  43   3.412  -0.064 -12.851
  302    HB   VAL  43           HB       VAL  43   5.897  -0.543 -11.134
  303   HG11  VAL  43          HG11      VAL  43   5.850   1.917 -10.688
  304   HG12  VAL  43          HG12      VAL  43   4.567   2.098 -11.885
  305   HG13  VAL  43          HG13      VAL  43   6.169   1.554 -12.383
  306   HG21  VAL  43          HG21      VAL  43   3.807  -1.132  -9.968
  307   HG22  VAL  43          HG22      VAL  43   3.125   0.452 -10.347
  308   HG23  VAL  43          HG23      VAL  43   4.513   0.325  -9.265
  309    HA   PRO  44           HA       PRO  44   6.173  -0.208 -16.491
  310    HB2  PRO  44           HB2      PRO  44   5.059   2.447 -17.209
  311    HB3  PRO  44           HB3      PRO  44   4.942   0.911 -18.077
  312    HG2  PRO  44           HG2      PRO  44   2.797   2.014 -16.831
  313    HG3  PRO  44           HG3      PRO  44   3.023   0.254 -16.930
  314    HD2  PRO  44           HD2      PRO  44   3.626   2.118 -14.619
  315    HD3  PRO  44           HD3      PRO  44   2.807   0.536 -14.608
  316    H    ARG  45           H        ARG  45   8.280   0.126 -15.917
  317    HA   ARG  45           HA       ARG  45   9.323   2.495 -14.709
  318    HB2  ARG  45           HB2      ARG  45  10.456   0.283 -14.551
  319    HB3  ARG  45           HB3      ARG  45  10.783   0.324 -16.279
  320    HG2  ARG  45           HG2      ARG  45  12.238   2.285 -15.978
  321    HG3  ARG  45           HG3      ARG  45  11.884   2.297 -14.248
  322    HD2  ARG  45           HD2      ARG  45  12.958   0.089 -14.004
  323    HD3  ARG  45           HD3      ARG  45  13.277   0.045 -15.740
  324    HE   ARG  45           HE       ARG  45  14.769   1.952 -15.434
  325   HH11  ARG  45          HH11      ARG  45  13.980   0.236 -12.524
  326   HH12  ARG  45          HH12      ARG  45  15.449   0.700 -11.742
  327   HH21  ARG  45          HH21      ARG  45  16.639   2.506 -14.403
  328   HH22  ARG  45          HH22      ARG  45  16.928   1.952 -12.789
  329    H    GLY  46           H        GLY  46   8.773   4.307 -15.822
  330    HA2  GLY  46           HA2      GLY  46   9.888   5.592 -17.852
  331    HA3  GLY  46           HA3      GLY  46   8.898   4.447 -18.758
  332    H    THR  47           H        THR  47   6.685   4.363 -16.935
  333    HA   THR  47           HA       THR  47   5.298   6.864 -17.474
  334    HB   THR  47           HB       THR  47   4.371   4.408 -15.894
  335    HG1  THR  47           HG1      THR  47   3.206   4.882 -18.337
  336   HG21  THR  47          HG21      THR  47   2.074   5.293 -16.261
  337   HG22  THR  47          HG22      THR  47   2.748   6.751 -16.988
  338   HG23  THR  47          HG23      THR  47   3.040   6.400 -15.282
  339    H    GLN  48           H        GLN  48   5.018   8.527 -16.052
  340    HA   GLN  48           HA       GLN  48   6.650   8.746 -13.742
  341    HB2  GLN  48           HB2      GLN  48   6.167  10.694 -15.119
  342    HB3  GLN  48           HB3      GLN  48   4.441  10.544 -14.818
  343    HG2  GLN  48           HG2      GLN  48   5.428  12.389 -13.531
  344    HG3  GLN  48           HG3      GLN  48   4.753  11.155 -12.469
  345   HE21  GLN  48          HE21      GLN  48   6.009  11.703 -10.712
  346   HE22  GLN  48          HE22      GLN  48   7.717  11.456 -10.644
  347    H    LEU  49           H        LEU  49   3.138   8.284 -14.109
  348    HA   LEU  49           HA       LEU  49   1.407   7.930 -12.705
  349    HB2  LEU  49           HB2      LEU  49   3.559   6.773 -10.890
  350    HB3  LEU  49           HB3      LEU  49   1.838   6.623 -10.580
  351    HG   LEU  49           HG       LEU  49   3.339   5.417 -12.942
  352   HD11  LEU  49          HD11      LEU  49   3.785   4.244 -10.841
  353   HD12  LEU  49          HD12      LEU  49   2.818   3.249 -11.925
  354   HD13  LEU  49          HD13      LEU  49   2.052   4.058 -10.555
  355   HD21  LEU  49          HD21      LEU  49   1.204   4.306 -13.527
  356   HD22  LEU  49          HD22      LEU  49   1.089   6.058 -13.659
  357   HD23  LEU  49          HD23      LEU  49   0.378   5.232 -12.270
  358    H    SER  50           H        SER  50   1.073   8.150  -9.929
  359    HA   SER  50           HA       SER  50   1.957  10.800  -9.064
  360    HB2  SER  50           HB2      SER  50  -0.101  11.304 -10.357
  361    HB3  SER  50           HB3      SER  50  -1.002  10.107  -9.432
  362    HG   SER  50           HG       SER  50  -1.057  12.499  -8.833
  363    H    GLN  51           H        GLN  51   0.996  11.242  -6.793
  364    HA   GLN  51           HA       GLN  51   1.748   9.307  -4.931
  365    HB2  GLN  51           HB2      GLN  51  -0.251  11.582  -4.555
  366    HB3  GLN  51           HB3      GLN  51   0.553  10.717  -3.248
  367    HG2  GLN  51           HG2      GLN  51   2.739  11.565  -4.050
  368    HG3  GLN  51           HG3      GLN  51   1.913  12.457  -5.326
  369   HE21  GLN  51          HE21      GLN  51   2.478  12.283  -1.866
  370   HE22  GLN  51          HE22      GLN  51   1.917  13.874  -1.504
  371    H    VAL  52           H        VAL  52  -1.525  10.091  -6.121
  372    HA   VAL  52           HA       VAL  52  -2.893   8.098  -4.568
  373    HB   VAL  52           HB       VAL  52  -4.024   9.247  -7.163
  374   HG11  VAL  52          HG11      VAL  52  -5.339   7.480  -6.069
  375   HG12  VAL  52          HG12      VAL  52  -6.189   9.022  -5.957
  376   HG13  VAL  52          HG13      VAL  52  -5.331   8.383  -4.548
  377   HG21  VAL  52          HG21      VAL  52  -4.893  11.181  -5.893
  378   HG22  VAL  52          HG22      VAL  52  -3.129  11.170  -5.933
  379   HG23  VAL  52          HG23      VAL  52  -3.981  10.660  -4.476
  380    H    GLU  53           H        GLU  53  -1.662   8.226  -7.914
  381    HA   GLU  53           HA       GLU  53  -2.774   5.862  -8.938
  382    HB2  GLU  53           HB2      GLU  53  -0.183   7.256  -9.715
  383    HB3  GLU  53           HB3      GLU  53  -0.916   5.956 -10.646
  384    HG2  GLU  53           HG2      GLU  53  -2.188   8.655 -10.102
  385    HG3  GLU  53           HG3      GLU  53  -1.387   8.181 -11.599
  386    H    ILE  54           H        ILE  54   0.248   6.319  -7.109
  387    HA   ILE  54           HA       ILE  54   1.249   3.686  -7.283
  388    HB   ILE  54           HB       ILE  54   1.524   5.663  -4.971
  389   HG12  ILE  54          HG12      ILE  54   3.465   5.084  -7.273
  390   HG13  ILE  54          HG13      ILE  54   2.430   6.502  -7.157
  391   HG21  ILE  54          HG21      ILE  54   2.024   3.408  -4.161
  392   HG22  ILE  54          HG22      ILE  54   3.518   4.335  -4.275
  393   HG23  ILE  54          HG23      ILE  54   3.138   3.128  -5.507
  394   HD11  ILE  54          HD11      ILE  54   4.681   5.797  -5.275
  395   HD12  ILE  54          HD12      ILE  54   3.627   7.207  -5.135
  396   HD13  ILE  54          HD13      ILE  54   4.696   7.038  -6.526
  397    H    LEU  55           H        LEU  55  -0.902   5.187  -4.810
  398    HA   LEU  55           HA       LEU  55  -1.472   2.990  -3.195
  399    HB2  LEU  55           HB2      LEU  55  -3.324   5.253  -4.024
  400    HB3  LEU  55           HB3      LEU  55  -3.688   4.118  -2.733
  401    HG   LEU  55           HG       LEU  55  -1.351   6.062  -2.730
  402   HD11  LEU  55          HD11      LEU  55  -3.488   7.250  -2.527
  403   HD12  LEU  55          HD12      LEU  55  -2.597   7.296  -1.010
  404   HD13  LEU  55          HD13      LEU  55  -3.967   6.197  -1.192
  405   HD21  LEU  55          HD21      LEU  55  -0.839   4.029  -1.462
  406   HD22  LEU  55          HD22      LEU  55  -2.347   4.189  -0.554
  407   HD23  LEU  55          HD23      LEU  55  -1.071   5.395  -0.372
  408    H    GLN  56           H        GLN  56  -3.126   3.997  -6.182
  409    HA   GLN  56           HA       GLN  56  -5.143   2.046  -6.276
  410    HB2  GLN  56           HB2      GLN  56  -3.782   3.391  -8.650
  411    HB3  GLN  56           HB3      GLN  56  -5.356   2.608  -8.672
  412    HG2  GLN  56           HG2      GLN  56  -4.710   5.073  -7.030
  413    HG3  GLN  56           HG3      GLN  56  -5.420   5.118  -8.638
  414   HE21  GLN  56          HE21      GLN  56  -7.201   6.252  -7.758
  415   HE22  GLN  56          HE22      GLN  56  -8.432   5.441  -6.861
  416    H    ARG  57           H        ARG  57  -1.900   2.056  -7.808
  417    HA   ARG  57           HA       ARG  57  -1.958  -0.496  -9.011
  418    HB2  ARG  57           HB2      ARG  57   0.410   1.142  -8.020
  419    HB3  ARG  57           HB3      ARG  57   0.574  -0.307  -9.000
  420    HG2  ARG  57           HG2      ARG  57  -0.969   2.120  -9.955
  421    HG3  ARG  57           HG3      ARG  57   0.769   1.956 -10.188
  422    HD2  ARG  57           HD2      ARG  57  -0.328   1.276 -12.216
  423    HD3  ARG  57           HD3      ARG  57   0.348  -0.166 -11.457
  424    HE   ARG  57           HE       ARG  57  -2.336   0.077 -10.668
  425   HH11  ARG  57          HH11      ARG  57  -0.578  -0.552 -13.601
  426   HH12  ARG  57          HH12      ARG  57  -1.839  -1.541 -14.247
  427   HH21  ARG  57          HH21      ARG  57  -3.902  -1.187 -11.554
  428   HH22  ARG  57          HH22      ARG  57  -3.683  -1.881 -13.113
  429    H    VAL  58           H        VAL  58  -1.088   0.469  -5.704
  430    HA   VAL  58           HA       VAL  58  -0.062  -2.045  -4.827
  431    HB   VAL  58           HB       VAL  58  -1.251   0.255  -3.195
  432   HG11  VAL  58          HG11      VAL  58  -1.404  -1.813  -1.887
  433   HG12  VAL  58          HG12      VAL  58  -0.156  -0.768  -1.213
  434   HG13  VAL  58          HG13      VAL  58   0.299  -2.168  -2.191
  435   HG21  VAL  58          HG21      VAL  58   1.099   0.832  -2.679
  436   HG22  VAL  58          HG22      VAL  58   0.815   0.862  -4.416
  437   HG23  VAL  58          HG23      VAL  58   1.664  -0.502  -3.691
  438    H    ILE  59           H        ILE  59  -3.332  -0.578  -4.676
  439    HA   ILE  59           HA       ILE  59  -4.645  -2.683  -3.303
  440    HB   ILE  59           HB       ILE  59  -5.804  -0.701  -5.316
  441   HG12  ILE  59          HG12      ILE  59  -5.847  -0.561  -2.255
  442   HG13  ILE  59          HG13      ILE  59  -4.698   0.309  -3.263
  443   HG21  ILE  59          HG21      ILE  59  -7.322  -2.624  -5.047
  444   HG22  ILE  59          HG22      ILE  59  -8.017  -1.191  -4.292
  445   HG23  ILE  59          HG23      ILE  59  -7.278  -2.443  -3.290
  446   HD11  ILE  59          HD11      ILE  59  -6.514   1.568  -4.279
  447   HD12  ILE  59          HD12      ILE  59  -6.512   1.733  -2.524
  448   HD13  ILE  59          HD13      ILE  59  -7.686   0.677  -3.303
  449    H    ASP  60           H        ASP  60  -4.340  -2.021  -6.817
  450    HA   ASP  60           HA       ASP  60  -5.609  -4.269  -7.877
  451    HB2  ASP  60           HB2      ASP  60  -3.205  -2.755  -8.989
  452    HB3  ASP  60           HB3      ASP  60  -4.173  -3.901  -9.913
  453    H    TYR  61           H        TYR  61  -2.229  -3.856  -6.884
  454    HA   TYR  61           HA       TYR  61  -1.129  -6.329  -7.535
  455    HB2  TYR  61           HB2      TYR  61   0.298  -4.529  -6.833
  456    HB3  TYR  61           HB3      TYR  61  -0.541  -4.356  -5.305
  457    HD1  TYR  61           HD1      TYR  61   1.637  -6.756  -7.201
  458    HD2  TYR  61           HD2      TYR  61   0.352  -5.398  -3.346
  459    HE1  TYR  61           HE1      TYR  61   3.351  -8.153  -6.132
  460    HE2  TYR  61           HE2      TYR  61   2.086  -6.792  -2.291
  461    HH   TYR  61           HH       TYR  61   3.397  -8.813  -2.805
  462    H    ILE  62           H        ILE  62  -2.686  -5.350  -4.456
  463    HA   ILE  62           HA       ILE  62  -2.492  -7.839  -3.120
  464    HB   ILE  62           HB       ILE  62  -4.562  -5.628  -2.671
  465   HG12  ILE  62          HG12      ILE  62  -1.882  -6.050  -1.240
  466   HG13  ILE  62          HG13      ILE  62  -2.163  -4.844  -2.488
  467   HG21  ILE  62          HG21      ILE  62  -5.231  -7.746  -1.581
  468   HG22  ILE  62          HG22      ILE  62  -4.787  -6.536  -0.378
  469   HG23  ILE  62          HG23      ILE  62  -3.660  -7.837  -0.776
  470   HD11  ILE  62          HD11      ILE  62  -3.502  -4.934   0.217
  471   HD12  ILE  62          HD12      ILE  62  -3.793  -3.725  -1.037
  472   HD13  ILE  62          HD13      ILE  62  -2.205  -3.848  -0.284
  473    H    LEU  63           H        LEU  63  -5.030  -6.500  -5.243
  474    HA   LEU  63           HA       LEU  63  -6.975  -8.537  -4.934
  475    HB2  LEU  63           HB2      LEU  63  -6.444  -6.694  -7.297
  476    HB3  LEU  63           HB3      LEU  63  -7.869  -7.712  -7.143
  477    HG   LEU  63           HG       LEU  63  -7.141  -5.432  -5.257
  478   HD11  LEU  63          HD11      LEU  63  -7.786  -4.581  -7.459
  479   HD12  LEU  63          HD12      LEU  63  -9.020  -4.207  -6.260
  480   HD13  LEU  63          HD13      LEU  63  -9.279  -5.523  -7.408
  481   HD21  LEU  63          HD21      LEU  63  -9.390  -5.746  -4.293
  482   HD22  LEU  63          HD22      LEU  63  -8.395  -7.183  -4.084
  483   HD23  LEU  63          HD23      LEU  63  -9.645  -7.153  -5.330
  484    H    ASP  64           H        ASP  64  -4.200  -8.287  -7.169
  485    HA   ASP  64           HA       ASP  64  -4.704 -10.739  -8.559
  486    HB2  ASP  64           HB2      ASP  64  -2.249  -8.955  -8.349
  487    HB3  ASP  64           HB3      ASP  64  -2.227 -10.457  -9.262
  488    H    LEU  65           H        LEU  65  -2.894  -9.939  -5.612
  489    HA   LEU  65           HA       LEU  65  -1.627 -12.451  -5.198
  490    HB2  LEU  65           HB2      LEU  65  -2.640 -10.495  -3.098
  491    HB3  LEU  65           HB3      LEU  65  -1.535 -11.826  -2.791
  492    HG   LEU  65           HG       LEU  65  -0.966  -9.324  -4.414
  493   HD11  LEU  65          HD11      LEU  65  -0.911  -8.925  -2.024
  494   HD12  LEU  65          HD12      LEU  65   0.719  -8.858  -2.684
  495   HD13  LEU  65          HD13      LEU  65   0.193 -10.282  -1.789
  496   HD21  LEU  65          HD21      LEU  65   1.321 -10.160  -4.743
  497   HD22  LEU  65          HD22      LEU  65   0.136 -11.213  -5.510
  498   HD23  LEU  65          HD23      LEU  65   0.879 -11.694  -3.982
  499    H    GLN  66           H        GLN  66  -4.841 -11.274  -4.450
  500    HA   GLN  66           HA       GLN  66  -5.760 -13.569  -2.991
  501    HB2  GLN  66           HB2      GLN  66  -7.297 -11.307  -4.336
  502    HB3  GLN  66           HB3      GLN  66  -8.006 -12.485  -3.232
  503    HG2  GLN  66           HG2      GLN  66  -6.693 -11.641  -1.382
  504    HG3  GLN  66           HG3      GLN  66  -5.769 -10.588  -2.450
  505   HE21  GLN  66          HE21      GLN  66  -7.336  -9.858  -0.103
  506   HE22  GLN  66          HE22      GLN  66  -8.525  -8.726  -0.639
  507    H    VAL  67           H        VAL  67  -6.499 -12.337  -6.288
  508    HA   VAL  67           HA       VAL  67  -7.222 -15.065  -7.186
  509    HB   VAL  67           HB       VAL  67  -8.788 -12.543  -7.921
  510   HG11  VAL  67          HG11      VAL  67  -8.791 -14.192  -9.734
  511   HG12  VAL  67          HG12      VAL  67 -10.396 -14.086  -9.012
  512   HG13  VAL  67          HG13      VAL  67  -9.346 -15.454  -8.628
  513   HG21  VAL  67          HG21      VAL  67  -9.244 -13.140  -5.577
  514   HG22  VAL  67          HG22      VAL  67  -9.633 -14.796  -6.045
  515   HG23  VAL  67          HG23      VAL  67 -10.662 -13.464  -6.577
  516    H    VAL  68           H        VAL  68  -5.991 -15.645  -8.905
  517    HA   VAL  68           HA       VAL  68  -5.252 -13.614 -10.955
  518    HB   VAL  68           HB       VAL  68  -3.951 -16.337 -10.409
  519   HG11  VAL  68          HG11      VAL  68  -2.264 -15.703 -12.123
  520   HG12  VAL  68          HG12      VAL  68  -3.199 -14.256 -12.506
  521   HG13  VAL  68          HG13      VAL  68  -3.880 -15.853 -12.815
  522   HG21  VAL  68          HG21      VAL  68  -3.358 -14.643  -8.715
  523   HG22  VAL  68          HG22      VAL  68  -2.836 -13.532  -9.982
  524   HG23  VAL  68          HG23      VAL  68  -1.963 -15.043  -9.719
  525    H1   MET   1           H1       MET   1  17.166  36.455 -16.260
  526    H2   MET   1           H2       MET   1  15.994  37.122 -17.270
  527    H3   MET   1           H3       MET   1  15.832  35.530 -16.735
  528    HA   MET   1           HA       MET   1  15.588  36.265 -14.465
  529    HB2  MET   1           HB2      MET   1  15.761  39.049 -15.699
  530    HB3  MET   1           HB3      MET   1  15.272  38.735 -14.037
  531    HG2  MET   1           HG2      MET   1  17.989  38.043 -15.192
  532    HG3  MET   1           HG3      MET   1  17.631  39.489 -14.252
  533    HE1  MET   1           HE1      MET   1  17.473  35.453 -14.012
  534    HE2  MET   1           HE2      MET   1  18.503  35.310 -12.591
  535    HE3  MET   1           HE3      MET   1  19.141  36.046 -14.060
  536    H    GLY   2           H        GLY   2  13.480  36.985 -13.578
  537    HA2  GLY   2           HA2      GLY   2  11.170  37.390 -13.728
  538    HA3  GLY   2           HA3      GLY   2  11.255  37.288 -15.480
  539    H    HIS   3           H        HIS   3  10.766  35.533 -12.524
  540    HA   HIS   3           HA       HIS   3  10.037  33.090 -14.023
  541    HB2  HIS   3           HB2      HIS   3  12.271  32.650 -13.117
  542    HB3  HIS   3           HB3      HIS   3  11.772  33.168 -11.513
  543    HD2  HIS   3           HD2      HIS   3  10.757  31.156  -9.939
  544    HE1  HIS   3           HE1      HIS   3  10.271  28.301 -13.012
  545    HE2  HIS   3           HE2      HIS   3   9.908  28.795 -10.566
  546    H    HIS   4           H        HIS   4   8.211  32.089 -13.352
  547    HA   HIS   4           HA       HIS   4   7.223  32.262 -10.627
  548    HB2  HIS   4           HB2      HIS   4   4.896  32.916 -11.326
  549    HB3  HIS   4           HB3      HIS   4   6.077  34.198 -11.550
  550    HD2  HIS   4           HD2      HIS   4   3.785  31.872 -13.715
  551    HE1  HIS   4           HE1      HIS   4   5.483  34.853 -16.178
  552    HE2  HIS   4           HE2      HIS   4   3.652  33.129 -15.972
  553    H    HIS   5           H        HIS   5   5.539  30.637 -10.189
  554    HA   HIS   5           HA       HIS   5   4.993  28.576 -12.161
  555    HB2  HIS   5           HB2      HIS   5   7.259  27.931 -11.380
  556    HB3  HIS   5           HB3      HIS   5   6.700  27.929  -9.709
  557    HD2  HIS   5           HD2      HIS   5   6.722  25.641 -12.829
  558    HE1  HIS   5           HE1      HIS   5   4.599  23.656  -9.758
  559    HE2  HIS   5           HE2      HIS   5   5.798  23.385 -11.962
  560    H    HIS   6           H        HIS   6   2.998  27.842 -11.797
  561    HA   HIS   6           HA       HIS   6   1.795  27.223  -9.292
  562    HB2  HIS   6           HB2      HIS   6  -0.012  29.016  -9.383
  563    HB3  HIS   6           HB3      HIS   6   1.588  29.622  -8.980
  564    HD2  HIS   6           HD2      HIS   6  -1.008  29.843 -11.912
  565    HE1  HIS   6           HE1      HIS   6   2.118  32.607 -12.591
  566    HE2  HIS   6           HE2      HIS   6  -0.034  31.652 -13.492
  567    H    HIS   7           H        HIS   7  -0.483  26.475  -9.574
  568    HA   HIS   7           HA       HIS   7  -1.624  26.186 -12.191
  569    HB2  HIS   7           HB2      HIS   7  -1.503  23.636 -12.254
  570    HB3  HIS   7           HB3      HIS   7   0.015  24.462 -12.552
  571    HD2  HIS   7           HD2      HIS   7   1.955  24.212 -10.473
  572    HE1  HIS   7           HE1      HIS   7  -0.172  21.168  -8.445
  573    HE2  HIS   7           HE2      HIS   7   1.909  22.598  -8.452
  574    H    HIS   8           H        HIS   8  -1.786  24.160  -9.189
  575    HA   HIS   8           HA       HIS   8  -3.474  23.246  -8.041
  576    HB2  HIS   8           HB2      HIS   8  -4.800  25.933  -8.549
  577    HB3  HIS   8           HB3      HIS   8  -5.447  24.729  -7.441
  578    HD2  HIS   8           HD2      HIS   8  -3.118  23.956  -5.534
  579    HE1  HIS   8           HE1      HIS   8  -2.178  28.071  -5.326
  580    HE2  HIS   8           HE2      HIS   8  -1.991  25.839  -4.155
  581    H    SER   9           H        SER   9  -5.440  22.095  -8.104
  582    HA   SER   9           HA       SER   9  -6.824  21.879 -10.719
  583    HB2  SER   9           HB2      SER   9  -5.239  19.992 -10.470
  584    HB3  SER   9           HB3      SER   9  -5.974  19.562  -8.927
  585    HG   SER   9           HG       SER   9  -6.759  18.311 -10.707
  586    H    HIS  10           H        HIS  10  -9.006  21.889 -10.623
  587    HA   HIS  10           HA       HIS  10 -10.439  21.257  -8.097
  588    HB2  HIS  10           HB2      HIS  10 -10.995  23.715  -9.834
  589    HB3  HIS  10           HB3      HIS  10 -11.951  23.215  -8.443
  590    HD1  HIS  10           HD1      HIS  10  -8.895  25.054  -9.403
  591    HD2  HIS  10           HD2      HIS  10 -10.658  23.672  -5.906
  592    HE1  HIS  10           HE1      HIS  10  -7.667  26.184  -7.545
  593    HE2  HIS  10           HE2      HIS  10  -8.753  25.355  -5.440
  594    H    MET  11           H        MET  11 -11.693  19.542  -8.635
  595    HA   MET  11           HA       MET  11 -13.121  19.506 -11.259
  596    HB2  MET  11           HB2      MET  11 -12.217  17.127  -9.575
  597    HB3  MET  11           HB3      MET  11 -13.113  17.018 -11.083
  598    HG2  MET  11           HG2      MET  11 -11.205  18.049 -12.275
  599    HG3  MET  11           HG3      MET  11 -10.306  18.106 -10.756
  600    HE1  MET  11           HE1      MET  11  -8.266  16.758 -11.936
  601    HE2  MET  11           HE2      MET  11  -9.190  16.728 -13.439
  602    HE3  MET  11           HE3      MET  11  -8.503  15.237 -12.799
  603    H    GLY  12           H        GLY  12 -15.127  17.904 -11.070
  604    HA2  GLY  12           HA2      GLY  12 -16.978  19.017  -9.150
  605    HA3  GLY  12           HA3      GLY  12 -17.327  17.791 -10.355
  606    H    GLY  13           H        GLY  13 -16.031  15.631  -9.800
  607    HA2  GLY  13           HA2      GLY  13 -15.463  13.950  -8.277
  608    HA3  GLY  13           HA3      GLY  13 -16.000  14.962  -6.950
  609    H    GLY  14           H        GLY  14 -17.649  13.739  -9.897
  610    HA2  GLY  14           HA2      GLY  14 -20.010  12.880  -8.427
  611    HA3  GLY  14           HA3      GLY  14 -19.712  12.708 -10.151
  612    H    LYS  15           H        LYS  15 -18.621  11.415  -7.012
  613    HA   LYS  15           HA       LYS  15 -18.674   8.658  -7.845
  614    HB2  LYS  15           HB2      LYS  15 -16.175   8.300  -7.554
  615    HB3  LYS  15           HB3      LYS  15 -16.615   9.217  -8.990
  616    HG2  LYS  15           HG2      LYS  15 -16.046  11.332  -7.779
  617    HG3  LYS  15           HG3      LYS  15 -15.511  10.368  -6.399
  618    HD2  LYS  15           HD2      LYS  15 -13.733   9.360  -7.737
  619    HD3  LYS  15           HD3      LYS  15 -14.320  10.165  -9.195
  620    HE2  LYS  15           HE2      LYS  15 -13.771  12.361  -8.207
  621    HE3  LYS  15           HE3      LYS  15 -13.203  11.564  -6.737
  622    HZ1  LYS  15           HZ1      LYS  15 -11.375  12.148  -8.179
  623    HZ2  LYS  15           HZ2      LYS  15 -12.027  11.245  -9.444
  624    HZ3  LYS  15           HZ3      LYS  15 -11.490  10.469  -8.040
  625    H    GLY  16           H        GLY  16 -18.277   7.190  -6.067
  626    HA2  GLY  16           HA2      GLY  16 -17.736   8.232  -3.387
  627    HA3  GLY  16           HA3      GLY  16 -19.387   7.706  -3.662
  628    HA   PRO  17           HA       PRO  17 -16.759   3.719  -3.394
  629    HB2  PRO  17           HB2      PRO  17 -14.069   3.970  -2.741
  630    HB3  PRO  17           HB3      PRO  17 -14.692   3.926  -4.391
  631    HG2  PRO  17           HG2      PRO  17 -13.493   6.171  -2.979
  632    HG3  PRO  17           HG3      PRO  17 -13.971   6.068  -4.679
  633    HD2  PRO  17           HD2      PRO  17 -15.412   7.290  -2.401
  634    HD3  PRO  17           HD3      PRO  17 -15.649   7.543  -4.145
  635    H    ALA  18           H        ALA  18 -15.280   2.571  -1.549
  636    HA   ALA  18           HA       ALA  18 -15.102   1.823   0.561
  637    HB1  ALA  18           HB1      ALA  18 -14.868   3.394   2.438
  638    HB2  ALA  18           HB2      ALA  18 -15.515   4.703   1.443
  639    HB3  ALA  18           HB3      ALA  18 -13.967   3.965   1.031
  640    H    ALA  19           H        ALA  19 -16.323   1.574   2.728
  641    HA   ALA  19           HA       ALA  19 -19.209   1.367   2.303
  642    HB1  ALA  19           HB1      ALA  19 -17.542   0.601   4.725
  643    HB2  ALA  19           HB2      ALA  19 -17.995  -0.478   3.405
  644    HB3  ALA  19           HB3      ALA  19 -19.240   0.191   4.465
  645    H    GLU  20           H        GLU  20 -16.942   3.289   4.183
  646    HA   GLU  20           HA       GLU  20 -18.846   5.452   4.487
  647    HB2  GLU  20           HB2      GLU  20 -18.616   5.696   6.917
  648    HB3  GLU  20           HB3      GLU  20 -19.323   4.135   6.538
  649    HG2  GLU  20           HG2      GLU  20 -16.387   4.517   7.210
  650    HG3  GLU  20           HG3      GLU  20 -17.621   4.157   8.412
  651    H    GLU  21           H        GLU  21 -17.685   7.380   5.606
  652    HA   GLU  21           HA       GLU  21 -14.806   7.495   4.910
  653    HB2  GLU  21           HB2      GLU  21 -15.160   9.619   3.703
  654    HB3  GLU  21           HB3      GLU  21 -16.087   8.320   2.958
  655    HG2  GLU  21           HG2      GLU  21 -18.141   9.132   4.015
  656    HG3  GLU  21           HG3      GLU  21 -17.237  10.406   4.842
  657    HA   PRO  22           HA       PRO  22 -14.570  10.103   8.651
  658    HB2  PRO  22           HB2      PRO  22 -12.261  11.448   8.301
  659    HB3  PRO  22           HB3      PRO  22 -12.265   9.684   8.451
  660    HG2  PRO  22           HG2      PRO  22 -12.165  11.359   5.936
  661    HG3  PRO  22           HG3      PRO  22 -11.138   9.982   6.399
  662    HD2  PRO  22           HD2      PRO  22 -13.308   9.722   4.745
  663    HD3  PRO  22           HD3      PRO  22 -12.751   8.415   5.809
  664    H    LEU  23           H        LEU  23 -15.673  11.311   5.864
  665    HA   LEU  23           HA       LEU  23 -16.791  13.149   5.167
  666    HB2  LEU  23           HB2      LEU  23 -16.763  13.848   8.122
  667    HB3  LEU  23           HB3      LEU  23 -17.793  14.619   6.926
  668    HG   LEU  23           HG       LEU  23 -17.928  11.686   7.740
  669   HD11  LEU  23          HD11      LEU  23 -18.731  13.153   9.522
  670   HD12  LEU  23          HD12      LEU  23 -20.065  12.256   8.800
  671   HD13  LEU  23          HD13      LEU  23 -19.827  13.957   8.393
  672   HD21  LEU  23          HD21      LEU  23 -19.715  13.240   5.834
  673   HD22  LEU  23          HD22      LEU  23 -19.971  11.579   6.373
  674   HD23  LEU  23          HD23      LEU  23 -18.565  11.973   5.389
  675    H    SER  24           H        SER  24 -13.834  13.318   5.199
  676    HA   SER  24           HA       SER  24 -12.912  15.879   5.990
  677    HB2  SER  24           HB2      SER  24 -11.749  14.069   3.823
  678    HB3  SER  24           HB3      SER  24 -10.906  15.395   4.624
  679    HG   SER  24           HG       SER  24 -10.404  13.339   5.529
  680    H    LEU  25           H        LEU  25 -12.588  15.168   2.505
  681    HA   LEU  25           HA       LEU  25 -14.641  17.189   1.807
  682    HB2  LEU  25           HB2      LEU  25 -11.905  16.973   0.455
  683    HB3  LEU  25           HB3      LEU  25 -13.236  17.962  -0.110
  684    HG   LEU  25           HG       LEU  25 -13.014  19.187   2.211
  685   HD11  LEU  25          HD11      LEU  25 -10.751  19.245   3.165
  686   HD12  LEU  25          HD12      LEU  25 -10.245  17.959   2.067
  687   HD13  LEU  25          HD13      LEU  25 -11.468  17.642   3.292
  688   HD21  LEU  25          HD21      LEU  25 -12.544  20.264   0.054
  689   HD22  LEU  25          HD22      LEU  25 -10.906  19.602   0.056
  690   HD23  LEU  25          HD23      LEU  25 -11.390  20.777   1.282
  691    H    LEU  26           H        LEU  26 -12.359  15.043   0.153
  692    HA   LEU  26           HA       LEU  26 -14.422  13.143  -0.661
  693    HB2  LEU  26           HB2      LEU  26 -14.215  14.920  -2.511
  694    HB3  LEU  26           HB3      LEU  26 -12.566  14.394  -2.753
  695    HG   LEU  26           HG       LEU  26 -14.975  12.562  -3.139
  696   HD11  LEU  26          HD11      LEU  26 -15.174  14.433  -4.680
  697   HD12  LEU  26          HD12      LEU  26 -14.778  12.957  -5.555
  698   HD13  LEU  26          HD13      LEU  26 -13.526  14.168  -5.261
  699   HD21  LEU  26          HD21      LEU  26 -12.113  12.238  -4.110
  700   HD22  LEU  26          HD22      LEU  26 -13.460  11.161  -4.492
  701   HD23  LEU  26          HD23      LEU  26 -12.898  11.306  -2.831
  702    H    ASP  27           H        ASP  27 -11.107  14.012  -1.550
  703    HA   ASP  27           HA       ASP  27  -9.086  13.100  -1.364
  704    HB2  ASP  27           HB2      ASP  27 -10.191  12.019   1.272
  705    HB3  ASP  27           HB3      ASP  27  -8.485  12.139   0.858
  706    H    ASP  28           H        ASP  28  -9.572  11.751  -3.251
  707    HA   ASP  28           HA       ASP  28 -10.304   9.080  -3.326
  708    HB2  ASP  28           HB2      ASP  28  -8.080  10.468  -4.892
  709    HB3  ASP  28           HB3      ASP  28  -8.752   8.892  -5.311
  710    H    MET  29           H        MET  29  -7.266  10.485  -2.293
  711    HA   MET  29           HA       MET  29  -5.636   8.236  -1.975
  712    HB2  MET  29           HB2      MET  29  -5.649  10.662  -0.114
  713    HB3  MET  29           HB3      MET  29  -4.303   9.577  -0.443
  714    HG2  MET  29           HG2      MET  29  -4.573  10.403  -2.913
  715    HG3  MET  29           HG3      MET  29  -5.452  11.741  -2.178
  716    HE1  MET  29           HE1      MET  29  -2.144   9.808  -2.512
  717    HE2  MET  29           HE2      MET  29  -2.353   9.739  -0.756
  718    HE3  MET  29           HE3      MET  29  -1.037  10.689  -1.450
  719    H    ASN  30           H        ASN  30  -7.877   9.782   0.339
  720    HA   ASN  30           HA       ASN  30  -7.366   8.130   2.565
  721    HB2  ASN  30           HB2      ASN  30  -8.444  10.390   2.659
  722    HB3  ASN  30           HB3      ASN  30  -9.903   9.705   1.956
  723   HD21  ASN  30          HD21      ASN  30  -7.949   9.936   4.815
  724   HD22  ASN  30          HD22      ASN  30  -9.084   9.209   5.889
  725    H    HIS  31           H        HIS  31  -9.806   7.865  -0.030
  726    HA   HIS  31           HA       HIS  31 -11.190   5.593   0.998
  727    HB2  HIS  31           HB2      HIS  31 -10.951   6.649  -1.847
  728    HB3  HIS  31           HB3      HIS  31 -12.022   5.326  -1.384
  729    HD2  HIS  31           HD2      HIS  31 -11.986   9.138  -1.468
  730    HE1  HIS  31           HE1      HIS  31 -15.380   7.946   0.756
  731    HE2  HIS  31           HE2      HIS  31 -14.078   9.912  -0.161
  732    H    CYS  32           H        CYS  32  -8.356   5.901  -1.127
  733    HA   CYS  32           HA       CYS  32  -7.899   3.125  -1.578
  734    HB2  CYS  32           HB2      CYS  32  -5.918   5.437  -1.499
  735    HB3  CYS  32           HB3      CYS  32  -5.531   3.810  -2.058
  736    HG   CYS  32           HG       CYS  32  -6.372   4.092  -4.462
  737    H    TYR  33           H        TYR  33  -6.902   5.332   1.009
  738    HA   TYR  33           HA       TYR  33  -5.279   3.538   2.493
  739    HB2  TYR  33           HB2      TYR  33  -6.637   6.158   3.175
  740    HB3  TYR  33           HB3      TYR  33  -5.756   5.256   4.403
  741    HD1  TYR  33           HD1      TYR  33  -3.367   4.336   3.277
  742    HD2  TYR  33           HD2      TYR  33  -5.328   8.012   2.374
  743    HE1  TYR  33           HE1      TYR  33  -1.231   5.316   2.659
  744    HE2  TYR  33           HE2      TYR  33  -3.177   9.006   1.736
  745    HH   TYR  33           HH       TYR  33  -0.397   7.213   1.213
  746    H    SER  34           H        SER  34  -8.749   4.162   2.492
  747    HA   SER  34           HA       SER  34  -9.525   2.701   4.773
  748    HB2  SER  34           HB2      SER  34 -11.049   3.035   2.146
  749    HB3  SER  34           HB3      SER  34 -11.752   2.456   3.661
  750    HG   SER  34           HG       SER  34 -11.892   4.825   3.015
  751    H    ARG  35           H        ARG  35  -9.128   1.659   1.371
  752    HA   ARG  35           HA       ARG  35  -9.571  -1.113   1.746
  753    HB2  ARG  35           HB2      ARG  35  -8.139   0.462  -0.387
  754    HB3  ARG  35           HB3      ARG  35  -8.178  -1.306  -0.423
  755    HG2  ARG  35           HG2      ARG  35 -10.662  -1.238  -0.391
  756    HG3  ARG  35           HG3      ARG  35 -10.597   0.530  -0.430
  757    HD2  ARG  35           HD2      ARG  35  -9.502   0.492  -2.560
  758    HD3  ARG  35           HD3      ARG  35  -9.356  -1.261  -2.521
  759    HE   ARG  35           HE       ARG  35 -12.062  -0.641  -2.340
  760   HH11  ARG  35          HH11      ARG  35  -9.574  -0.147  -4.696
  761   HH12  ARG  35          HH12      ARG  35 -10.632  -0.453  -6.024
  762   HH21  ARG  35          HH21      ARG  35 -13.389  -1.030  -4.061
  763   HH22  ARG  35          HH22      ARG  35 -12.764  -0.957  -5.672
  764    H    LEU  36           H        LEU  36  -6.524   0.757   1.779
  765    HA   LEU  36           HA       LEU  36  -4.788  -1.432   2.322
  766    HB2  LEU  36           HB2      LEU  36  -4.395   1.504   2.944
  767    HB3  LEU  36           HB3      LEU  36  -3.138   0.285   3.025
  768    HG   LEU  36           HG       LEU  36  -4.562   1.247   0.521
  769   HD11  LEU  36          HD11      LEU  36  -2.887   2.818   1.346
  770   HD12  LEU  36          HD12      LEU  36  -2.353   2.070  -0.158
  771   HD13  LEU  36          HD13      LEU  36  -1.672   1.533   1.380
  772   HD21  LEU  36          HD21      LEU  36  -4.156  -1.162   0.298
  773   HD22  LEU  36          HD22      LEU  36  -2.463  -0.941   0.746
  774   HD23  LEU  36          HD23      LEU  36  -3.076  -0.257  -0.761
  775    H    ARG  37           H        ARG  37  -6.960   0.302   4.378
  776    HA   ARG  37           HA       ARG  37  -5.807  -0.666   6.864
  777    HB2  ARG  37           HB2      ARG  37  -7.093   1.530   6.512
  778    HB3  ARG  37           HB3      ARG  37  -8.556   0.552   6.438
  779    HG2  ARG  37           HG2      ARG  37  -7.988  -0.320   8.729
  780    HG3  ARG  37           HG3      ARG  37  -6.652   0.835   8.778
  781    HD2  ARG  37           HD2      ARG  37  -8.523   1.775   9.943
  782    HD3  ARG  37           HD3      ARG  37  -8.312   2.681   8.445
  783    HE   ARG  37           HE       ARG  37 -10.280   0.485   8.646
  784   HH11  ARG  37          HH11      ARG  37  -9.723   3.850   7.953
  785   HH12  ARG  37          HH12      ARG  37 -11.328   4.070   7.354
  786   HH21  ARG  37          HH21      ARG  37 -12.273   0.815   7.865
  787   HH22  ARG  37          HH22      ARG  37 -12.754   2.385   7.317
  788    H    GLU  38           H        GLU  38  -8.439  -1.606   4.653
  789    HA   GLU  38           HA       GLU  38  -9.638  -3.458   6.577
  790    HB2  GLU  38           HB2      GLU  38 -10.453  -2.674   3.751
  791    HB3  GLU  38           HB3      GLU  38 -11.356  -3.803   4.751
  792    HG2  GLU  38           HG2      GLU  38 -10.919  -0.853   5.265
  793    HG3  GLU  38           HG3      GLU  38 -12.436  -1.650   4.862
  794    H    LEU  39           H        LEU  39  -7.901  -3.663   3.502
  795    HA   LEU  39           HA       LEU  39  -8.166  -6.515   3.174
  796    HB2  LEU  39           HB2      LEU  39  -6.247  -4.599   1.790
  797    HB3  LEU  39           HB3      LEU  39  -6.613  -6.237   1.275
  798    HG   LEU  39           HG       LEU  39  -8.573  -3.904   1.279
  799   HD11  LEU  39          HD11      LEU  39  -6.883  -3.645  -0.465
  800   HD12  LEU  39          HD12      LEU  39  -8.458  -4.000  -1.166
  801   HD13  LEU  39          HD13      LEU  39  -7.231  -5.267  -1.073
  802   HD21  LEU  39          HD21      LEU  39  -9.004  -6.739   0.277
  803   HD22  LEU  39          HD22      LEU  39 -10.133  -5.394   0.099
  804   HD23  LEU  39          HD23      LEU  39  -9.753  -6.012   1.703
  805    H    VAL  40           H        VAL  40  -5.973  -4.454   4.881
  806    HA   VAL  40           HA       VAL  40  -3.972  -6.563   5.298
  807    HB   VAL  40           HB       VAL  40  -4.011  -3.762   6.524
  808   HG11  VAL  40          HG11      VAL  40  -2.564  -5.352   7.729
  809   HG12  VAL  40          HG12      VAL  40  -1.597  -4.126   6.914
  810   HG13  VAL  40          HG13      VAL  40  -1.718  -5.752   6.233
  811   HG21  VAL  40          HG21      VAL  40  -2.672  -4.682   3.942
  812   HG22  VAL  40          HG22      VAL  40  -2.391  -3.127   4.738
  813   HG23  VAL  40          HG23      VAL  40  -3.994  -3.510   4.114
  814    HA   PRO  41           HA       PRO  41  -6.671  -7.699   8.806
  815    HB2  PRO  41           HB2      PRO  41  -5.740 -10.184   9.251
  816    HB3  PRO  41           HB3      PRO  41  -6.601  -9.792   7.756
  817    HG2  PRO  41           HG2      PRO  41  -3.621  -9.967   8.221
  818    HG3  PRO  41           HG3      PRO  41  -4.590 -10.690   6.915
  819    HD2  PRO  41           HD2      PRO  41  -3.220  -8.324   6.630
  820    HD3  PRO  41           HD3      PRO  41  -4.701  -8.700   5.725
  821    H    GLY  42           H        GLY  42  -3.711  -6.469   9.140
  822    HA2  GLY  42           HA2      GLY  42  -3.090  -7.388  11.867
  823    HA3  GLY  42           HA3      GLY  42  -2.081  -6.375  10.847
  824    H    VAL  43           H        VAL  43  -5.140  -5.088  10.638
  825    HA   VAL  43           HA       VAL  43  -4.420  -2.834  12.308
  826    HB   VAL  43           HB       VAL  43  -6.917  -3.283  10.608
  827   HG11  VAL  43          HG11      VAL  43  -7.371  -1.607  12.341
  828   HG12  VAL  43          HG12      VAL  43  -7.270  -0.826  10.766
  829   HG13  VAL  43          HG13      VAL  43  -5.918  -0.707  11.898
  830   HG21  VAL  43          HG21      VAL  43  -4.867  -3.254   9.257
  831   HG22  VAL  43          HG22      VAL  43  -4.374  -1.722   9.984
  832   HG23  VAL  43          HG23      VAL  43  -5.813  -1.796   8.961
  833    HA   PRO  44           HA       PRO  44  -6.994  -4.199  15.875
  834    HB2  PRO  44           HB2      PRO  44  -6.226  -1.543  17.004
  835    HB3  PRO  44           HB3      PRO  44  -5.949  -3.161  17.662
  836    HG2  PRO  44           HG2      PRO  44  -3.923  -1.694  16.664
  837    HG3  PRO  44           HG3      PRO  44  -3.966  -3.460  16.451
  838    HD2  PRO  44           HD2      PRO  44  -4.758  -1.292  14.488
  839    HD3  PRO  44           HD3      PRO  44  -3.763  -2.743  14.215
  840    H    ARG  45           H        ARG  45  -9.122  -3.750  16.393
  841    HA   ARG  45           HA       ARG  45 -10.681  -1.844  14.930
  842    HB2  ARG  45           HB2      ARG  45 -11.561  -4.057  15.774
  843    HB3  ARG  45           HB3      ARG  45 -11.465  -3.446  17.421
  844    HG2  ARG  45           HG2      ARG  45 -13.768  -3.348  16.624
  845    HG3  ARG  45           HG3      ARG  45 -13.151  -1.713  16.873
  846    HD2  ARG  45           HD2      ARG  45 -12.733  -1.520  14.422
  847    HD3  ARG  45           HD3      ARG  45 -13.399  -3.142  14.204
  848    HE   ARG  45           HE       ARG  45 -15.540  -2.274  15.011
  849   HH11  ARG  45          HH11      ARG  45 -13.267   0.079  13.883
  850   HH12  ARG  45          HH12      ARG  45 -14.496   1.244  13.540
  851   HH21  ARG  45          HH21      ARG  45 -17.078  -0.776  14.543
  852   HH22  ARG  45          HH22      ARG  45 -16.621   0.762  13.902
  853    H    GLY  46           H        GLY  46 -10.145   0.280  15.310
  854    HA2  GLY  46           HA2      GLY  46 -10.169   2.325  16.473
  855    HA3  GLY  46           HA3      GLY  46 -10.387   1.466  17.993
  856    H    THR  47           H        THR  47  -8.152   3.034  15.976
  857    HA   THR  47           HA       THR  47  -5.819   2.353  17.593
  858    HB   THR  47           HB       THR  47  -5.803   0.459  16.054
  859    HG1  THR  47           HG1      THR  47  -3.721   0.806  16.121
  860   HG21  THR  47          HG21      THR  47  -5.663   0.718  13.614
  861   HG22  THR  47          HG22      THR  47  -5.844   2.464  13.777
  862   HG23  THR  47          HG23      THR  47  -7.177   1.391  14.228
  863    H    GLN  48           H        GLN  48  -3.762   3.429  16.420
  864    HA   GLN  48           HA       GLN  48  -4.493   6.286  16.145
  865    HB2  GLN  48           HB2      GLN  48  -1.884   5.003  17.067
  866    HB3  GLN  48           HB3      GLN  48  -2.214   6.731  17.046
  867    HG2  GLN  48           HG2      GLN  48  -3.678   4.687  18.745
  868    HG3  GLN  48           HG3      GLN  48  -2.404   5.763  19.313
  869   HE21  GLN  48          HE21      GLN  48  -3.354   8.110  17.870
  870   HE22  GLN  48          HE22      GLN  48  -4.793   8.626  18.666
  871    H    LEU  49           H        LEU  49  -4.394   4.436  13.816
  872    HA   LEU  49           HA       LEU  49  -1.944   4.864  12.366
  873    HB2  LEU  49           HB2      LEU  49  -4.619   3.884  11.303
  874    HB3  LEU  49           HB3      LEU  49  -3.069   3.752  10.482
  875    HG   LEU  49           HG       LEU  49  -3.865   2.330  13.043
  876   HD11  LEU  49          HD11      LEU  49  -3.423   1.216  10.262
  877   HD12  LEU  49          HD12      LEU  49  -4.975   1.397  11.084
  878   HD13  LEU  49          HD13      LEU  49  -3.775   0.274  11.714
  879   HD21  LEU  49          HD21      LEU  49  -1.475   2.862  13.118
  880   HD22  LEU  49          HD22      LEU  49  -1.241   2.136  11.525
  881   HD23  LEU  49          HD23      LEU  49  -1.725   1.131  12.894
  882    H    SER  50           H        SER  50  -1.404   6.856  11.590
  883    HA   SER  50           HA       SER  50  -3.307   8.604  10.234
  884    HB2  SER  50           HB2      SER  50  -1.457  10.106   9.864
  885    HB3  SER  50           HB3      SER  50  -1.223   9.461  11.487
  886    HG   SER  50           HG       SER  50   0.683   8.901  10.793
  887    H    GLN  51           H        GLN  51  -2.511   9.362   7.914
  888    HA   GLN  51           HA       GLN  51  -2.749   7.249   6.067
  889    HB2  GLN  51           HB2      GLN  51  -1.714  10.083   5.666
  890    HB3  GLN  51           HB3      GLN  51  -2.109   8.981   4.349
  891    HG2  GLN  51           HG2      GLN  51  -4.456   8.905   5.117
  892    HG3  GLN  51           HG3      GLN  51  -4.061  10.016   6.428
  893   HE21  GLN  51          HE21      GLN  51  -2.326  11.713   4.787
  894   HE22  GLN  51          HE22      GLN  51  -3.379  12.601   3.752
  895    H    VAL  52           H        VAL  52   0.139   8.863   7.359
  896    HA   VAL  52           HA       VAL  52   2.063   7.616   5.648
  897    HB   VAL  52           HB       VAL  52   2.536   8.683   8.479
  898   HG11  VAL  52          HG11      VAL  52   4.497   8.290   6.176
  899   HG12  VAL  52          HG12      VAL  52   4.400   7.301   7.636
  900   HG13  VAL  52          HG13      VAL  52   4.882   8.993   7.752
  901   HG21  VAL  52          HG21      VAL  52   1.479  10.421   7.093
  902   HG22  VAL  52          HG22      VAL  52   2.696  10.194   5.835
  903   HG23  VAL  52          HG23      VAL  52   3.166  10.831   7.414
  904    H    GLU  53           H        GLU  53   0.854   6.830   8.931
  905    HA   GLU  53           HA       GLU  53   2.463   4.608   9.517
  906    HB2  GLU  53           HB2      GLU  53  -0.404   5.044  10.458
  907    HB3  GLU  53           HB3      GLU  53   0.794   4.005  11.223
  908    HG2  GLU  53           HG2      GLU  53   0.848   7.026  11.054
  909    HG3  GLU  53           HG3      GLU  53   0.545   6.052  12.488
  910    H    ILE  54           H        ILE  54  -0.619   4.790   7.795
  911    HA   ILE  54           HA       ILE  54  -1.176   2.055   7.464
  912    HB   ILE  54           HB       ILE  54  -1.891   4.464   5.735
  913   HG12  ILE  54          HG12      ILE  54  -3.605   2.843   7.699
  914   HG13  ILE  54          HG13      ILE  54  -2.874   4.404   8.050
  915   HG21  ILE  54          HG21      ILE  54  -3.627   3.028   4.647
  916   HG22  ILE  54          HG22      ILE  54  -2.913   1.614   5.428
  917   HG23  ILE  54          HG23      ILE  54  -1.977   2.549   4.254
  918   HD11  ILE  54          HD11      ILE  54  -5.226   4.634   7.552
  919   HD12  ILE  54          HD12      ILE  54  -5.002   3.871   5.980
  920   HD13  ILE  54          HD13      ILE  54  -4.263   5.440   6.315
  921    H    LEU  55           H        LEU  55   0.662   4.285   5.318
  922    HA   LEU  55           HA       LEU  55   1.362   2.559   3.233
  923    HB2  LEU  55           HB2      LEU  55   2.971   4.824   4.469
  924    HB3  LEU  55           HB3      LEU  55   3.374   4.062   2.940
  925    HG   LEU  55           HG       LEU  55   0.808   5.597   3.477
  926   HD11  LEU  55          HD11      LEU  55   2.739   7.103   3.511
  927   HD12  LEU  55          HD12      LEU  55   1.765   7.372   2.069
  928   HD13  LEU  55          HD13      LEU  55   3.282   6.475   1.952
  929   HD21  LEU  55          HD21      LEU  55   0.463   5.462   1.042
  930   HD22  LEU  55          HD22      LEU  55   0.511   3.859   1.766
  931   HD23  LEU  55          HD23      LEU  55   1.912   4.464   0.880
  932    H    GLN  56           H        GLN  56   3.025   3.102   6.318
  933    HA   GLN  56           HA       GLN  56   5.336   1.538   5.942
  934    HB2  GLN  56           HB2      GLN  56   3.880   1.975   8.588
  935    HB3  GLN  56           HB3      GLN  56   5.594   1.629   8.368
  936    HG2  GLN  56           HG2      GLN  56   5.981   3.814   7.413
  937    HG3  GLN  56           HG3      GLN  56   4.253   4.158   7.372
  938   HE21  GLN  56          HE21      GLN  56   6.170   5.809   8.621
  939   HE22  GLN  56          HE22      GLN  56   5.814   5.853  10.308
  940    H    ARG  57           H        ARG  57   2.208   0.696   7.443
  941    HA   ARG  57           HA       ARG  57   2.722  -1.973   8.180
  942    HB2  ARG  57           HB2      ARG  57   0.060  -0.793   7.313
  943    HB3  ARG  57           HB3      ARG  57   0.278  -2.268   8.251
  944    HG2  ARG  57           HG2      ARG  57   1.184  -0.937  10.120
  945    HG3  ARG  57           HG3      ARG  57   0.952   0.535   9.173
  946    HD2  ARG  57           HD2      ARG  57  -1.231  -1.371  10.084
  947    HD3  ARG  57           HD3      ARG  57  -0.901   0.227  10.742
  948    HE   ARG  57           HE       ARG  57  -1.831   1.215   8.830
  949   HH11  ARG  57          HH11      ARG  57  -1.958  -2.238   8.506
  950   HH12  ARG  57          HH12      ARG  57  -3.212  -2.173   7.318
  951   HH21  ARG  57          HH21      ARG  57  -3.476   1.226   7.324
  952   HH22  ARG  57          HH22      ARG  57  -4.040  -0.262   6.655
  953    H    VAL  58           H        VAL  58   1.489  -0.625   5.132
  954    HA   VAL  58           HA       VAL  58   0.785  -3.061   3.864
  955    HB   VAL  58           HB       VAL  58   1.535  -0.378   2.609
  956   HG11  VAL  58          HG11      VAL  58   0.371  -1.180   0.570
  957   HG12  VAL  58          HG12      VAL  58   0.165  -2.769   1.312
  958   HG13  VAL  58          HG13      VAL  58   1.782  -2.168   0.947
  959   HG21  VAL  58          HG21      VAL  58  -0.434  -0.262   4.101
  960   HG22  VAL  58          HG22      VAL  58  -1.204  -1.579   3.215
  961   HG23  VAL  58          HG23      VAL  58  -0.910  -0.030   2.418
  962    H    ILE  59           H        ILE  59   3.824  -1.169   3.857
  963    HA   ILE  59           HA       ILE  59   5.370  -2.792   2.141
  964    HB   ILE  59           HB       ILE  59   6.275  -1.221   4.604
  965   HG12  ILE  59          HG12      ILE  59   6.272  -0.411   1.651
  966   HG13  ILE  59          HG13      ILE  59   5.151   0.180   2.870
  967   HG21  ILE  59          HG21      ILE  59   7.990  -2.871   3.990
  968   HG22  ILE  59          HG22      ILE  59   8.546  -1.245   3.607
  969   HG23  ILE  59          HG23      ILE  59   7.974  -2.303   2.316
  970   HD11  ILE  59          HD11      ILE  59   6.858   1.808   2.395
  971   HD12  ILE  59          HD12      ILE  59   8.126   0.660   2.818
  972   HD13  ILE  59          HD13      ILE  59   7.008   1.243   4.058
  973    H    ASP  60           H        ASP  60   5.006  -2.962   5.717
  974    HA   ASP  60           HA       ASP  60   6.489  -5.310   6.190
  975    HB2  ASP  60           HB2      ASP  60   4.165  -4.099   7.740
  976    HB3  ASP  60           HB3      ASP  60   5.103  -5.468   8.331
  977    H    TYR  61           H        TYR  61   3.128  -4.905   5.205
  978    HA   TYR  61           HA       TYR  61   2.199  -7.549   5.613
  979    HB2  TYR  61           HB2      TYR  61   0.602  -5.739   5.337
  980    HB3  TYR  61           HB3      TYR  61   1.258  -5.323   3.760
  981    HD1  TYR  61           HD1      TYR  61  -0.694  -7.923   5.602
  982    HD2  TYR  61           HD2      TYR  61   0.426  -6.411   1.749
  983    HE1  TYR  61           HE1      TYR  61  -2.368  -9.374   4.538
  984    HE2  TYR  61           HE2      TYR  61  -1.264  -7.860   0.701
  985    HH   TYR  61           HH       TYR  61  -2.430 -10.023   1.261
  986    H    ILE  62           H        ILE  62   3.460  -5.903   2.710
  987    HA   ILE  62           HA       ILE  62   3.276  -8.062   0.904
  988    HB   ILE  62           HB       ILE  62   5.165  -5.653   0.844
  989   HG12  ILE  62          HG12      ILE  62   2.492  -6.044  -0.607
  990   HG13  ILE  62          HG13      ILE  62   2.697  -5.089   0.855
  991   HG21  ILE  62          HG21      ILE  62   4.436  -7.550  -1.422
  992   HG22  ILE  62          HG22      ILE  62   6.013  -7.423  -0.641
  993   HG23  ILE  62          HG23      ILE  62   5.393  -6.076  -1.591
  994   HD11  ILE  62          HD11      ILE  62   4.170  -3.549  -0.358
  995   HD12  ILE  62          HD12      ILE  62   2.578  -3.676  -1.106
  996   HD13  ILE  62          HD13      ILE  62   3.956  -4.507  -1.826
  997    H    LEU  63           H        LEU  63   6.134  -6.815   2.689
  998    HA   LEU  63           HA       LEU  63   7.999  -8.773   1.905
  999    HB2  LEU  63           HB2      LEU  63   7.925  -7.057   4.415
 1000    HB3  LEU  63           HB3      LEU  63   9.327  -7.977   3.883
 1001    HG   LEU  63           HG       LEU  63   8.050  -5.702   2.311
 1002   HD11  LEU  63          HD11      LEU  63  10.619  -5.693   3.922
 1003   HD12  LEU  63          HD12      LEU  63   9.120  -4.866   4.345
 1004   HD13  LEU  63          HD13      LEU  63  10.018  -4.372   2.913
 1005   HD21  LEU  63          HD21      LEU  63  10.031  -5.839   0.852
 1006   HD22  LEU  63          HD22      LEU  63   9.118  -7.344   0.826
 1007   HD23  LEU  63          HD23      LEU  63  10.615  -7.241   1.756
 1008    H    ASP  64           H        ASP  64   5.630  -8.814   4.500
 1009    HA   ASP  64           HA       ASP  64   6.473 -11.098   5.935
 1010    HB2  ASP  64           HB2      ASP  64   4.772  -9.555   6.792
 1011    HB3  ASP  64           HB3      ASP  64   3.685  -9.949   5.467
 1012    H    LEU  65           H        LEU  65   4.243 -10.778   3.159
 1013    HA   LEU  65           HA       LEU  65   3.631 -13.532   2.820
 1014    HB2  LEU  65           HB2      LEU  65   3.655 -11.344   0.703
 1015    HB3  LEU  65           HB3      LEU  65   2.803 -12.877   0.595
 1016    HG   LEU  65           HG       LEU  65   2.179 -10.632   2.546
 1017   HD11  LEU  65          HD11      LEU  65   1.553 -10.057   0.267
 1018   HD12  LEU  65          HD12      LEU  65   0.121 -10.315   1.262
 1019   HD13  LEU  65          HD13      LEU  65   0.633 -11.558   0.116
 1020   HD21  LEU  65          HD21      LEU  65   0.726 -13.268   2.165
 1021   HD22  LEU  65          HD22      LEU  65   0.204 -11.935   3.199
 1022   HD23  LEU  65          HD23      LEU  65   1.694 -12.798   3.569
 1023    H    GLN  66           H        GLN  66   6.187 -11.485   1.531
 1024    HA   GLN  66           HA       GLN  66   7.169 -13.127  -0.536
 1025    HB2  GLN  66           HB2      GLN  66   8.651 -11.009   1.079
 1026    HB3  GLN  66           HB3      GLN  66   9.218 -11.691  -0.440
 1027    HG2  GLN  66           HG2      GLN  66   6.658 -10.105  -0.115
 1028    HG3  GLN  66           HG3      GLN  66   8.188  -9.429  -0.661
 1029   HE21  GLN  66          HE21      GLN  66   8.917  -9.938  -2.751
 1030   HE22  GLN  66          HE22      GLN  66   7.874 -10.613  -3.947
 1031    H    VAL  67           H        VAL  67   8.522 -12.673   2.777
 1032    HA   VAL  67           HA       VAL  67  10.040 -15.217   2.504
 1033    HB   VAL  67           HB       VAL  67  11.942 -14.195   3.744
 1034   HG11  VAL  67          HG11      VAL  67  12.837 -12.797   1.912
 1035   HG12  VAL  67          HG12      VAL  67  11.224 -12.672   1.210
 1036   HG13  VAL  67          HG13      VAL  67  12.030 -14.239   1.291
 1037   HG21  VAL  67          HG21      VAL  67  10.747 -12.442   4.998
 1038   HG22  VAL  67          HG22      VAL  67  10.404 -11.568   3.505
 1039   HG23  VAL  67          HG23      VAL  67  12.068 -11.731   4.071
 1040    H    VAL  68           H        VAL  68  10.685 -16.228   4.528
 1041    HA   VAL  68           HA       VAL  68   8.783 -15.782   6.771
 1042    HB   VAL  68           HB       VAL  68  10.324 -18.341   6.076
 1043   HG11  VAL  68          HG11      VAL  68   9.850 -18.180   8.484
 1044   HG12  VAL  68          HG12      VAL  68   8.875 -19.452   7.753
 1045   HG13  VAL  68          HG13      VAL  68   8.138 -17.901   8.156
 1046   HG21  VAL  68          HG21      VAL  68   8.625 -17.864   4.359
 1047   HG22  VAL  68          HG22      VAL  68   7.380 -17.699   5.596
 1048   HG23  VAL  68          HG23      VAL  68   8.149 -19.265   5.320
  Start of MODEL    5
    1    H1   MET   1           H1       MET   1 -16.727 -11.237  10.254
    2    H2   MET   1           H2       MET   1 -16.678  -9.660   9.650
    3    H3   MET   1           H3       MET   1 -18.166 -10.408   9.940
    4    HA   MET   1           HA       MET   1 -17.766 -10.454  12.294
    5    HB2  MET   1           HB2      MET   1 -15.147  -9.053  11.587
    6    HB3  MET   1           HB3      MET   1 -15.745  -9.285  13.226
    7    HG2  MET   1           HG2      MET   1 -15.545 -11.709  12.981
    8    HG3  MET   1           HG3      MET   1 -15.022 -11.518  11.309
    9    HE1  MET   1           HE1      MET   1 -11.491  -9.843  11.754
   10    HE2  MET   1           HE2      MET   1 -13.017  -9.004  11.477
   11    HE3  MET   1           HE3      MET   1 -12.653 -10.489  10.596
   12    H    GLY   2           H        GLY   2 -19.639  -9.194  12.208
   13    HA2  GLY   2           HA2      GLY   2 -20.947  -7.310  12.381
   14    HA3  GLY   2           HA3      GLY   2 -19.483  -6.356  12.558
   15    H    HIS   3           H        HIS   3 -20.095  -8.403   9.773
   16    HA   HIS   3           HA       HIS   3 -20.269  -6.039   7.986
   17    HB2  HIS   3           HB2      HIS   3 -19.180  -8.833   7.396
   18    HB3  HIS   3           HB3      HIS   3 -19.271  -7.512   6.232
   19    HD2  HIS   3           HD2      HIS   3 -17.689  -5.162   7.191
   20    HE1  HIS   3           HE1      HIS   3 -14.893  -7.778   8.981
   21    HE2  HIS   3           HE2      HIS   3 -15.248  -5.488   7.989
   22    H    HIS   4           H        HIS   4 -22.250  -5.743   7.177
   23    HA   HIS   4           HA       HIS   4 -24.116  -8.007   6.827
   24    HB2  HIS   4           HB2      HIS   4 -24.657  -5.004   6.933
   25    HB3  HIS   4           HB3      HIS   4 -25.890  -6.252   6.744
   26    HD2  HIS   4           HD2      HIS   4 -26.485  -7.720   9.057
   27    HE1  HIS   4           HE1      HIS   4 -24.077  -5.370  11.621
   28    HE2  HIS   4           HE2      HIS   4 -25.641  -7.351  11.476
   29    H    HIS   5           H        HIS   5 -23.796  -8.892   4.867
   30    HA   HIS   5           HA       HIS   5 -23.037  -7.472   2.502
   31    HB2  HIS   5           HB2      HIS   5 -24.069 -10.316   2.882
   32    HB3  HIS   5           HB3      HIS   5 -23.431  -9.687   1.364
   33    HD2  HIS   5           HD2      HIS   5 -20.675  -9.634   1.163
   34    HE1  HIS   5           HE1      HIS   5 -19.896 -10.885   5.127
   35    HE2  HIS   5           HE2      HIS   5 -18.895 -10.482   2.844
   36    H    HIS   6           H        HIS   6 -24.422  -5.951   1.856
   37    HA   HIS   6           HA       HIS   6 -26.905  -6.567   0.549
   38    HB2  HIS   6           HB2      HIS   6 -27.800  -6.427   2.835
   39    HB3  HIS   6           HB3      HIS   6 -26.966  -4.904   3.122
   40    HD2  HIS   6           HD2      HIS   6 -30.024  -6.232   0.986
   41    HE1  HIS   6           HE1      HIS   6 -30.335  -2.047   1.504
   42    HE2  HIS   6           HE2      HIS   6 -31.519  -4.131   0.708
   43    H    HIS   7           H        HIS   7 -24.585  -4.216   1.755
   44    HA   HIS   7           HA       HIS   7 -25.422  -1.911   0.343
   45    HB2  HIS   7           HB2      HIS   7 -22.664  -2.591   1.451
   46    HB3  HIS   7           HB3      HIS   7 -23.203  -0.980   0.978
   47    HD2  HIS   7           HD2      HIS   7 -23.450  -3.433   3.965
   48    HE1  HIS   7           HE1      HIS   7 -25.665   0.042   4.908
   49    HE2  HIS   7           HE2      HIS   7 -24.920  -2.230   5.722
   50    H    HIS   8           H        HIS   8 -25.577  -1.905  -1.830
   51    HA   HIS   8           HA       HIS   8 -23.747  -3.252  -3.624
   52    HB2  HIS   8           HB2      HIS   8 -26.122  -3.088  -4.212
   53    HB3  HIS   8           HB3      HIS   8 -26.064  -1.331  -4.128
   54    HD2  HIS   8           HD2      HIS   8 -25.041  -4.229  -6.545
   55    HE1  HIS   8           HE1      HIS   8 -24.481  -0.531  -8.506
   56    HE2  HIS   8           HE2      HIS   8 -24.212  -3.030  -8.683
   57    H    SER   9           H        SER   9 -21.811  -2.411  -4.259
   58    HA   SER   9           HA       SER   9 -21.122   0.385  -3.732
   59    HB2  SER   9           HB2      SER   9 -19.390  -1.905  -4.762
   60    HB3  SER   9           HB3      SER   9 -18.801  -0.311  -4.291
   61    HG   SER   9           HG       SER   9 -18.807  -2.206  -2.709
   62    H    HIS  10           H        HIS  10 -22.312   1.502  -5.308
   63    HA   HIS  10           HA       HIS  10 -21.733   1.053  -8.164
   64    HB2  HIS  10           HB2      HIS  10 -24.109   1.324  -7.454
   65    HB3  HIS  10           HB3      HIS  10 -23.745   2.934  -6.847
   66    HD1  HIS  10           HD1      HIS  10 -23.632   1.038 -10.152
   67    HD2  HIS  10           HD2      HIS  10 -24.169   4.902  -8.720
   68    HE1  HIS  10           HE1      HIS  10 -24.195   2.426 -12.157
   69    HE2  HIS  10           HE2      HIS  10 -24.363   4.771 -11.290
   70    H    MET  11           H        MET  11 -19.789   1.963  -8.670
   71    HA   MET  11           HA       MET  11 -19.349   4.858  -8.118
   72    HB2  MET  11           HB2      MET  11 -17.233   2.652  -8.166
   73    HB3  MET  11           HB3      MET  11 -16.887   4.371  -8.021
   74    HG2  MET  11           HG2      MET  11 -18.081   4.429  -5.865
   75    HG3  MET  11           HG3      MET  11 -18.423   2.704  -6.008
   76    HE1  MET  11           HE1      MET  11 -14.794   1.167  -5.747
   77    HE2  MET  11           HE2      MET  11 -15.633   1.594  -7.237
   78    HE3  MET  11           HE3      MET  11 -16.510   0.805  -5.925
   79    H    GLY  12           H        GLY  12 -18.858   6.082  -9.882
   80    HA2  GLY  12           HA2      GLY  12 -18.017   4.789 -12.431
   81    HA3  GLY  12           HA3      GLY  12 -19.356   5.930 -12.395
   82    H    GLY  13           H        GLY  13 -16.367   6.152 -10.531
   83    HA2  GLY  13           HA2      GLY  13 -14.596   7.617 -10.586
   84    HA3  GLY  13           HA3      GLY  13 -15.107   8.144 -12.181
   85    H    GLY  14           H        GLY  14 -14.354  10.230 -11.239
   86    HA2  GLY  14           HA2      GLY  14 -16.565  11.887 -10.594
   87    HA3  GLY  14           HA3      GLY  14 -15.608  11.593  -9.148
   88    H    LYS  15           H        LYS  15 -15.986  14.095 -10.130
   89    HA   LYS  15           HA       LYS  15 -13.265  14.933 -10.949
   90    HB2  LYS  15           HB2      LYS  15 -15.940  16.243 -11.641
   91    HB3  LYS  15           HB3      LYS  15 -14.393  17.053 -11.835
   92    HG2  LYS  15           HG2      LYS  15 -14.956  16.284 -13.995
   93    HG3  LYS  15           HG3      LYS  15 -13.724  15.168 -13.417
   94    HD2  LYS  15           HD2      LYS  15 -15.457  13.907 -14.567
   95    HD3  LYS  15           HD3      LYS  15 -15.516  13.517 -12.850
   96    HE2  LYS  15           HE2      LYS  15 -17.781  13.782 -13.729
   97    HE3  LYS  15           HE3      LYS  15 -17.434  15.074 -12.579
   98    HZ1  LYS  15           HZ1      LYS  15 -17.016  16.568 -14.410
   99    HZ2  LYS  15           HZ2      LYS  15 -18.549  15.880 -14.567
  100    HZ3  LYS  15           HZ3      LYS  15 -17.278  15.329 -15.532
  101    H    GLY  16           H        GLY  16 -12.563  16.981  -9.979
  102    HA2  GLY  16           HA2      GLY  16 -13.904  18.479  -8.055
  103    HA3  GLY  16           HA3      GLY  16 -13.137  17.161  -7.181
  104    HA   PRO  17           HA       PRO  17  -9.671  20.268  -8.933
  105    HB2  PRO  17           HB2      PRO  17 -11.319  22.761  -8.581
  106    HB3  PRO  17           HB3      PRO  17 -10.108  22.377  -9.812
  107    HG2  PRO  17           HG2      PRO  17 -12.709  22.350 -10.432
  108    HG3  PRO  17           HG3      PRO  17 -11.620  21.107 -11.090
  109    HD2  PRO  17           HD2      PRO  17 -13.559  20.898  -8.775
  110    HD3  PRO  17           HD3      PRO  17 -13.247  19.740 -10.089
  111    H    ALA  18           H        ALA  18  -9.006  19.428  -6.901
  112    HA   ALA  18           HA       ALA  18  -8.862  21.308  -4.689
  113    HB1  ALA  18           HB1      ALA  18 -10.165  18.586  -4.281
  114    HB2  ALA  18           HB2      ALA  18 -10.990  20.143  -4.196
  115    HB3  ALA  18           HB3      ALA  18  -9.756  19.733  -3.003
  116    H    ALA  19           H        ALA  19  -6.642  21.305  -4.961
  117    HA   ALA  19           HA       ALA  19  -5.106  18.975  -4.081
  118    HB1  ALA  19           HB1      ALA  19  -5.247  18.682  -6.541
  119    HB2  ALA  19           HB2      ALA  19  -3.594  19.013  -6.024
  120    HB3  ALA  19           HB3      ALA  19  -4.560  20.288  -6.772
  121    H    GLU  20           H        GLU  20  -3.815  19.776  -2.538
  122    HA   GLU  20           HA       GLU  20  -2.662  22.507  -2.783
  123    HB2  GLU  20           HB2      GLU  20  -3.095  20.812  -0.280
  124    HB3  GLU  20           HB3      GLU  20  -2.409  22.435  -0.312
  125    HG2  GLU  20           HG2      GLU  20  -4.526  23.358  -1.119
  126    HG3  GLU  20           HG3      GLU  20  -5.220  21.740  -1.217
  127    H    GLU  21           H        GLU  21  -0.560  22.539  -3.356
  128    HA   GLU  21           HA       GLU  21   1.023  20.131  -3.430
  129    HB2  GLU  21           HB2      GLU  21   2.764  21.509  -4.493
  130    HB3  GLU  21           HB3      GLU  21   1.199  21.760  -5.252
  131    HG2  GLU  21           HG2      GLU  21   0.961  23.888  -3.940
  132    HG3  GLU  21           HG3      GLU  21   2.599  23.651  -3.331
  133    HA   PRO  22           HA       PRO  22   2.912  20.764   0.625
  134    HB2  PRO  22           HB2      PRO  22   4.551  18.641   0.708
  135    HB3  PRO  22           HB3      PRO  22   2.799  18.416   0.620
  136    HG2  PRO  22           HG2      PRO  22   4.841  18.261  -1.596
  137    HG3  PRO  22           HG3      PRO  22   3.499  17.152  -1.238
  138    HD2  PRO  22           HD2      PRO  22   3.379  19.177  -3.135
  139    HD3  PRO  22           HD3      PRO  22   1.951  18.492  -2.328
  140    H    LEU  23           H        LEU  23   5.381  20.456   1.521
  141    HA   LEU  23           HA       LEU  23   6.868  22.643   0.236
  142    HB2  LEU  23           HB2      LEU  23   7.273  21.256   2.915
  143    HB3  LEU  23           HB3      LEU  23   8.154  22.672   2.366
  144    HG   LEU  23           HG       LEU  23   5.174  22.558   2.979
  145   HD11  LEU  23          HD11      LEU  23   6.552  22.484   5.013
  146   HD12  LEU  23          HD12      LEU  23   5.698  24.019   4.887
  147   HD13  LEU  23          HD13      LEU  23   7.418  23.935   4.496
  148   HD21  LEU  23          HD21      LEU  23   5.169  25.010   2.617
  149   HD22  LEU  23          HD22      LEU  23   5.586  24.137   1.145
  150   HD23  LEU  23          HD23      LEU  23   6.852  24.934   2.082
  151    H    SER  24           H        SER  24   9.381  22.430   0.577
  152    HA   SER  24           HA       SER  24  10.356  20.064  -0.817
  153    HB2  SER  24           HB2      SER  24  11.184  22.364  -1.382
  154    HB3  SER  24           HB3      SER  24  11.930  22.465   0.212
  155    HG   SER  24           HG       SER  24  12.758  21.147  -2.044
  156    H    LEU  25           H        LEU  25   9.706  18.639   0.980
  157    HA   LEU  25           HA       LEU  25  11.655  18.513   3.230
  158    HB2  LEU  25           HB2      LEU  25   8.872  17.280   3.083
  159    HB3  LEU  25           HB3      LEU  25   9.942  17.260   4.475
  160    HG   LEU  25           HG       LEU  25   8.603  19.732   3.307
  161   HD11  LEU  25          HD11      LEU  25   7.240  19.764   5.340
  162   HD12  LEU  25          HD12      LEU  25   7.997  18.268   5.892
  163   HD13  LEU  25          HD13      LEU  25   6.992  18.268   4.439
  164   HD21  LEU  25          HD21      LEU  25  10.768  20.326   4.280
  165   HD22  LEU  25          HD22      LEU  25  10.349  19.494   5.780
  166   HD23  LEU  25          HD23      LEU  25   9.453  20.931   5.284
  167    H    LEU  26           H        LEU  26  11.843  16.124   4.050
  168    HA   LEU  26           HA       LEU  26  12.653  14.348   1.907
  169    HB2  LEU  26           HB2      LEU  26  13.765  14.584   4.201
  170    HB3  LEU  26           HB3      LEU  26  12.408  13.719   4.889
  171    HG   LEU  26           HG       LEU  26  14.225  12.486   2.766
  172   HD11  LEU  26          HD11      LEU  26  14.534  12.240   5.779
  173   HD12  LEU  26          HD12      LEU  26  15.614  13.113   4.693
  174   HD13  LEU  26          HD13      LEU  26  15.470  11.363   4.562
  175   HD21  LEU  26          HD21      LEU  26  12.088  11.303   3.026
  176   HD22  LEU  26          HD22      LEU  26  12.351  11.158   4.764
  177   HD23  LEU  26          HD23      LEU  26  13.416  10.315   3.634
  178    H    ASP  27           H        ASP  27  10.183  14.324   4.456
  179    HA   ASP  27           HA       ASP  27   8.229  13.317   4.846
  180    HB2  ASP  27           HB2      ASP  27   8.041  12.989   1.828
  181    HB3  ASP  27           HB3      ASP  27   6.697  12.855   2.959
  182    H    ASP  28           H        ASP  28   8.324  11.468   5.923
  183    HA   ASP  28           HA       ASP  28   9.745   9.132   5.271
  184    HB2  ASP  28           HB2      ASP  28   7.272   9.182   7.060
  185    HB3  ASP  28           HB3      ASP  28   8.664   8.106   7.178
  186    H    MET  29           H        MET  29   6.376  10.028   4.727
  187    HA   MET  29           HA       MET  29   5.406   7.555   3.744
  188    HB2  MET  29           HB2      MET  29   3.441   8.770   3.030
  189    HB3  MET  29           HB3      MET  29   3.929   9.292   4.627
  190    HG2  MET  29           HG2      MET  29   4.991  11.312   3.516
  191    HG3  MET  29           HG3      MET  29   4.182  10.807   2.029
  192    HE1  MET  29           HE1      MET  29   1.620   9.479   4.048
  193    HE2  MET  29           HE2      MET  29   1.378  10.023   2.381
  194    HE3  MET  29           HE3      MET  29   0.410  10.717   3.681
  195    H    ASN  30           H        ASN  30   6.920  10.317   2.139
  196    HA   ASN  30           HA       ASN  30   6.419   9.556  -0.572
  197    HB2  ASN  30           HB2      ASN  30   6.981  11.879   0.101
  198    HB3  ASN  30           HB3      ASN  30   8.587  11.357   0.598
  199   HD21  ASN  30          HD21      ASN  30   9.651  12.717  -0.810
  200   HD22  ASN  30          HD22      ASN  30   9.642  12.513  -2.522
  201    H    HIS  31           H        HIS  31   9.134   9.023   1.674
  202    HA   HIS  31           HA       HIS  31  10.823   7.489   0.011
  203    HB2  HIS  31           HB2      HIS  31  11.519   8.394   2.226
  204    HB3  HIS  31           HB3      HIS  31  10.433   7.267   3.035
  205    HD2  HIS  31           HD2      HIS  31  13.819   7.222   1.045
  206    HE1  HIS  31           HE1      HIS  31  13.349   3.534   3.058
  207    HE2  HIS  31           HE2      HIS  31  14.973   5.055   1.856
  208    H    CYS  32           H        CYS  32   8.124   6.525   2.130
  209    HA   CYS  32           HA       CYS  32   8.158   3.738   1.680
  210    HB2  CYS  32           HB2      CYS  32   5.802   5.539   2.377
  211    HB3  CYS  32           HB3      CYS  32   5.772   3.777   2.453
  212    HG   CYS  32           HG       CYS  32   8.133   5.429   4.229
  213    H    TYR  33           H        TYR  33   6.588   6.372  -0.134
  214    HA   TYR  33           HA       TYR  33   5.085   4.801  -1.955
  215    HB2  TYR  33           HB2      TYR  33   6.017   7.677  -1.945
  216    HB3  TYR  33           HB3      TYR  33   5.257   7.025  -3.394
  217    HD1  TYR  33           HD1      TYR  33   3.094   5.423  -2.580
  218    HD2  TYR  33           HD2      TYR  33   4.453   9.026  -0.739
  219    HE1  TYR  33           HE1      TYR  33   0.848   5.826  -1.737
  220    HE2  TYR  33           HE2      TYR  33   2.188   9.433   0.125
  221    HH   TYR  33           HH       TYR  33  -0.275   7.055   0.004
  222    H    SER  34           H        SER  34   8.385   6.063  -2.114
  223    HA   SER  34           HA       SER  34   9.078   5.233  -4.718
  224    HB2  SER  34           HB2      SER  34  10.853   5.419  -2.234
  225    HB3  SER  34           HB3      SER  34  11.441   5.298  -3.898
  226    HG   SER  34           HG       SER  34  11.268   7.479  -2.906
  227    H    ARG  35           H        ARG  35   9.178   3.520  -1.598
  228    HA   ARG  35           HA       ARG  35  10.339   1.110  -2.654
  229    HB2  ARG  35           HB2      ARG  35  10.127   2.201  -0.104
  230    HB3  ARG  35           HB3      ARG  35   8.953   0.898  -0.009
  231    HG2  ARG  35           HG2      ARG  35  11.854   0.577  -0.832
  232    HG3  ARG  35           HG3      ARG  35  11.218   0.253   0.781
  233    HD2  ARG  35           HD2      ARG  35   9.857  -1.572  -0.084
  234    HD3  ARG  35           HD3      ARG  35  10.338  -1.192  -1.741
  235    HE   ARG  35           HE       ARG  35  12.292  -2.051   0.297
  236   HH11  ARG  35          HH11      ARG  35  10.906  -2.486  -2.831
  237   HH12  ARG  35          HH12      ARG  35  12.070  -3.668  -3.293
  238   HH21  ARG  35          HH21      ARG  35  13.752  -3.576  -0.309
  239   HH22  ARG  35          HH22      ARG  35  13.655  -4.281  -1.884
  240    H    LEU  36           H        LEU  36   6.992   2.159  -2.069
  241    HA   LEU  36           HA       LEU  36   5.706  -0.350  -2.307
  242    HB2  LEU  36           HB2      LEU  36   4.688   2.433  -2.987
  243    HB3  LEU  36           HB3      LEU  36   3.676   1.000  -3.049
  244    HG   LEU  36           HG       LEU  36   5.002   2.103  -0.542
  245   HD11  LEU  36          HD11      LEU  36   2.744   2.711   0.195
  246   HD12  LEU  36          HD12      LEU  36   2.083   2.169  -1.349
  247   HD13  LEU  36          HD13      LEU  36   3.182   3.549  -1.292
  248   HD21  LEU  36          HD21      LEU  36   4.810  -0.344  -0.414
  249   HD22  LEU  36          HD22      LEU  36   3.095  -0.250  -0.824
  250   HD23  LEU  36          HD23      LEU  36   3.681   0.427   0.696
  251    H    ARG  37           H        ARG  37   6.511   2.116  -4.755
  252    HA   ARG  37           HA       ARG  37   5.635   0.775  -7.067
  253    HB2  ARG  37           HB2      ARG  37   7.778   2.862  -6.618
  254    HB3  ARG  37           HB3      ARG  37   7.429   2.227  -8.225
  255    HG2  ARG  37           HG2      ARG  37   5.094   2.993  -8.039
  256    HG3  ARG  37           HG3      ARG  37   5.422   3.618  -6.420
  257    HD2  ARG  37           HD2      ARG  37   6.868   4.563  -8.917
  258    HD3  ARG  37           HD3      ARG  37   5.435   5.340  -8.248
  259    HE   ARG  37           HE       ARG  37   6.806   5.646  -6.156
  260   HH11  ARG  37          HH11      ARG  37   8.438   5.429  -9.204
  261   HH12  ARG  37          HH12      ARG  37   9.706   6.487  -8.705
  262   HH21  ARG  37          HH21      ARG  37   8.436   7.008  -5.578
  263   HH22  ARG  37          HH22      ARG  37   9.700   7.366  -6.700
  264    H    GLU  38           H        GLU  38   8.378   0.051  -5.066
  265    HA   GLU  38           HA       GLU  38   9.813  -1.489  -7.104
  266    HB2  GLU  38           HB2      GLU  38  10.326  -1.182  -4.108
  267    HB3  GLU  38           HB3      GLU  38  11.387  -2.028  -5.227
  268    HG2  GLU  38           HG2      GLU  38  10.752   0.933  -5.305
  269    HG3  GLU  38           HG3      GLU  38  12.219   0.217  -4.646
  270    H    LEU  39           H        LEU  39   7.778  -2.017  -4.255
  271    HA   LEU  39           HA       LEU  39   8.042  -4.871  -4.112
  272    HB2  LEU  39           HB2      LEU  39   6.009  -2.974  -2.880
  273    HB3  LEU  39           HB3      LEU  39   6.111  -4.684  -2.496
  274    HG   LEU  39           HG       LEU  39   8.331  -2.666  -1.967
  275   HD11  LEU  39          HD11      LEU  39   6.368  -3.884  -0.001
  276   HD12  LEU  39          HD12      LEU  39   6.405  -2.201  -0.532
  277   HD13  LEU  39          HD13      LEU  39   7.743  -2.853   0.411
  278   HD21  LEU  39          HD21      LEU  39   8.103  -5.582  -1.120
  279   HD22  LEU  39          HD22      LEU  39   9.376  -4.462  -0.629
  280   HD23  LEU  39          HD23      LEU  39   9.225  -4.928  -2.320
  281    H    VAL  40           H        VAL  40   5.948  -2.699  -5.843
  282    HA   VAL  40           HA       VAL  40   4.069  -4.803  -6.673
  283    HB   VAL  40           HB       VAL  40   4.078  -1.835  -7.425
  284   HG11  VAL  40          HG11      VAL  40   1.886  -3.929  -7.719
  285   HG12  VAL  40          HG12      VAL  40   2.807  -3.186  -9.028
  286   HG13  VAL  40          HG13      VAL  40   1.707  -2.204  -8.063
  287   HG21  VAL  40          HG21      VAL  40   2.523  -3.231  -5.205
  288   HG22  VAL  40          HG22      VAL  40   2.312  -1.548  -5.705
  289   HG23  VAL  40          HG23      VAL  40   3.847  -2.070  -5.002
  290    HA   PRO  41           HA       PRO  41   6.737  -5.145 -10.450
  291    HB2  PRO  41           HB2      PRO  41   5.960  -7.626 -11.229
  292    HB3  PRO  41           HB3      PRO  41   7.049  -7.387  -9.855
  293    HG2  PRO  41           HG2      PRO  41   4.074  -7.889  -9.843
  294    HG3  PRO  41           HG3      PRO  41   5.337  -8.642  -8.844
  295    HD2  PRO  41           HD2      PRO  41   3.762  -6.559  -7.971
  296    HD3  PRO  41           HD3      PRO  41   5.406  -6.848  -7.365
  297    H    GLY  42           H        GLY  42   3.320  -5.004 -10.070
  298    HA2  GLY  42           HA2      GLY  42   2.560  -5.098 -12.866
  299    HA3  GLY  42           HA3      GLY  42   1.542  -4.668 -11.503
  300    H    VAL  43           H        VAL  43   4.322  -2.759 -11.378
  301    HA   VAL  43           HA       VAL  43   3.040  -0.363 -12.251
  302    HB   VAL  43           HB       VAL  43   5.993  -0.875 -11.649
  303   HG11  VAL  43          HG11      VAL  43   6.224   1.590 -11.417
  304   HG12  VAL  43          HG12      VAL  43   4.562   1.797 -11.979
  305   HG13  VAL  43          HG13      VAL  43   5.781   1.124 -13.060
  306   HG21  VAL  43          HG21      VAL  43   4.536  -1.267  -9.702
  307   HG22  VAL  43          HG22      VAL  43   3.808   0.329  -9.892
  308   HG23  VAL  43          HG23      VAL  43   5.513   0.183  -9.455
  309    HA   PRO  44           HA       PRO  44   3.892  -0.987 -16.708
  310    HB2  PRO  44           HB2      PRO  44   2.922   1.825 -17.014
  311    HB3  PRO  44           HB3      PRO  44   2.298   0.337 -17.738
  312    HG2  PRO  44           HG2      PRO  44   0.956   1.604 -15.773
  313    HG3  PRO  44           HG3      PRO  44   0.975  -0.171 -15.877
  314    HD2  PRO  44           HD2      PRO  44   2.601   1.643 -14.080
  315    HD3  PRO  44           HD3      PRO  44   1.755   0.130 -13.680
  316    H    ARG  45           H        ARG  45   5.549  -0.419 -18.132
  317    HA   ARG  45           HA       ARG  45   7.881   0.811 -17.035
  318    HB2  ARG  45           HB2      ARG  45   7.361  -0.001 -19.930
  319    HB3  ARG  45           HB3      ARG  45   8.938   0.317 -19.217
  320    HG2  ARG  45           HG2      ARG  45   7.076  -1.974 -18.517
  321    HG3  ARG  45           HG3      ARG  45   8.564  -2.082 -19.457
  322    HD2  ARG  45           HD2      ARG  45   9.843  -1.339 -17.442
  323    HD3  ARG  45           HD3      ARG  45   8.336  -1.344 -16.516
  324    HE   ARG  45           HE       ARG  45   8.860  -3.846 -17.815
  325   HH11  ARG  45          HH11      ARG  45   9.499  -2.039 -14.931
  326   HH12  ARG  45          HH12      ARG  45   9.967  -3.446 -14.042
  327   HH21  ARG  45          HH21      ARG  45   9.445  -5.613 -16.643
  328   HH22  ARG  45          HH22      ARG  45   9.939  -5.433 -14.993
  329    H    GLY  46           H        GLY  46   8.634   2.856 -17.187
  330    HA2  GLY  46           HA2      GLY  46   8.881   5.063 -17.748
  331    HA3  GLY  46           HA3      GLY  46   8.208   4.674 -19.324
  332    H    THR  47           H        THR  47   6.699   4.407 -16.105
  333    HA   THR  47           HA       THR  47   4.659   6.441 -16.864
  334    HB   THR  47           HB       THR  47   4.064   3.800 -15.439
  335    HG1  THR  47           HG1      THR  47   4.609   3.604 -17.706
  336   HG21  THR  47          HG21      THR  47   1.691   4.385 -15.803
  337   HG22  THR  47          HG22      THR  47   2.166   5.914 -16.543
  338   HG23  THR  47          HG23      THR  47   2.489   5.620 -14.831
  339    H    GLN  48           H        GLN  48   4.926   8.090 -15.472
  340    HA   GLN  48           HA       GLN  48   5.930   7.786 -12.770
  341    HB2  GLN  48           HB2      GLN  48   4.876  10.226 -14.267
  342    HB3  GLN  48           HB3      GLN  48   5.474  10.286 -12.615
  343    HG2  GLN  48           HG2      GLN  48   7.246  11.063 -13.993
  344    HG3  GLN  48           HG3      GLN  48   7.700   9.448 -13.468
  345   HE21  GLN  48          HE21      GLN  48   7.777   7.777 -15.040
  346   HE22  GLN  48          HE22      GLN  48   7.791   8.120 -16.731
  347    H    LEU  49           H        LEU  49   4.471   6.555 -11.622
  348    HA   LEU  49           HA       LEU  49   1.656   7.169 -11.420
  349    HB2  LEU  49           HB2      LEU  49   3.406   5.399  -9.657
  350    HB3  LEU  49           HB3      LEU  49   1.652   5.474  -9.589
  351    HG   LEU  49           HG       LEU  49   3.290   4.442 -11.940
  352   HD11  LEU  49          HD11      LEU  49   2.393   2.225 -11.355
  353   HD12  LEU  49          HD12      LEU  49   1.577   2.915  -9.950
  354   HD13  LEU  49          HD13      LEU  49   3.340   2.902 -10.031
  355   HD21  LEU  49          HD21      LEU  49   1.140   3.744 -12.933
  356   HD22  LEU  49          HD22      LEU  49   1.215   5.492 -12.741
  357   HD23  LEU  49          HD23      LEU  49   0.265   4.524 -11.610
  358    H    SER  50           H        SER  50   1.010   9.020 -10.434
  359    HA   SER  50           HA       SER  50   2.349  10.476  -8.417
  360    HB2  SER  50           HB2      SER  50   0.527  11.499  -9.722
  361    HB3  SER  50           HB3      SER  50  -0.637  10.362  -9.047
  362    HG   SER  50           HG       SER  50  -0.469  12.566  -8.082
  363    H    GLN  51           H        GLN  51   1.655  10.747  -6.119
  364    HA   GLN  51           HA       GLN  51   1.969   8.425  -4.635
  365    HB2  GLN  51           HB2      GLN  51   0.716  11.049  -3.744
  366    HB3  GLN  51           HB3      GLN  51   1.252   9.779  -2.645
  367    HG2  GLN  51           HG2      GLN  51   3.571  10.043  -3.554
  368    HG3  GLN  51           HG3      GLN  51   2.998  11.408  -4.512
  369   HE21  GLN  51          HE21      GLN  51   1.243  12.446  -2.372
  370   HE22  GLN  51          HE22      GLN  51   2.300  13.121  -1.195
  371    H    VAL  52           H        VAL  52  -1.055   9.934  -5.621
  372    HA   VAL  52           HA       VAL  52  -2.839   8.304  -4.057
  373    HB   VAL  52           HB       VAL  52  -3.588   9.732  -6.654
  374   HG11  VAL  52          HG11      VAL  52  -5.194   9.148  -4.132
  375   HG12  VAL  52          HG12      VAL  52  -5.345   8.314  -5.682
  376   HG13  VAL  52          HG13      VAL  52  -5.790  10.016  -5.556
  377   HG21  VAL  52          HG21      VAL  52  -4.031  11.773  -5.296
  378   HG22  VAL  52          HG22      VAL  52  -2.321  11.358  -5.366
  379   HG23  VAL  52          HG23      VAL  52  -3.252  11.000  -3.914
  380    H    GLU  53           H        GLU  53  -1.630   8.190  -7.396
  381    HA   GLU  53           HA       GLU  53  -3.197   5.979  -8.314
  382    HB2  GLU  53           HB2      GLU  53  -0.561   6.944  -9.508
  383    HB3  GLU  53           HB3      GLU  53  -1.855   6.084 -10.332
  384    HG2  GLU  53           HG2      GLU  53  -1.856   8.960  -9.379
  385    HG3  GLU  53           HG3      GLU  53  -1.916   8.375 -11.038
  386    H    ILE  54           H        ILE  54  -0.105   6.254  -6.709
  387    HA   ILE  54           HA       ILE  54   0.876   3.613  -6.993
  388    HB   ILE  54           HB       ILE  54   1.287   5.641  -4.743
  389   HG12  ILE  54          HG12      ILE  54   3.131   4.908  -7.076
  390   HG13  ILE  54          HG13      ILE  54   2.120   6.347  -7.006
  391   HG21  ILE  54          HG21      ILE  54   1.775   3.422  -3.847
  392   HG22  ILE  54          HG22      ILE  54   3.283   4.302  -4.068
  393   HG23  ILE  54          HG23      ILE  54   2.818   3.049  -5.224
  394   HD11  ILE  54          HD11      ILE  54   4.421   5.706  -5.165
  395   HD12  ILE  54          HD12      ILE  54   3.403   7.148  -5.078
  396   HD13  ILE  54          HD13      ILE  54   4.418   6.868  -6.492
  397    H    LEU  55           H        LEU  55  -1.134   5.146  -4.443
  398    HA   LEU  55           HA       LEU  55  -1.619   2.994  -2.748
  399    HB2  LEU  55           HB2      LEU  55  -3.564   5.190  -3.564
  400    HB3  LEU  55           HB3      LEU  55  -3.772   4.143  -2.170
  401    HG   LEU  55           HG       LEU  55  -1.520   6.150  -2.528
  402   HD11  LEU  55          HD11      LEU  55  -3.666   7.278  -2.168
  403   HD12  LEU  55          HD12      LEU  55  -2.626   7.447  -0.755
  404   HD13  LEU  55          HD13      LEU  55  -3.964   6.293  -0.730
  405   HD21  LEU  55          HD21      LEU  55  -0.805   4.214  -1.216
  406   HD22  LEU  55          HD22      LEU  55  -2.202   4.396  -0.153
  407   HD23  LEU  55          HD23      LEU  55  -0.955   5.642  -0.196
  408    H    GLN  56           H        GLN  56  -3.464   3.963  -5.611
  409    HA   GLN  56           HA       GLN  56  -5.452   1.962  -5.607
  410    HB2  GLN  56           HB2      GLN  56  -4.280   3.481  -7.980
  411    HB3  GLN  56           HB3      GLN  56  -5.830   2.639  -7.963
  412    HG2  GLN  56           HG2      GLN  56  -6.730   4.212  -6.343
  413    HG3  GLN  56           HG3      GLN  56  -5.151   4.970  -6.148
  414   HE21  GLN  56          HE21      GLN  56  -5.834   7.006  -6.757
  415   HE22  GLN  56          HE22      GLN  56  -6.286   7.407  -8.373
  416    H    ARG  57           H        ARG  57  -2.259   2.103  -7.219
  417    HA   ARG  57           HA       ARG  57  -2.464  -0.324  -8.693
  418    HB2  ARG  57           HB2      ARG  57  -0.801   1.625  -9.059
  419    HB3  ARG  57           HB3      ARG  57   0.144   0.941  -7.748
  420    HG2  ARG  57           HG2      ARG  57   1.214   0.041  -9.615
  421    HG3  ARG  57           HG3      ARG  57   0.103  -1.258  -9.185
  422    HD2  ARG  57           HD2      ARG  57  -0.267   0.794 -11.389
  423    HD3  ARG  57           HD3      ARG  57   0.125  -0.911 -11.597
  424    HE   ARG  57           HE       ARG  57  -2.236  -1.039 -10.310
  425   HH11  ARG  57          HH11      ARG  57  -1.275   0.724 -13.136
  426   HH12  ARG  57          HH12      ARG  57  -2.868   0.738 -13.792
  427   HH21  ARG  57          HH21      ARG  57  -4.275  -0.965 -11.194
  428   HH22  ARG  57          HH22      ARG  57  -4.526  -0.186 -12.706
  429    H    VAL  58           H        VAL  58  -1.290   0.392  -5.433
  430    HA   VAL  58           HA       VAL  58  -0.282  -2.193  -4.783
  431    HB   VAL  58           HB       VAL  58  -1.285   0.033  -2.940
  432   HG11  VAL  58          HG11      VAL  58  -1.372  -2.113  -1.746
  433   HG12  VAL  58          HG12      VAL  58  -0.065  -1.114  -1.112
  434   HG13  VAL  58          HG13      VAL  58   0.300  -2.459  -2.198
  435   HG21  VAL  58          HG21      VAL  58   1.564  -0.735  -3.714
  436   HG22  VAL  58          HG22      VAL  58   1.112   0.542  -2.582
  437   HG23  VAL  58          HG23      VAL  58   0.686   0.685  -4.284
  438    H    ILE  59           H        ILE  59  -3.525  -0.698  -4.475
  439    HA   ILE  59           HA       ILE  59  -4.866  -2.790  -3.132
  440    HB   ILE  59           HB       ILE  59  -5.956  -0.819  -5.199
  441   HG12  ILE  59          HG12      ILE  59  -6.115  -0.735  -2.139
  442   HG13  ILE  59          HG13      ILE  59  -4.997   0.208  -3.113
  443   HG21  ILE  59          HG21      ILE  59  -8.228  -1.321  -4.311
  444   HG22  ILE  59          HG22      ILE  59  -7.545  -2.604  -3.311
  445   HG23  ILE  59          HG23      ILE  59  -7.489  -2.735  -5.069
  446   HD11  ILE  59          HD11      ILE  59  -8.000   0.440  -3.166
  447   HD12  ILE  59          HD12      ILE  59  -6.869   1.396  -4.128
  448   HD13  ILE  59          HD13      ILE  59  -6.874   1.540  -2.370
  449    H    ASP  60           H        ASP  60  -4.427  -2.261  -6.680
  450    HA   ASP  60           HA       ASP  60  -5.583  -4.616  -7.664
  451    HB2  ASP  60           HB2      ASP  60  -3.110  -3.179  -8.732
  452    HB3  ASP  60           HB3      ASP  60  -4.024  -4.391  -9.626
  453    H    TYR  61           H        TYR  61  -2.235  -4.057  -6.668
  454    HA   TYR  61           HA       TYR  61  -1.066  -6.498  -7.251
  455    HB2  TYR  61           HB2      TYR  61   0.310  -4.611  -6.691
  456    HB3  TYR  61           HB3      TYR  61  -0.469  -4.404  -5.131
  457    HD1  TYR  61           HD1      TYR  61   1.715  -6.812  -7.022
  458    HD2  TYR  61           HD2      TYR  61   0.571  -5.311  -3.179
  459    HE1  TYR  61           HE1      TYR  61   3.508  -8.116  -5.975
  460    HE2  TYR  61           HE2      TYR  61   2.380  -6.615  -2.147
  461    HH   TYR  61           HH       TYR  61   3.692  -8.650  -2.638
  462    H    ILE  62           H        ILE  62  -2.572  -5.504  -4.152
  463    HA   ILE  62           HA       ILE  62  -2.045  -7.956  -2.783
  464    HB   ILE  62           HB       ILE  62  -4.081  -5.789  -2.076
  465   HG12  ILE  62          HG12      ILE  62  -1.205  -6.137  -1.065
  466   HG13  ILE  62          HG13      ILE  62  -1.722  -4.918  -2.219
  467   HG21  ILE  62          HG21      ILE  62  -2.888  -7.998  -0.351
  468   HG22  ILE  62          HG22      ILE  62  -4.561  -7.892  -0.901
  469   HG23  ILE  62          HG23      ILE  62  -3.935  -6.701   0.233
  470   HD11  ILE  62          HD11      ILE  62  -1.447  -3.981  -0.000
  471   HD12  ILE  62          HD12      ILE  62  -2.624  -5.116   0.656
  472   HD13  ILE  62          HD13      ILE  62  -3.134  -3.886  -0.504
  473    H    LEU  63           H        LEU  63  -4.901  -6.716  -4.560
  474    HA   LEU  63           HA       LEU  63  -6.704  -8.819  -4.031
  475    HB2  LEU  63           HB2      LEU  63  -6.446  -6.957  -6.413
  476    HB3  LEU  63           HB3      LEU  63  -7.751  -8.125  -6.282
  477    HG   LEU  63           HG       LEU  63  -7.250  -5.856  -4.313
  478   HD11  LEU  63          HD11      LEU  63  -8.007  -4.979  -6.470
  479   HD12  LEU  63          HD12      LEU  63  -9.268  -4.808  -5.251
  480   HD13  LEU  63          HD13      LEU  63  -9.383  -6.089  -6.461
  481   HD21  LEU  63          HD21      LEU  63  -8.282  -7.785  -3.216
  482   HD22  LEU  63          HD22      LEU  63  -9.542  -7.847  -4.453
  483   HD23  LEU  63          HD23      LEU  63  -9.442  -6.465  -3.357
  484    H    ASP  64           H        ASP  64  -4.061  -8.642  -6.393
  485    HA   ASP  64           HA       ASP  64  -4.676 -11.095  -7.747
  486    HB2  ASP  64           HB2      ASP  64  -2.072  -9.516  -7.581
  487    HB3  ASP  64           HB3      ASP  64  -2.329 -10.900  -8.636
  488    H    LEU  65           H        LEU  65  -2.800 -10.294  -4.870
  489    HA   LEU  65           HA       LEU  65  -1.670 -12.935  -4.508
  490    HB2  LEU  65           HB2      LEU  65  -1.970 -10.708  -2.461
  491    HB3  LEU  65           HB3      LEU  65  -0.906 -12.102  -2.337
  492    HG   LEU  65           HG       LEU  65  -0.632  -9.758  -4.254
  493   HD11  LEU  65          HD11      LEU  65   0.120  -9.251  -1.997
  494   HD12  LEU  65          HD12      LEU  65   1.492  -9.340  -3.098
  495   HD13  LEU  65          HD13      LEU  65   1.163 -10.677  -1.996
  496   HD21  LEU  65          HD21      LEU  65   1.074 -12.271  -4.171
  497   HD22  LEU  65          HD22      LEU  65   1.424 -10.821  -5.113
  498   HD23  LEU  65          HD23      LEU  65  -0.007 -11.778  -5.480
  499    H    GLN  66           H        GLN  66  -4.565 -11.298  -3.500
  500    HA   GLN  66           HA       GLN  66  -5.526 -13.566  -1.857
  501    HB2  GLN  66           HB2      GLN  66  -6.555 -10.704  -2.134
  502    HB3  GLN  66           HB3      GLN  66  -7.276 -11.931  -1.100
  503    HG2  GLN  66           HG2      GLN  66  -5.256 -12.004   0.284
  504    HG3  GLN  66           HG3      GLN  66  -4.457 -10.846  -0.781
  505   HE21  GLN  66          HE21      GLN  66  -5.069 -10.675   2.092
  506   HE22  GLN  66          HE22      GLN  66  -5.977  -9.222   2.292
  507    H    VAL  67           H        VAL  67  -8.240 -13.324  -2.125
  508    HA   VAL  67           HA       VAL  67  -8.841 -13.758  -4.999
  509    HB   VAL  67           HB       VAL  67 -10.916 -14.914  -4.199
  510   HG11  VAL  67          HG11      VAL  67  -8.916 -16.250  -4.691
  511   HG12  VAL  67          HG12      VAL  67  -9.822 -16.965  -3.357
  512   HG13  VAL  67          HG13      VAL  67  -8.347 -16.053  -3.029
  513   HG21  VAL  67          HG21      VAL  67 -11.242 -13.745  -2.044
  514   HG22  VAL  67          HG22      VAL  67  -9.786 -14.503  -1.391
  515   HG23  VAL  67          HG23      VAL  67 -11.189 -15.493  -1.797
  516    H    VAL  68           H        VAL  68 -11.568 -13.306  -5.054
  517    HA   VAL  68           HA       VAL  68 -11.851 -10.481  -5.183
  518    HB   VAL  68           HB       VAL  68 -14.046 -12.610  -5.225
  519   HG11  VAL  68          HG11      VAL  68 -14.123  -9.741  -6.244
  520   HG12  VAL  68          HG12      VAL  68 -14.993 -10.378  -4.850
  521   HG13  VAL  68          HG13      VAL  68 -15.398 -10.945  -6.468
  522   HG21  VAL  68          HG21      VAL  68 -13.864 -12.514  -7.695
  523   HG22  VAL  68          HG22      VAL  68 -12.359 -13.059  -6.955
  524   HG23  VAL  68          HG23      VAL  68 -12.494 -11.404  -7.556
  525    H1   MET   1           H1       MET   1  16.409  13.882  13.113
  526    H2   MET   1           H2       MET   1  16.105  15.533  13.285
  527    H3   MET   1           H3       MET   1  17.416  14.833  14.083
  528    HA   MET   1           HA       MET   1  18.140  16.091  12.171
  529    HB2  MET   1           HB2      MET   1  18.456  13.065  11.939
  530    HB3  MET   1           HB3      MET   1  19.431  14.219  11.030
  531    HG2  MET   1           HG2      MET   1  20.663  13.399  12.960
  532    HG3  MET   1           HG3      MET   1  20.329  15.121  13.142
  533    HE1  MET   1           HE1      MET   1  20.810  15.152  15.741
  534    HE2  MET   1           HE2      MET   1  21.308  13.463  15.619
  535    HE3  MET   1           HE3      MET   1  20.165  13.955  16.866
  536    H    GLY   2           H        GLY   2  16.919  17.096  10.660
  537    HA2  GLY   2           HA2      GLY   2  16.348  15.951   8.141
  538    HA3  GLY   2           HA3      GLY   2  14.854  16.011   9.076
  539    H    HIS   3           H        HIS   3  17.629  18.218   8.886
  540    HA   HIS   3           HA       HIS   3  16.063  20.579   9.137
  541    HB2  HIS   3           HB2      HIS   3  18.988  20.258   8.327
  542    HB3  HIS   3           HB3      HIS   3  18.232  21.760   8.853
  543    HD2  HIS   3           HD2      HIS   3  17.988  22.083  11.585
  544    HE1  HIS   3           HE1      HIS   3  19.629  18.324  12.622
  545    HE2  HIS   3           HE2      HIS   3  19.045  20.638  13.454
  546    H    HIS   4           H        HIS   4  14.648  21.015   7.511
  547    HA   HIS   4           HA       HIS   4  15.302  20.888   4.701
  548    HB2  HIS   4           HB2      HIS   4  13.035  21.855   4.370
  549    HB3  HIS   4           HB3      HIS   4  13.002  20.460   5.438
  550    HD2  HIS   4           HD2      HIS   4  11.845  24.090   5.388
  551    HE1  HIS   4           HE1      HIS   4  11.552  22.735   9.382
  552    HE2  HIS   4           HE2      HIS   4  10.757  24.455   7.711
  553    H    HIS   5           H        HIS   5  15.753  22.619   3.294
  554    HA   HIS   5           HA       HIS   5  16.015  25.350   4.270
  555    HB2  HIS   5           HB2      HIS   5  18.073  24.171   5.135
  556    HB3  HIS   5           HB3      HIS   5  18.527  23.799   3.475
  557    HD2  HIS   5           HD2      HIS   5  17.966  27.059   5.655
  558    HE1  HIS   5           HE1      HIS   5  20.876  27.793   2.680
  559    HE2  HIS   5           HE2      HIS   5  19.455  28.828   4.497
  560    H    HIS   6           H        HIS   6  15.635  23.140   1.702
  561    HA   HIS   6           HA       HIS   6  16.682  24.712  -0.452
  562    HB2  HIS   6           HB2      HIS   6  16.404  22.249  -0.649
  563    HB3  HIS   6           HB3      HIS   6  14.655  22.445  -0.600
  564    HD2  HIS   6           HD2      HIS   6  13.591  22.532  -3.101
  565    HE1  HIS   6           HE1      HIS   6  16.992  24.050  -5.093
  566    HE2  HIS   6           HE2      HIS   6  14.545  23.481  -5.314
  567    H    HIS   7           H        HIS   7  15.635  26.039  -1.914
  568    HA   HIS   7           HA       HIS   7  13.540  27.633  -0.678
  569    HB2  HIS   7           HB2      HIS   7  15.131  28.135  -3.230
  570    HB3  HIS   7           HB3      HIS   7  14.161  29.320  -2.358
  571    HD2  HIS   7           HD2      HIS   7  15.346  30.364  -0.033
  572    HE1  HIS   7           HE1      HIS   7  19.047  28.401  -0.598
  573    HE2  HIS   7           HE2      HIS   7  17.744  29.999   0.862
  574    H    HIS   8           H        HIS   8  13.979  26.344  -4.030
  575    HA   HIS   8           HA       HIS   8  11.101  26.819  -4.534
  576    HB2  HIS   8           HB2      HIS   8  11.713  26.926  -6.937
  577    HB3  HIS   8           HB3      HIS   8  12.567  28.123  -5.969
  578    HD2  HIS   8           HD2      HIS   8  13.360  25.736  -8.703
  579    HE1  HIS   8           HE1      HIS   8  16.942  26.159  -6.505
  580    HE2  HIS   8           HE2      HIS   8  15.937  25.523  -8.730
  581    H    SER   9           H        SER   9   9.844  25.094  -4.455
  582    HA   SER   9           HA       SER   9  10.416  22.735  -6.082
  583    HB2  SER   9           HB2      SER   9   9.637  22.524  -3.135
  584    HB3  SER   9           HB3      SER   9   9.548  21.182  -4.275
  585    HG   SER   9           HG       SER   9  11.987  22.320  -4.397
  586    H    HIS  10           H        HIS  10   8.831  22.944  -7.498
  587    HA   HIS  10           HA       HIS  10   6.043  23.461  -6.610
  588    HB2  HIS  10           HB2      HIS  10   7.012  25.487  -7.649
  589    HB3  HIS  10           HB3      HIS  10   7.475  24.564  -9.072
  590    HD1  HIS  10           HD1      HIS  10   5.687  24.159 -10.848
  591    HD2  HIS  10           HD2      HIS  10   4.214  26.063  -7.457
  592    HE1  HIS  10           HE1      HIS  10   3.400  24.975 -11.469
  593    HE2  HIS  10           HE2      HIS  10   2.538  26.123  -9.416
  594    H    MET  11           H        MET  11   5.468  21.278  -6.654
  595    HA   MET  11           HA       MET  11   5.925  19.668  -9.078
  596    HB2  MET  11           HB2      MET  11   5.162  17.760  -7.754
  597    HB3  MET  11           HB3      MET  11   6.372  18.657  -6.853
  598    HG2  MET  11           HG2      MET  11   4.544  19.704  -5.508
  599    HG3  MET  11           HG3      MET  11   3.378  18.711  -6.377
  600    HE1  MET  11           HE1      MET  11   7.007  17.753  -5.073
  601    HE2  MET  11           HE2      MET  11   6.603  17.019  -3.524
  602    HE3  MET  11           HE3      MET  11   6.337  18.744  -3.774
  603    H    GLY  12           H        GLY  12   4.260  18.752 -10.326
  604    HA2  GLY  12           HA2      GLY  12   1.789  20.218 -10.557
  605    HA3  GLY  12           HA3      GLY  12   2.266  18.819 -11.501
  606    H    GLY  13           H        GLY  13   0.095  19.910  -9.187
  607    HA2  GLY  13           HA2      GLY  13  -0.275  17.524  -7.610
  608    HA3  GLY  13           HA3      GLY  13  -1.320  18.936  -7.653
  609    H    GLY  14           H        GLY  14  -0.407  16.132  -9.673
  610    HA2  GLY  14           HA2      GLY  14  -3.089  16.051 -10.915
  611    HA3  GLY  14           HA3      GLY  14  -1.643  15.239 -11.489
  612    H    LYS  15           H        LYS  15  -4.549  14.768  -9.925
  613    HA   LYS  15           HA       LYS  15  -3.717  12.131  -8.823
  614    HB2  LYS  15           HB2      LYS  15  -6.209  13.672  -7.956
  615    HB3  LYS  15           HB3      LYS  15  -5.551  12.217  -7.231
  616    HG2  LYS  15           HG2      LYS  15  -5.028  13.904  -5.686
  617    HG3  LYS  15           HG3      LYS  15  -3.520  13.663  -6.567
  618    HD2  LYS  15           HD2      LYS  15  -4.017  16.068  -6.170
  619    HD3  LYS  15           HD3      LYS  15  -3.913  15.681  -7.890
  620    HE2  LYS  15           HE2      LYS  15  -5.796  17.185  -7.478
  621    HE3  LYS  15           HE3      LYS  15  -6.393  15.617  -8.017
  622    HZ1  LYS  15           HZ1      LYS  15  -6.910  15.072  -5.717
  623    HZ2  LYS  15           HZ2      LYS  15  -7.681  16.502  -6.179
  624    HZ3  LYS  15           HZ3      LYS  15  -6.306  16.564  -5.205
  625    H    GLY  16           H        GLY  16  -5.484  10.474  -8.957
  626    HA2  GLY  16           HA2      GLY  16  -7.419  10.822 -11.165
  627    HA3  GLY  16           HA3      GLY  16  -7.040   9.326 -10.319
  628    HA   PRO  17           HA       PRO  17  -9.784  12.480  -7.555
  629    HB2  PRO  17           HB2      PRO  17 -11.929  12.882  -9.630
  630    HB3  PRO  17           HB3      PRO  17 -11.283  14.021  -8.438
  631    HG2  PRO  17           HG2      PRO  17 -10.568  14.226 -11.005
  632    HG3  PRO  17           HG3      PRO  17  -9.369  14.480  -9.717
  633    HD2  PRO  17           HD2      PRO  17  -9.794  12.041 -11.455
  634    HD3  PRO  17           HD3      PRO  17  -8.271  12.816 -10.957
  635    H    ALA  18           H        ALA  18 -11.371  11.721  -6.195
  636    HA   ALA  18           HA       ALA  18 -12.020   8.940  -6.417
  637    HB1  ALA  18           HB1      ALA  18 -12.927   9.208  -4.152
  638    HB2  ALA  18           HB2      ALA  18 -12.813  10.962  -4.301
  639    HB3  ALA  18           HB3      ALA  18 -11.347   9.981  -4.296
  640    H    ALA  19           H        ALA  19 -14.393   8.382  -5.441
  641    HA   ALA  19           HA       ALA  19 -16.142   8.881  -7.700
  642    HB1  ALA  19           HB1      ALA  19 -16.525   7.113  -5.262
  643    HB2  ALA  19           HB2      ALA  19 -15.804   6.619  -6.794
  644    HB3  ALA  19           HB3      ALA  19 -17.505   7.079  -6.731
  645    H    GLU  20           H        GLU  20 -15.761  11.143  -5.687
  646    HA   GLU  20           HA       GLU  20 -18.586  11.604  -4.914
  647    HB2  GLU  20           HB2      GLU  20 -16.035  12.840  -3.797
  648    HB3  GLU  20           HB3      GLU  20 -17.657  13.370  -3.358
  649    HG2  GLU  20           HG2      GLU  20 -18.120  11.066  -2.488
  650    HG3  GLU  20           HG3      GLU  20 -16.440  10.647  -2.832
  651    H    GLU  21           H        GLU  21 -19.168  13.964  -4.875
  652    HA   GLU  21           HA       GLU  21 -18.853  15.136  -7.488
  653    HB2  GLU  21           HB2      GLU  21 -20.500  16.820  -6.740
  654    HB3  GLU  21           HB3      GLU  21 -21.071  15.191  -6.436
  655    HG2  GLU  21           HG2      GLU  21 -19.763  16.797  -4.234
  656    HG3  GLU  21           HG3      GLU  21 -21.457  17.040  -4.634
  657    HA   PRO  22           HA       PRO  22 -15.622  18.205  -6.749
  658    HB2  PRO  22           HB2      PRO  22 -17.455  20.232  -8.027
  659    HB3  PRO  22           HB3      PRO  22 -15.777  19.827  -8.420
  660    HG2  PRO  22           HG2      PRO  22 -17.780  18.973  -9.980
  661    HG3  PRO  22           HG3      PRO  22 -16.390  17.915  -9.641
  662    HD2  PRO  22           HD2      PRO  22 -19.159  17.862  -8.449
  663    HD3  PRO  22           HD3      PRO  22 -18.116  16.505  -8.925
  664    H    LEU  23           H        LEU  23 -15.646  18.411  -4.525
  665    HA   LEU  23           HA       LEU  23 -17.163  20.686  -3.358
  666    HB2  LEU  23           HB2      LEU  23 -16.029  18.216  -1.983
  667    HB3  LEU  23           HB3      LEU  23 -16.804  19.556  -1.150
  668    HG   LEU  23           HG       LEU  23 -18.163  17.674  -3.126
  669   HD11  LEU  23          HD11      LEU  23 -17.705  16.574  -0.989
  670   HD12  LEU  23          HD12      LEU  23 -19.434  16.840  -1.207
  671   HD13  LEU  23          HD13      LEU  23 -18.513  17.887  -0.123
  672   HD21  LEU  23          HD21      LEU  23 -19.387  19.963  -1.536
  673   HD22  LEU  23          HD22      LEU  23 -20.265  18.814  -2.547
  674   HD23  LEU  23          HD23      LEU  23 -19.128  19.935  -3.286
  675    H    SER  24           H        SER  24 -15.952  21.734  -1.488
  676    HA   SER  24           HA       SER  24 -13.764  23.155  -2.376
  677    HB2  SER  24           HB2      SER  24 -13.490  23.896   0.004
  678    HB3  SER  24           HB3      SER  24 -15.173  23.910  -0.524
  679    HG   SER  24           HG       SER  24 -15.394  22.819   1.287
  680    H    LEU  25           H        LEU  25 -13.688  20.255  -0.324
  681    HA   LEU  25           HA       LEU  25 -10.871  19.784  -1.078
  682    HB2  LEU  25           HB2      LEU  25 -11.204  20.868   1.275
  683    HB3  LEU  25           HB3      LEU  25 -11.836  19.316   1.771
  684    HG   LEU  25           HG       LEU  25  -9.017  19.740   0.689
  685   HD11  LEU  25          HD11      LEU  25  -9.903  19.552   3.583
  686   HD12  LEU  25          HD12      LEU  25  -9.282  20.987   2.765
  687   HD13  LEU  25          HD13      LEU  25  -8.229  19.598   3.017
  688   HD21  LEU  25          HD21      LEU  25  -9.744  17.412   0.423
  689   HD22  LEU  25          HD22      LEU  25 -10.197  17.332   2.125
  690   HD23  LEU  25          HD23      LEU  25  -8.503  17.527   1.669
  691    H    LEU  26           H        LEU  26 -11.121  17.980  -2.305
  692    HA   LEU  26           HA       LEU  26 -12.938  15.802  -1.490
  693    HB2  LEU  26           HB2      LEU  26 -12.488  16.850  -3.987
  694    HB3  LEU  26           HB3      LEU  26 -11.319  15.545  -4.017
  695    HG   LEU  26           HG       LEU  26 -14.324  15.256  -3.593
  696   HD11  LEU  26          HD11      LEU  26 -14.358  14.159  -5.781
  697   HD12  LEU  26          HD12      LEU  26 -12.627  14.449  -5.971
  698   HD13  LEU  26          HD13      LEU  26 -13.752  15.809  -5.905
  699   HD21  LEU  26          HD21      LEU  26 -12.248  13.042  -3.745
  700   HD22  LEU  26          HD22      LEU  26 -14.000  12.819  -3.705
  701   HD23  LEU  26          HD23      LEU  26 -13.173  13.512  -2.312
  702    H    ASP  27           H        ASP  27 -12.176  13.951  -0.602
  703    HA   ASP  27           HA       ASP  27  -9.333  13.789   0.118
  704    HB2  ASP  27           HB2      ASP  27 -10.073  12.217   1.859
  705    HB3  ASP  27           HB3      ASP  27 -11.007  13.702   1.924
  706    H    ASP  28           H        ASP  28  -9.256  13.252  -2.377
  707    HA   ASP  28           HA       ASP  28 -10.037  10.879  -3.562
  708    HB2  ASP  28           HB2      ASP  28  -7.375  12.234  -4.157
  709    HB3  ASP  28           HB3      ASP  28  -8.401  11.345  -5.279
  710    H    MET  29           H        MET  29  -7.134  11.465  -1.657
  711    HA   MET  29           HA       MET  29  -5.851   8.947  -2.086
  712    HB2  MET  29           HB2      MET  29  -5.414  10.875   0.239
  713    HB3  MET  29           HB3      MET  29  -4.298   9.641  -0.334
  714    HG2  MET  29           HG2      MET  29  -4.264  10.947  -2.549
  715    HG3  MET  29           HG3      MET  29  -5.036  12.248  -1.646
  716    HE1  MET  29           HE1      MET  29  -0.811  10.578  -0.820
  717    HE2  MET  29           HE2      MET  29  -1.899   9.996  -2.085
  718    HE3  MET  29           HE3      MET  29  -2.256   9.663  -0.387
  719    H    ASN  30           H        ASN  30  -8.041  10.188   0.413
  720    HA   ASN  30           HA       ASN  30  -7.561   8.235   2.415
  721    HB2  ASN  30           HB2      ASN  30  -8.544  10.498   2.836
  722    HB3  ASN  30           HB3      ASN  30 -10.023   9.986   2.029
  723   HD21  ASN  30          HD21      ASN  30 -11.339  10.248   3.802
  724   HD22  ASN  30          HD22      ASN  30 -11.239   9.266   5.221
  725    H    HIS  31           H        HIS  31  -9.972   8.418  -0.196
  726    HA   HIS  31           HA       HIS  31 -11.561   6.171   0.342
  727    HB2  HIS  31           HB2      HIS  31 -10.666   7.341  -2.330
  728    HB3  HIS  31           HB3      HIS  31 -11.856   6.049  -2.205
  729    HD2  HIS  31           HD2      HIS  31 -11.741   9.500  -0.245
  730    HE1  HIS  31           HE1      HIS  31 -15.439   9.064  -2.230
  731    HE2  HIS  31           HE2      HIS  31 -14.046  10.560  -0.740
  732    H    CYS  32           H        CYS  32  -8.431   6.373  -1.326
  733    HA   CYS  32           HA       CYS  32  -8.209   3.590  -1.977
  734    HB2  CYS  32           HB2      CYS  32  -6.032   5.712  -1.811
  735    HB3  CYS  32           HB3      CYS  32  -5.909   4.157  -2.637
  736    HG   CYS  32           HG       CYS  32  -7.595   6.947  -3.587
  737    H    TYR  33           H        TYR  33  -6.934   5.618   0.672
  738    HA   TYR  33           HA       TYR  33  -5.362   3.751   2.053
  739    HB2  TYR  33           HB2      TYR  33  -6.881   6.212   2.961
  740    HB3  TYR  33           HB3      TYR  33  -6.024   5.222   4.137
  741    HD1  TYR  33           HD1      TYR  33  -3.493   4.574   3.155
  742    HD2  TYR  33           HD2      TYR  33  -5.655   8.172   2.379
  743    HE1  TYR  33           HE1      TYR  33  -1.386   5.764   2.819
  744    HE2  TYR  33           HE2      TYR  33  -3.543   9.366   2.022
  745    HH   TYR  33           HH       TYR  33  -0.543   7.794   1.706
  746    H    SER  34           H        SER  34  -8.848   4.317   2.188
  747    HA   SER  34           HA       SER  34  -9.589   2.765   4.376
  748    HB2  SER  34           HB2      SER  34 -11.127   3.197   1.775
  749    HB3  SER  34           HB3      SER  34 -11.830   2.592   3.279
  750    HG   SER  34           HG       SER  34 -12.204   4.765   3.234
  751    H    ARG  35           H        ARG  35  -9.235   1.731   0.953
  752    HA   ARG  35           HA       ARG  35  -9.942  -1.011   1.520
  753    HB2  ARG  35           HB2      ARG  35  -8.908   0.334  -0.998
  754    HB3  ARG  35           HB3      ARG  35  -9.091  -1.414  -0.902
  755    HG2  ARG  35           HG2      ARG  35 -11.076  -0.638  -1.928
  756    HG3  ARG  35           HG3      ARG  35 -11.523  -1.015  -0.261
  757    HD2  ARG  35           HD2      ARG  35 -11.194   1.467   0.246
  758    HD3  ARG  35           HD3      ARG  35 -11.081   1.714  -1.500
  759    HE   ARG  35           HE       ARG  35 -13.454   0.294  -0.809
  760   HH11  ARG  35          HH11      ARG  35 -12.134   3.506  -0.823
  761   HH12  ARG  35          HH12      ARG  35 -13.692   4.248  -0.843
  762   HH21  ARG  35          HH21      ARG  35 -15.424   1.287  -0.793
  763   HH22  ARG  35          HH22      ARG  35 -15.526   3.013  -0.830
  764    H    LEU  36           H        LEU  36  -6.868   0.728   1.345
  765    HA   LEU  36           HA       LEU  36  -5.118  -1.478   1.407
  766    HB2  LEU  36           HB2      LEU  36  -4.843   1.189   2.841
  767    HB3  LEU  36           HB3      LEU  36  -3.548   0.013   2.688
  768    HG   LEU  36           HG       LEU  36  -4.857   1.540   0.403
  769   HD11  LEU  36          HD11      LEU  36  -2.678   2.640   0.161
  770   HD12  LEU  36          HD12      LEU  36  -2.072   1.777   1.578
  771   HD13  LEU  36          HD13      LEU  36  -3.386   2.946   1.746
  772   HD21  LEU  36          HD21      LEU  36  -4.222  -0.706  -0.372
  773   HD22  LEU  36          HD22      LEU  36  -2.591  -0.489   0.267
  774   HD23  LEU  36          HD23      LEU  36  -3.159   0.513  -1.069
  775    H    ARG  37           H        ARG  37  -6.726   0.227   4.121
  776    HA   ARG  37           HA       ARG  37  -5.811  -1.333   6.262
  777    HB2  ARG  37           HB2      ARG  37  -8.514   0.041   5.999
  778    HB3  ARG  37           HB3      ARG  37  -7.798  -0.521   7.507
  779    HG2  ARG  37           HG2      ARG  37  -5.954   1.123   7.234
  780    HG3  ARG  37           HG3      ARG  37  -6.705   1.692   5.738
  781    HD2  ARG  37           HD2      ARG  37  -8.793   2.175   7.109
  782    HD3  ARG  37           HD3      ARG  37  -7.825   1.854   8.544
  783    HE   ARG  37           HE       ARG  37  -6.442   3.767   7.952
  784   HH11  ARG  37          HH11      ARG  37  -9.469   3.582   6.271
  785   HH12  ARG  37          HH12      ARG  37  -9.593   5.295   6.092
  786   HH21  ARG  37          HH21      ARG  37  -6.645   5.967   7.725
  787   HH22  ARG  37          HH22      ARG  37  -8.022   6.623   6.907
  788    H    GLU  38           H        GLU  38  -8.284  -2.069   3.890
  789    HA   GLU  38           HA       GLU  38  -9.637  -4.119   5.467
  790    HB2  GLU  38           HB2      GLU  38  -9.968  -3.402   2.515
  791    HB3  GLU  38           HB3      GLU  38 -11.041  -4.441   3.446
  792    HG2  GLU  38           HG2      GLU  38 -10.605  -1.475   3.868
  793    HG3  GLU  38           HG3      GLU  38 -12.015  -2.222   3.126
  794    H    LEU  39           H        LEU  39  -7.444  -3.922   2.705
  795    HA   LEU  39           HA       LEU  39  -7.335  -6.762   2.204
  796    HB2  LEU  39           HB2      LEU  39  -5.675  -4.468   1.107
  797    HB3  LEU  39           HB3      LEU  39  -5.596  -6.123   0.533
  798    HG   LEU  39           HG       LEU  39  -7.993  -4.264   0.301
  799   HD11  LEU  39          HD11      LEU  39  -6.205  -3.695  -1.264
  800   HD12  LEU  39          HD12      LEU  39  -7.582  -4.377  -2.124
  801   HD13  LEU  39          HD13      LEU  39  -6.149  -5.365  -1.841
  802   HD21  LEU  39          HD21      LEU  39  -8.778  -6.568   0.662
  803   HD22  LEU  39          HD22      LEU  39  -7.746  -7.145  -0.650
  804   HD23  LEU  39          HD23      LEU  39  -9.090  -6.054  -0.994
  805    H    VAL  40           H        VAL  40  -5.654  -4.594   4.279
  806    HA   VAL  40           HA       VAL  40  -3.506  -6.551   4.839
  807    HB   VAL  40           HB       VAL  40  -3.771  -3.698   5.919
  808   HG11  VAL  40          HG11      VAL  40  -2.390  -5.115   7.368
  809   HG12  VAL  40          HG12      VAL  40  -1.374  -3.935   6.539
  810   HG13  VAL  40          HG13      VAL  40  -1.404  -5.615   5.994
  811   HG21  VAL  40          HG21      VAL  40  -2.110  -4.685   3.564
  812   HG22  VAL  40          HG22      VAL  40  -2.023  -3.066   4.273
  813   HG23  VAL  40          HG23      VAL  40  -3.517  -3.610   3.499
  814    HA   PRO  41           HA       PRO  41  -6.146  -7.466   8.567
  815    HB2  PRO  41           HB2      PRO  41  -5.544 -10.109   8.756
  816    HB3  PRO  41           HB3      PRO  41  -6.749  -9.514   7.604
  817    HG2  PRO  41           HG2      PRO  41  -3.853 -10.210   7.117
  818    HG3  PRO  41           HG3      PRO  41  -5.285 -10.672   6.171
  819    HD2  PRO  41           HD2      PRO  41  -3.663  -8.584   5.470
  820    HD3  PRO  41           HD3      PRO  41  -5.397  -8.607   5.099
  821    H    GLY  42           H        GLY  42  -2.835  -7.352   7.830
  822    HA2  GLY  42           HA2      GLY  42  -1.691  -8.098  10.358
  823    HA3  GLY  42           HA3      GLY  42  -0.900  -7.205   9.069
  824    H    VAL  43           H        VAL  43  -3.542  -5.373   9.476
  825    HA   VAL  43           HA       VAL  43  -2.371  -3.500  11.346
  826    HB   VAL  43           HB       VAL  43  -5.214  -3.401  10.213
  827   HG11  VAL  43          HG11      VAL  43  -4.829  -1.928  12.161
  828   HG12  VAL  43          HG12      VAL  43  -5.096  -0.983  10.694
  829   HG13  VAL  43          HG13      VAL  43  -3.461  -1.175  11.337
  830   HG21  VAL  43          HG21      VAL  43  -3.619  -3.505   8.335
  831   HG22  VAL  43          HG22      VAL  43  -2.719  -2.143   9.001
  832   HG23  VAL  43          HG23      VAL  43  -4.374  -1.913   8.431
  833    HA   PRO  44           HA       PRO  44  -4.700  -5.346  14.863
  834    HB2  PRO  44           HB2      PRO  44  -3.644  -3.665  16.815
  835    HB3  PRO  44           HB3      PRO  44  -2.926  -5.196  16.307
  836    HG2  PRO  44           HG2      PRO  44  -2.088  -2.423  15.669
  837    HG3  PRO  44           HG3      PRO  44  -1.119  -3.903  15.713
  838    HD2  PRO  44           HD2      PRO  44  -2.062  -2.593  13.396
  839    HD3  PRO  44           HD3      PRO  44  -1.394  -4.233  13.461
  840    H    ARG  45           H        ARG  45  -6.812  -4.774  14.808
  841    HA   ARG  45           HA       ARG  45  -7.713  -2.252  13.856
  842    HB2  ARG  45           HB2      ARG  45  -8.783  -4.788  13.905
  843    HB3  ARG  45           HB3      ARG  45  -9.719  -4.056  15.193
  844    HG2  ARG  45           HG2      ARG  45  -9.566  -3.061  12.323
  845    HG3  ARG  45           HG3      ARG  45 -10.893  -3.983  13.023
  846    HD2  ARG  45           HD2      ARG  45 -11.408  -2.132  14.548
  847    HD3  ARG  45           HD3      ARG  45 -10.030  -1.212  13.929
  848    HE   ARG  45           HE       ARG  45 -11.787  -1.933  11.820
  849   HH11  ARG  45          HH11      ARG  45 -11.621   0.298  14.467
  850   HH12  ARG  45          HH12      ARG  45 -12.597   1.470  13.661
  851   HH21  ARG  45          HH21      ARG  45 -13.036  -0.421  10.831
  852   HH22  ARG  45          HH22      ARG  45 -13.380   1.071  11.634
  853    H    GLY  46           H        GLY  46  -7.121  -0.580  15.206
  854    HA2  GLY  46           HA2      GLY  46  -8.230   0.851  16.960
  855    HA3  GLY  46           HA3      GLY  46  -8.078  -0.533  18.032
  856    H    THR  47           H        THR  47  -5.481   0.105  15.812
  857    HA   THR  47           HA       THR  47  -3.611   0.652  17.994
  858    HB   THR  47           HB       THR  47  -2.969  -0.993  16.293
  859    HG1  THR  47           HG1      THR  47  -0.899  -0.250  16.020
  860   HG21  THR  47          HG21      THR  47  -2.430  -0.334  13.983
  861   HG22  THR  47          HG22      THR  47  -3.052   1.287  14.294
  862   HG23  THR  47          HG23      THR  47  -4.145  -0.100  14.328
  863    H    GLN  48           H        GLN  48  -5.339   2.501  15.664
  864    HA   GLN  48           HA       GLN  48  -5.424   4.664  15.043
  865    HB2  GLN  48           HB2      GLN  48  -3.755   5.176  17.542
  866    HB3  GLN  48           HB3      GLN  48  -4.595   6.422  16.624
  867    HG2  GLN  48           HG2      GLN  48  -6.760   5.394  17.180
  868    HG3  GLN  48           HG3      GLN  48  -5.935   4.111  18.066
  869   HE21  GLN  48          HE21      GLN  48  -4.984   4.617  20.091
  870   HE22  GLN  48          HE22      GLN  48  -5.374   6.059  20.957
  871    H    LEU  49           H        LEU  49  -4.167   4.073  13.139
  872    HA   LEU  49           HA       LEU  49  -1.390   5.113  13.026
  873    HB2  LEU  49           HB2      LEU  49  -2.940   3.518  10.939
  874    HB3  LEU  49           HB3      LEU  49  -1.257   4.001  10.811
  875    HG   LEU  49           HG       LEU  49  -2.428   1.970  12.738
  876   HD11  LEU  49          HD11      LEU  49  -2.166   1.124  10.454
  877   HD12  LEU  49          HD12      LEU  49  -1.042   0.334  11.556
  878   HD13  LEU  49          HD13      LEU  49  -0.462   1.591  10.461
  879   HD21  LEU  49          HD21      LEU  49  -0.673   3.195  13.931
  880   HD22  LEU  49          HD22      LEU  49   0.455   2.918  12.602
  881   HD23  LEU  49          HD23      LEU  49  -0.136   1.559  13.557
  882    H    SER  50           H        SER  50  -0.853   6.896  11.792
  883    HA   SER  50           HA       SER  50  -2.920   8.442  10.407
  884    HB2  SER  50           HB2      SER  50  -1.161   9.649  11.679
  885    HB3  SER  50           HB3      SER  50   0.082   8.948  10.646
  886    HG   SER  50           HG       SER  50  -0.477  11.073  10.005
  887    H    GLN  51           H        GLN  51  -2.157   9.343   8.152
  888    HA   GLN  51           HA       GLN  51  -2.426   7.466   6.156
  889    HB2  GLN  51           HB2      GLN  51  -0.970  10.138   5.983
  890    HB3  GLN  51           HB3      GLN  51  -1.587   9.235   4.601
  891    HG2  GLN  51           HG2      GLN  51  -3.886   9.553   5.377
  892    HG3  GLN  51           HG3      GLN  51  -3.308  10.370   6.828
  893   HE21  GLN  51          HE21      GLN  51  -3.724  10.669   3.358
  894   HE22  GLN  51          HE22      GLN  51  -3.513  12.379   3.288
  895    H    VAL  52           H        VAL  52   0.613   8.636   7.561
  896    HA   VAL  52           HA       VAL  52   2.388   7.405   5.672
  897    HB   VAL  52           HB       VAL  52   3.044   8.333   8.512
  898   HG11  VAL  52          HG11      VAL  52   4.818   8.004   6.063
  899   HG12  VAL  52          HG12      VAL  52   4.827   6.978   7.502
  900   HG13  VAL  52          HG13      VAL  52   5.337   8.663   7.619
  901   HG21  VAL  52          HG21      VAL  52   3.093   9.955   5.937
  902   HG22  VAL  52          HG22      VAL  52   3.617  10.520   7.528
  903   HG23  VAL  52          HG23      VAL  52   1.917  10.131   7.247
  904    H    GLU  53           H        GLU  53   1.366   6.514   9.004
  905    HA   GLU  53           HA       GLU  53   2.939   4.143   9.196
  906    HB2  GLU  53           HB2      GLU  53   0.465   4.907  10.793
  907    HB3  GLU  53           HB3      GLU  53   1.525   3.553  11.164
  908    HG2  GLU  53           HG2      GLU  53   2.299   5.136  12.648
  909    HG3  GLU  53           HG3      GLU  53   3.402   5.383  11.298
  910    H    ILE  54           H        ILE  54  -0.286   4.727   7.899
  911    HA   ILE  54           HA       ILE  54  -1.178   2.100   7.483
  912    HB   ILE  54           HB       ILE  54  -1.505   4.582   5.731
  913   HG12  ILE  54          HG12      ILE  54  -3.486   3.209   7.621
  914   HG13  ILE  54          HG13      ILE  54  -2.590   4.681   7.980
  915   HG21  ILE  54          HG21      ILE  54  -2.928   1.910   5.368
  916   HG22  ILE  54          HG22      ILE  54  -1.767   2.641   4.258
  917   HG23  ILE  54          HG23      ILE  54  -3.330   3.407   4.516
  918   HD11  ILE  54          HD11      ILE  54  -4.665   4.358   5.815
  919   HD12  ILE  54          HD12      ILE  54  -3.767   5.836   6.173
  920   HD13  ILE  54          HD13      ILE  54  -4.878   5.165   7.367
  921    H    LEU  55           H        LEU  55   0.893   4.138   5.396
  922    HA   LEU  55           HA       LEU  55   1.431   2.276   3.355
  923    HB2  LEU  55           HB2      LEU  55   3.215   4.536   4.326
  924    HB3  LEU  55           HB3      LEU  55   3.327   3.739   2.761
  925    HG   LEU  55           HG       LEU  55   0.987   5.429   3.715
  926   HD11  LEU  55          HD11      LEU  55   1.717   7.072   2.061
  927   HD12  LEU  55          HD12      LEU  55   3.109   6.067   1.652
  928   HD13  LEU  55          HD13      LEU  55   2.975   6.779   3.261
  929   HD21  LEU  55          HD21      LEU  55   0.131   5.216   1.419
  930   HD22  LEU  55          HD22      LEU  55   0.223   3.651   2.219
  931   HD23  LEU  55          HD23      LEU  55   1.442   4.101   1.023
  932    H    GLN  56           H        GLN  56   3.234   3.000   6.330
  933    HA   GLN  56           HA       GLN  56   5.426   1.267   6.000
  934    HB2  GLN  56           HB2      GLN  56   4.039   2.142   8.572
  935    HB3  GLN  56           HB3      GLN  56   5.627   1.380   8.496
  936    HG2  GLN  56           HG2      GLN  56   6.497   3.302   7.219
  937    HG3  GLN  56           HG3      GLN  56   4.901   4.056   7.267
  938   HE21  GLN  56          HE21      GLN  56   5.689   5.873   8.354
  939   HE22  GLN  56          HE22      GLN  56   6.172   5.835  10.006
  940    H    ARG  57           H        ARG  57   2.233   0.710   7.498
  941    HA   ARG  57           HA       ARG  57   2.662  -1.970   8.350
  942    HB2  ARG  57           HB2      ARG  57   0.860  -0.371   9.189
  943    HB3  ARG  57           HB3      ARG  57  -0.009  -0.664   7.691
  944    HG2  ARG  57           HG2      ARG  57  -1.074  -2.132   9.143
  945    HG3  ARG  57           HG3      ARG  57   0.111  -3.190   8.387
  946    HD2  ARG  57           HD2      ARG  57   0.407  -1.873  11.107
  947    HD3  ARG  57           HD3      ARG  57  -0.082  -3.543  10.832
  948    HE   ARG  57           HE       ARG  57   2.560  -2.584   9.924
  949   HH11  ARG  57          HH11      ARG  57   0.713  -4.817  11.819
  950   HH12  ARG  57          HH12      ARG  57   2.122  -5.644  12.376
  951   HH21  ARG  57          HH21      ARG  57   4.318  -3.670  10.654
  952   HH22  ARG  57          HH22      ARG  57   4.128  -5.010  11.730
  953    H    VAL  58           H        VAL  58   1.390  -0.571   5.351
  954    HA   VAL  58           HA       VAL  58   0.622  -2.964   4.041
  955    HB   VAL  58           HB       VAL  58   1.470  -0.263   2.884
  956   HG11  VAL  58          HG11      VAL  58   0.257  -2.623   1.392
  957   HG12  VAL  58          HG12      VAL  58   1.880  -1.973   1.174
  958   HG13  VAL  58          HG13      VAL  58   0.480  -1.002   0.724
  959   HG21  VAL  58          HG21      VAL  58  -0.629  -0.206   4.188
  960   HG22  VAL  58          HG22      VAL  58  -1.297  -1.509   3.204
  961   HG23  VAL  58          HG23      VAL  58  -0.955   0.063   2.474
  962    H    ILE  59           H        ILE  59   3.740  -1.178   4.105
  963    HA   ILE  59           HA       ILE  59   5.209  -2.855   2.366
  964    HB   ILE  59           HB       ILE  59   6.197  -1.189   4.733
  965   HG12  ILE  59          HG12      ILE  59   6.223  -0.573   1.730
  966   HG13  ILE  59          HG13      ILE  59   5.116   0.128   2.902
  967   HG21  ILE  59          HG21      ILE  59   7.875  -2.918   4.230
  968   HG22  ILE  59          HG22      ILE  59   8.472  -1.334   3.741
  969   HG23  ILE  59          HG23      ILE  59   7.870  -2.461   2.524
  970   HD11  ILE  59          HD11      ILE  59   6.872   1.677   2.320
  971   HD12  ILE  59          HD12      ILE  59   8.102   0.523   2.829
  972   HD13  ILE  59          HD13      ILE  59   7.001   1.223   4.019
  973    H    ASP  60           H        ASP  60   4.846  -3.001   5.948
  974    HA   ASP  60           HA       ASP  60   6.366  -5.290   6.503
  975    HB2  ASP  60           HB2      ASP  60   3.812  -4.427   7.936
  976    HB3  ASP  60           HB3      ASP  60   5.060  -5.483   8.596
  977    H    TYR  61           H        TYR  61   2.963  -5.001   5.612
  978    HA   TYR  61           HA       TYR  61   2.110  -7.671   5.768
  979    HB2  TYR  61           HB2      TYR  61   0.485  -5.888   5.578
  980    HB3  TYR  61           HB3      TYR  61   1.189  -5.315   4.073
  981    HD1  TYR  61           HD1      TYR  61  -0.733  -8.151   5.575
  982    HD2  TYR  61           HD2      TYR  61   0.405  -6.166   1.954
  983    HE1  TYR  61           HE1      TYR  61  -2.319  -9.529   4.315
  984    HE2  TYR  61           HE2      TYR  61  -1.196  -7.544   0.707
  985    HH   TYR  61           HH       TYR  61  -3.631  -9.228   2.093
  986    H    ILE  62           H        ILE  62   3.331  -5.834   2.955
  987    HA   ILE  62           HA       ILE  62   3.157  -7.893   1.034
  988    HB   ILE  62           HB       ILE  62   4.936  -5.403   1.092
  989   HG12  ILE  62          HG12      ILE  62   2.311  -5.909  -0.414
  990   HG13  ILE  62          HG13      ILE  62   2.455  -4.963   1.061
  991   HG21  ILE  62          HG21      ILE  62   4.387  -7.248  -1.265
  992   HG22  ILE  62          HG22      ILE  62   5.931  -7.051  -0.436
  993   HG23  ILE  62          HG23      ILE  62   5.250  -5.710  -1.351
  994   HD11  ILE  62          HD11      ILE  62   2.268  -3.535  -0.881
  995   HD12  ILE  62          HD12      ILE  62   3.688  -4.284  -1.609
  996   HD13  ILE  62          HD13      ILE  62   3.851  -3.333  -0.130
  997    H    LEU  63           H        LEU  63   5.918  -6.789   3.024
  998    HA   LEU  63           HA       LEU  63   7.872  -8.605   2.115
  999    HB2  LEU  63           HB2      LEU  63   7.612  -7.234   4.817
 1000    HB3  LEU  63           HB3      LEU  63   9.058  -8.065   4.258
 1001    HG   LEU  63           HG       LEU  63   7.852  -5.561   3.022
 1002   HD11  LEU  63          HD11      LEU  63  10.423  -5.914   4.591
 1003   HD12  LEU  63          HD12      LEU  63   8.960  -5.104   5.153
 1004   HD13  LEU  63          HD13      LEU  63   9.880  -4.424   3.814
 1005   HD21  LEU  63          HD21      LEU  63   9.828  -5.536   1.541
 1006   HD22  LEU  63          HD22      LEU  63   8.824  -6.956   1.266
 1007   HD23  LEU  63          HD23      LEU  63  10.328  -7.106   2.179
 1008    H    ASP  64           H        ASP  64   5.404  -8.939   4.608
 1009    HA   ASP  64           HA       ASP  64   6.189 -11.355   5.824
 1010    HB2  ASP  64           HB2      ASP  64   4.393  -9.802   6.647
 1011    HB3  ASP  64           HB3      ASP  64   3.355 -10.316   5.322
 1012    H    LEU  65           H        LEU  65   4.319 -10.721   2.881
 1013    HA   LEU  65           HA       LEU  65   3.732 -13.507   2.299
 1014    HB2  LEU  65           HB2      LEU  65   3.440 -11.097   0.474
 1015    HB3  LEU  65           HB3      LEU  65   2.627 -12.649   0.318
 1016    HG   LEU  65           HG       LEU  65   2.141 -10.569   2.483
 1017   HD11  LEU  65          HD11      LEU  65   1.198  -9.919   0.335
 1018   HD12  LEU  65          HD12      LEU  65  -0.078 -10.323   1.481
 1019   HD13  LEU  65          HD13      LEU  65   0.355 -11.468   0.211
 1020   HD21  LEU  65          HD21      LEU  65   0.785 -13.264   2.145
 1021   HD22  LEU  65          HD22      LEU  65   0.326 -12.010   3.298
 1022   HD23  LEU  65          HD23      LEU  65   1.890 -12.805   3.447
 1023    H    GLN  66           H        GLN  66   6.052 -11.085   1.226
 1024    HA   GLN  66           HA       GLN  66   7.058 -12.435  -1.083
 1025    HB2  GLN  66           HB2      GLN  66   8.208 -10.138   0.553
 1026    HB3  GLN  66           HB3      GLN  66   8.952 -10.728  -0.925
 1027    HG2  GLN  66           HG2      GLN  66   6.125  -9.627  -0.807
 1028    HG3  GLN  66           HG3      GLN  66   7.544  -8.643  -1.153
 1029   HE21  GLN  66          HE21      GLN  66   6.764  -8.079  -3.211
 1030   HE22  GLN  66          HE22      GLN  66   6.729  -9.190  -4.530
 1031    H    VAL  67           H        VAL  67   8.069 -12.328   2.306
 1032    HA   VAL  67           HA       VAL  67   9.641 -13.341   3.561
 1033    HB   VAL  67           HB       VAL  67   9.465 -15.583   1.494
 1034   HG11  VAL  67          HG11      VAL  67  11.406 -15.877   2.967
 1035   HG12  VAL  67          HG12      VAL  67  10.182 -17.095   3.323
 1036   HG13  VAL  67          HG13      VAL  67  10.381 -15.704   4.394
 1037   HG21  VAL  67          HG21      VAL  67   7.225 -15.015   2.362
 1038   HG22  VAL  67          HG22      VAL  67   7.800 -15.192   4.021
 1039   HG23  VAL  67          HG23      VAL  67   7.732 -16.597   2.956
 1040    H    VAL  68           H        VAL  68  11.330 -11.898   3.323
 1041    HA   VAL  68           HA       VAL  68  13.159 -12.059   1.020
 1042    HB   VAL  68           HB       VAL  68  13.029  -9.954   3.234
 1043   HG11  VAL  68          HG11      VAL  68  14.370  -8.538   1.699
 1044   HG12  VAL  68          HG12      VAL  68  14.504  -9.891   0.573
 1045   HG13  VAL  68          HG13      VAL  68  15.232 -10.002   2.176
 1046   HG21  VAL  68          HG21      VAL  68  11.839  -8.518   1.597
 1047   HG22  VAL  68          HG22      VAL  68  10.926  -9.986   1.942
 1048   HG23  VAL  68          HG23      VAL  68  11.825  -9.845   0.432
  Start of MODEL    6
    1    H1   MET   1           H1       MET   1 -35.763 -23.897  -5.915
    2    H2   MET   1           H2       MET   1 -34.412 -23.988  -4.908
    3    H3   MET   1           H3       MET   1 -34.210 -23.790  -6.574
    4    HA   MET   1           HA       MET   1 -35.204 -21.634  -6.512
    5    HB2  MET   1           HB2      MET   1 -36.760 -22.144  -4.599
    6    HB3  MET   1           HB3      MET   1 -35.397 -22.045  -3.493
    7    HG2  MET   1           HG2      MET   1 -35.088 -19.664  -4.103
    8    HG3  MET   1           HG3      MET   1 -36.477 -19.774  -5.186
    9    HE1  MET   1           HE1      MET   1 -35.945 -21.302  -1.526
   10    HE2  MET   1           HE2      MET   1 -36.733 -20.056  -0.563
   11    HE3  MET   1           HE3      MET   1 -35.250 -19.682  -1.439
   12    H    GLY   2           H        GLY   2 -33.562 -20.217  -6.831
   13    HA2  GLY   2           HA2      GLY   2 -31.017 -20.527  -5.323
   14    HA3  GLY   2           HA3      GLY   2 -31.150 -19.971  -6.985
   15    H    HIS   3           H        HIS   3 -30.013 -18.739  -4.432
   16    HA   HIS   3           HA       HIS   3 -31.533 -16.191  -4.339
   17    HB2  HIS   3           HB2      HIS   3 -30.998 -17.363  -2.168
   18    HB3  HIS   3           HB3      HIS   3 -29.285 -17.152  -2.508
   19    HD2  HIS   3           HD2      HIS   3 -28.293 -14.551  -2.090
   20    HE1  HIS   3           HE1      HIS   3 -31.905 -13.056  -0.482
   21    HE2  HIS   3           HE2      HIS   3 -29.509 -12.512  -1.063
   22    H    HIS   4           H        HIS   4 -30.840 -14.779  -5.843
   23    HA   HIS   4           HA       HIS   4 -28.084 -13.921  -5.983
   24    HB2  HIS   4           HB2      HIS   4 -27.746 -14.372  -8.395
   25    HB3  HIS   4           HB3      HIS   4 -27.985 -15.871  -7.508
   26    HD2  HIS   4           HD2      HIS   4 -30.729 -16.933  -7.818
   27    HE1  HIS   4           HE1      HIS   4 -31.128 -15.073 -11.593
   28    HE2  HIS   4           HE2      HIS   4 -31.949 -16.938 -10.101
   29    H    HIS   5           H        HIS   5 -27.821 -11.919  -7.005
   30    HA   HIS   5           HA       HIS   5 -30.032 -10.693  -8.478
   31    HB2  HIS   5           HB2      HIS   5 -30.391  -9.971  -6.095
   32    HB3  HIS   5           HB3      HIS   5 -28.775  -9.272  -6.074
   33    HD2  HIS   5           HD2      HIS   5 -28.583  -6.727  -7.116
   34    HE1  HIS   5           HE1      HIS   5 -32.539  -6.517  -8.597
   35    HE2  HIS   5           HE2      HIS   5 -30.305  -5.344  -8.466
   36    H    HIS   6           H        HIS   6 -29.283  -9.535 -10.178
   37    HA   HIS   6           HA       HIS   6 -26.480  -9.447 -10.797
   38    HB2  HIS   6           HB2      HIS   6 -28.832  -8.148 -12.256
   39    HB3  HIS   6           HB3      HIS   6 -27.217  -8.405 -12.918
   40    HD2  HIS   6           HD2      HIS   6 -26.687 -10.983 -13.831
   41    HE1  HIS   6           HE1      HIS   6 -30.528 -12.529 -12.954
   42    HE2  HIS   6           HE2      HIS   6 -28.355 -12.929 -14.180
   43    H    HIS   7           H        HIS   7 -25.078  -7.900 -10.248
   44    HA   HIS   7           HA       HIS   7 -25.818  -5.571  -8.782
   45    HB2  HIS   7           HB2      HIS   7 -23.694  -6.802  -8.361
   46    HB3  HIS   7           HB3      HIS   7 -23.107  -6.336  -9.953
   47    HD2  HIS   7           HD2      HIS   7 -21.753  -3.974 -10.007
   48    HE1  HIS   7           HE1      HIS   7 -22.943  -2.593  -6.196
   49    HE2  HIS   7           HE2      HIS   7 -21.692  -2.025  -8.309
   50    H    HIS   8           H        HIS   8 -27.144  -4.317 -10.101
   51    HA   HIS   8           HA       HIS   8 -26.368  -3.368 -12.718
   52    HB2  HIS   8           HB2      HIS   8 -28.631  -2.412 -10.908
   53    HB3  HIS   8           HB3      HIS   8 -28.470  -2.080 -12.632
   54    HD2  HIS   8           HD2      HIS   8 -28.272  -4.827 -14.055
   55    HE1  HIS   8           HE1      HIS   8 -31.348  -6.186 -11.487
   56    HE2  HIS   8           HE2      HIS   8 -30.228  -6.490 -13.732
   57    H    SER   9           H        SER   9 -24.306  -2.425 -12.221
   58    HA   SER   9           HA       SER   9 -24.103  -0.142 -10.426
   59    HB2  SER   9           HB2      SER   9 -21.686  -0.153 -11.098
   60    HB3  SER   9           HB3      SER   9 -22.241  -1.702 -10.481
   61    HG   SER   9           HG       SER   9 -20.915  -1.689 -12.486
   62    H    HIS  10           H        HIS  10 -25.139   1.636 -11.189
   63    HA   HIS  10           HA       HIS  10 -24.366   2.767 -13.834
   64    HB2  HIS  10           HB2      HIS  10 -27.008   3.119 -12.338
   65    HB3  HIS  10           HB3      HIS  10 -26.582   3.913 -13.851
   66    HD1  HIS  10           HD1      HIS  10 -26.804   2.539 -16.002
   67    HD2  HIS  10           HD2      HIS  10 -27.685   0.356 -12.580
   68    HE1  HIS  10           HE1      HIS  10 -27.873   0.425 -16.811
   69    HE2  HIS  10           HE2      HIS  10 -28.220  -0.944 -14.738
   70    H    MET  11           H        MET  11 -22.766   4.198 -13.275
   71    HA   MET  11           HA       MET  11 -22.920   5.862 -10.875
   72    HB2  MET  11           HB2      MET  11 -20.784   5.744 -13.048
   73    HB3  MET  11           HB3      MET  11 -20.656   6.642 -11.539
   74    HG2  MET  11           HG2      MET  11 -19.366   4.646 -11.323
   75    HG3  MET  11           HG3      MET  11 -20.798   4.456 -10.312
   76    HE1  MET  11           HE1      MET  11 -18.740   2.113 -11.413
   77    HE2  MET  11           HE2      MET  11 -19.905   0.826 -11.718
   78    HE3  MET  11           HE3      MET  11 -20.039   1.803 -10.257
   79    H    GLY  12           H        GLY  12 -23.652   7.928 -10.857
   80    HA2  GLY  12           HA2      GLY  12 -24.020   9.426 -13.415
   81    HA3  GLY  12           HA3      GLY  12 -25.034   9.597 -11.990
   82    H    GLY  13           H        GLY  13 -24.705  11.796 -11.633
   83    HA2  GLY  13           HA2      GLY  13 -23.707  13.536 -10.471
   84    HA3  GLY  13           HA3      GLY  13 -22.292  12.525 -10.208
   85    H    GLY  14           H        GLY  14 -20.858  12.211 -12.158
   86    HA2  GLY  14           HA2      GLY  14 -19.580  12.990 -13.915
   87    HA3  GLY  14           HA3      GLY  14 -20.879  14.091 -14.332
   88    H    LYS  15           H        LYS  15 -18.511  13.682 -11.670
   89    HA   LYS  15           HA       LYS  15 -17.299  16.263 -11.955
   90    HB2  LYS  15           HB2      LYS  15 -18.156  17.274  -9.841
   91    HB3  LYS  15           HB3      LYS  15 -19.432  17.039 -11.032
   92    HG2  LYS  15           HG2      LYS  15 -19.966  14.835  -9.777
   93    HG3  LYS  15           HG3      LYS  15 -18.936  15.466  -8.490
   94    HD2  LYS  15           HD2      LYS  15 -21.237  16.012  -7.961
   95    HD3  LYS  15           HD3      LYS  15 -20.395  17.504  -8.377
   96    HE2  LYS  15           HE2      LYS  15 -21.382  17.405 -10.656
   97    HE3  LYS  15           HE3      LYS  15 -22.240  15.927 -10.209
   98    HZ1  LYS  15           HZ1      LYS  15 -23.692  17.799 -10.013
   99    HZ2  LYS  15           HZ2      LYS  15 -22.605  18.614  -9.010
  100    HZ3  LYS  15           HZ3      LYS  15 -23.368  17.207  -8.466
  101    H    GLY  16           H        GLY  16 -15.721  16.718 -10.156
  102    HA2  GLY  16           HA2      GLY  16 -15.131  14.929  -8.055
  103    HA3  GLY  16           HA3      GLY  16 -14.170  14.448  -9.447
  104    HA   PRO  17           HA       PRO  17 -12.504  18.819  -8.170
  105    HB2  PRO  17           HB2      PRO  17 -13.389  20.049  -5.941
  106    HB3  PRO  17           HB3      PRO  17 -14.341  20.065  -7.432
  107    HG2  PRO  17           HG2      PRO  17 -14.661  18.301  -5.006
  108    HG3  PRO  17           HG3      PRO  17 -15.909  19.180  -5.916
  109    HD2  PRO  17           HD2      PRO  17 -15.349  16.501  -6.290
  110    HD3  PRO  17           HD3      PRO  17 -16.039  17.541  -7.555
  111    H    ALA  18           H        ALA  18 -11.511  16.263  -7.352
  112    HA   ALA  18           HA       ALA  18  -9.538  17.074  -5.365
  113    HB1  ALA  18           HB1      ALA  18  -9.794  15.024  -4.016
  114    HB2  ALA  18           HB2      ALA  18 -11.166  14.526  -5.011
  115    HB3  ALA  18           HB3      ALA  18 -11.285  15.970  -4.006
  116    H    ALA  19           H        ALA  19  -7.659  16.718  -6.372
  117    HA   ALA  19           HA       ALA  19  -7.119  14.121  -7.698
  118    HB1  ALA  19           HB1      ALA  19  -7.584  15.779  -9.485
  119    HB2  ALA  19           HB2      ALA  19  -5.897  15.260  -9.516
  120    HB3  ALA  19           HB3      ALA  19  -6.323  16.832  -8.838
  121    H    GLU  20           H        GLU  20  -4.531  14.314  -8.277
  122    HA   GLU  20           HA       GLU  20  -3.232  14.486  -5.634
  123    HB2  GLU  20           HB2      GLU  20  -1.401  13.149  -6.802
  124    HB3  GLU  20           HB3      GLU  20  -2.962  12.358  -6.636
  125    HG2  GLU  20           HG2      GLU  20  -3.486  12.823  -8.978
  126    HG3  GLU  20           HG3      GLU  20  -1.970  13.704  -9.163
  127    H    GLU  21           H        GLU  21  -0.777  15.024  -5.748
  128    HA   GLU  21           HA       GLU  21  -0.197  17.386  -7.410
  129    HB2  GLU  21           HB2      GLU  21   0.321  18.772  -5.434
  130    HB3  GLU  21           HB3      GLU  21  -1.357  18.245  -5.403
  131    HG2  GLU  21           HG2      GLU  21  -0.788  16.503  -3.741
  132    HG3  GLU  21           HG3      GLU  21   0.896  17.031  -3.764
  133    HA   PRO  22           HA       PRO  22   4.081  15.978  -7.421
  134    HB2  PRO  22           HB2      PRO  22   4.998  18.780  -6.814
  135    HB3  PRO  22           HB3      PRO  22   5.406  17.732  -8.181
  136    HG2  PRO  22           HG2      PRO  22   3.733  19.787  -8.519
  137    HG3  PRO  22           HG3      PRO  22   3.413  18.232  -9.325
  138    HD2  PRO  22           HD2      PRO  22   2.164  19.351  -6.805
  139    HD3  PRO  22           HD3      PRO  22   1.377  18.556  -8.189
  140    H    LEU  23           H        LEU  23   5.784  15.358  -6.117
  141    HA   LEU  23           HA       LEU  23   5.553  15.759  -3.208
  142    HB2  LEU  23           HB2      LEU  23   7.354  13.855  -4.760
  143    HB3  LEU  23           HB3      LEU  23   7.009  13.803  -3.034
  144    HG   LEU  23           HG       LEU  23   4.983  13.279  -5.251
  145   HD11  LEU  23          HD11      LEU  23   6.630  11.473  -5.096
  146   HD12  LEU  23          HD12      LEU  23   5.039  10.939  -4.567
  147   HD13  LEU  23          HD13      LEU  23   6.286  11.298  -3.375
  148   HD21  LEU  23          HD21      LEU  23   3.449  12.552  -3.468
  149   HD22  LEU  23          HD22      LEU  23   3.888  14.247  -3.277
  150   HD23  LEU  23          HD23      LEU  23   4.631  13.024  -2.244
  151    H    SER  24           H        SER  24   7.406  16.444  -1.925
  152    HA   SER  24           HA       SER  24   9.426  18.058  -3.409
  153    HB2  SER  24           HB2      SER  24   8.957  19.984  -1.929
  154    HB3  SER  24           HB3      SER  24   7.491  19.497  -2.778
  155    HG   SER  24           HG       SER  24   7.168  18.158  -0.725
  156    H    LEU  25           H        LEU  25  11.033  19.076  -1.797
  157    HA   LEU  25           HA       LEU  25  12.693  18.975  -0.280
  158    HB2  LEU  25           HB2      LEU  25  10.371  18.094   1.472
  159    HB3  LEU  25           HB3      LEU  25  11.930  18.617   2.095
  160    HG   LEU  25           HG       LEU  25  10.066  20.374   0.444
  161   HD11  LEU  25          HD11      LEU  25   9.584  21.574   2.537
  162   HD12  LEU  25          HD12      LEU  25  10.537  20.396   3.443
  163   HD13  LEU  25          HD13      LEU  25   9.060  19.893   2.618
  164   HD21  LEU  25          HD21      LEU  25  12.626  21.087   1.933
  165   HD22  LEU  25          HD22      LEU  25  11.552  22.229   1.124
  166   HD23  LEU  25          HD23      LEU  25  12.419  21.025   0.179
  167    H    LEU  26           H        LEU  26  10.949  16.181   1.067
  168    HA   LEU  26           HA       LEU  26  12.986  14.256   0.326
  169    HB2  LEU  26           HB2      LEU  26  13.835  15.485   2.411
  170    HB3  LEU  26           HB3      LEU  26  12.478  14.824   3.293
  171    HG   LEU  26           HG       LEU  26  14.550  13.040   1.950
  172   HD11  LEU  26          HD11      LEU  26  15.766  14.501   3.477
  173   HD12  LEU  26          HD12      LEU  26  15.730  12.853   4.098
  174   HD13  LEU  26          HD13      LEU  26  14.670  14.081   4.798
  175   HD21  LEU  26          HD21      LEU  26  13.819  11.336   3.583
  176   HD22  LEU  26          HD22      LEU  26  12.482  11.879   2.576
  177   HD23  LEU  26          HD23      LEU  26  12.624  12.462   4.236
  178    H    ASP  27           H        ASP  27  10.372  14.864   2.651
  179    HA   ASP  27           HA       ASP  27   8.427  13.920   3.210
  180    HB2  ASP  27           HB2      ASP  27   8.436  12.981   0.316
  181    HB3  ASP  27           HB3      ASP  27   7.037  12.895   1.379
  182    H    ASP  28           H        ASP  28   8.662  12.418   4.771
  183    HA   ASP  28           HA       ASP  28   9.844   9.867   4.622
  184    HB2  ASP  28           HB2      ASP  28   7.556  10.737   6.451
  185    HB3  ASP  28           HB3      ASP  28   8.658   9.393   6.739
  186    H    MET  29           H        MET  29   6.617  10.962   3.826
  187    HA   MET  29           HA       MET  29   5.320   8.457   3.534
  188    HB2  MET  29           HB2      MET  29   4.657  11.039   2.054
  189    HB3  MET  29           HB3      MET  29   3.586   9.673   2.334
  190    HG2  MET  29           HG2      MET  29   3.924  10.169   4.845
  191    HG3  MET  29           HG3      MET  29   4.565  11.721   4.307
  192    HE1  MET  29           HE1      MET  29   1.548   9.301   4.392
  193    HE2  MET  29           HE2      MET  29   1.634   9.604   2.651
  194    HE3  MET  29           HE3      MET  29   0.269  10.220   3.587
  195    H    ASN  30           H        ASN  30   6.939  10.616   1.190
  196    HA   ASN  30           HA       ASN  30   6.619   9.029  -1.123
  197    HB2  ASN  30           HB2      ASN  30   7.197  11.418  -1.189
  198    HB3  ASN  30           HB3      ASN  30   8.758  11.083  -0.451
  199   HD21  ASN  30          HD21      ASN  30   9.597  12.223  -2.285
  200   HD22  ASN  30          HD22      ASN  30   9.827  11.394  -3.783
  201    H    HIS  31           H        HIS  31   9.096   8.997   1.396
  202    HA   HIS  31           HA       HIS  31  10.902   7.144   0.267
  203    HB2  HIS  31           HB2      HIS  31  11.340   8.521   2.324
  204    HB3  HIS  31           HB3      HIS  31  10.213   7.506   3.219
  205    HD2  HIS  31           HD2      HIS  31  13.759   7.212   1.531
  206    HE1  HIS  31           HE1      HIS  31  13.235   4.056   4.292
  207    HE2  HIS  31           HE2      HIS  31  14.906   5.323   2.883
  208    H    CYS  32           H        CYS  32   7.974   6.651   2.268
  209    HA   CYS  32           HA       CYS  32   8.019   3.786   2.236
  210    HB2  CYS  32           HB2      CYS  32   5.699   5.686   2.750
  211    HB3  CYS  32           HB3      CYS  32   5.702   3.958   3.105
  212    HG   CYS  32           HG       CYS  32   7.969   6.069   4.531
  213    H    TYR  33           H        TYR  33   6.566   6.218   0.114
  214    HA   TYR  33           HA       TYR  33   4.966   4.546  -1.523
  215    HB2  TYR  33           HB2      TYR  33   6.105   7.326  -1.867
  216    HB3  TYR  33           HB3      TYR  33   5.384   6.536  -3.263
  217    HD1  TYR  33           HD1      TYR  33   3.016   5.332  -2.585
  218    HD2  TYR  33           HD2      TYR  33   4.602   8.860  -0.782
  219    HE1  TYR  33           HE1      TYR  33   0.765   6.030  -1.976
  220    HE2  TYR  33           HE2      TYR  33   2.338   9.564  -0.150
  221    HH   TYR  33           HH       TYR  33  -0.290   7.557  -0.158
  222    H    SER  34           H        SER  34   8.379   5.350  -1.593
  223    HA   SER  34           HA       SER  34   9.148   4.357  -4.091
  224    HB2  SER  34           HB2      SER  34  10.714   5.575  -2.608
  225    HB3  SER  34           HB3      SER  34  10.709   4.228  -1.473
  226    HG   SER  34           HG       SER  34  12.507   3.998  -2.744
  227    H    ARG  35           H        ARG  35   9.072   2.626  -0.946
  228    HA   ARG  35           HA       ARG  35   9.756   0.071  -1.933
  229    HB2  ARG  35           HB2      ARG  35   8.618   1.117   0.643
  230    HB3  ARG  35           HB3      ARG  35   8.479  -0.615   0.361
  231    HG2  ARG  35           HG2      ARG  35  11.100   0.854   0.123
  232    HG3  ARG  35           HG3      ARG  35  10.534   0.165   1.648
  233    HD2  ARG  35           HD2      ARG  35  10.390  -2.070   0.479
  234    HD3  ARG  35           HD3      ARG  35  11.148  -1.322  -0.930
  235    HE   ARG  35           HE       ARG  35  12.780  -0.834   1.282
  236   HH11  ARG  35          HH11      ARG  35  11.822  -3.541  -0.664
  237   HH12  ARG  35          HH12      ARG  35  13.212  -4.463  -0.232
  238   HH21  ARG  35          HH21      ARG  35  14.558  -2.053   1.790
  239   HH22  ARG  35          HH22      ARG  35  14.732  -3.634   1.112
  240    H    LEU  36           H        LEU  36   6.532   1.509  -1.383
  241    HA   LEU  36           HA       LEU  36   4.945  -0.660  -2.167
  242    HB2  LEU  36           HB2      LEU  36   4.509   2.291  -2.769
  243    HB3  LEU  36           HB3      LEU  36   3.284   1.041  -2.921
  244    HG   LEU  36           HG       LEU  36   4.573   1.995  -0.338
  245   HD11  LEU  36          HD11      LEU  36   1.721   2.276  -1.334
  246   HD12  LEU  36          HD12      LEU  36   2.927   3.562  -1.245
  247   HD13  LEU  36          HD13      LEU  36   2.335   2.812   0.233
  248   HD21  LEU  36          HD21      LEU  36   4.167  -0.419  -0.168
  249   HD22  LEU  36          HD22      LEU  36   2.497  -0.200  -0.699
  250   HD23  LEU  36          HD23      LEU  36   3.028   0.466   0.846
  251    H    ARG  37           H        ARG  37   6.241   1.965  -4.211
  252    HA   ARG  37           HA       ARG  37   5.522   1.131  -6.758
  253    HB2  ARG  37           HB2      ARG  37   6.561   3.329  -6.023
  254    HB3  ARG  37           HB3      ARG  37   8.127   2.524  -6.059
  255    HG2  ARG  37           HG2      ARG  37   7.584   1.934  -8.504
  256    HG3  ARG  37           HG3      ARG  37   6.259   3.092  -8.370
  257    HD2  ARG  37           HD2      ARG  37   8.133   4.197  -9.347
  258    HD3  ARG  37           HD3      ARG  37   7.936   4.830  -7.715
  259    HE   ARG  37           HE       ARG  37   9.734   2.817  -7.378
  260   HH11  ARG  37          HH11      ARG  37   9.748   5.570  -9.484
  261   HH12  ARG  37          HH12      ARG  37  11.469   5.619  -9.563
  262   HH21  ARG  37          HH21      ARG  37  11.908   2.897  -7.517
  263   HH22  ARG  37          HH22      ARG  37  12.679   4.128  -8.459
  264    H    GLU  38           H        GLU  38   8.213  -0.043  -4.726
  265    HA   GLU  38           HA       GLU  38   9.652  -1.359  -6.885
  266    HB2  GLU  38           HB2      GLU  38   9.921  -1.752  -3.871
  267    HB3  GLU  38           HB3      GLU  38  11.041  -2.360  -5.084
  268    HG2  GLU  38           HG2      GLU  38  10.538   0.522  -4.331
  269    HG3  GLU  38           HG3      GLU  38  12.000  -0.411  -4.059
  270    H    LEU  39           H        LEU  39   7.293  -2.309  -4.456
  271    HA   LEU  39           HA       LEU  39   7.421  -5.158  -5.103
  272    HB2  LEU  39           HB2      LEU  39   5.687  -3.633  -3.128
  273    HB3  LEU  39           HB3      LEU  39   5.836  -5.384  -3.211
  274    HG   LEU  39           HG       LEU  39   8.168  -3.519  -2.574
  275   HD11  LEU  39          HD11      LEU  39   6.522  -5.096  -0.583
  276   HD12  LEU  39          HD12      LEU  39   6.481  -3.347  -0.794
  277   HD13  LEU  39          HD13      LEU  39   7.955  -4.129  -0.228
  278   HD21  LEU  39          HD21      LEU  39   7.939  -6.539  -2.308
  279   HD22  LEU  39          HD22      LEU  39   9.321  -5.558  -1.808
  280   HD23  LEU  39          HD23      LEU  39   8.891  -5.663  -3.513
  281    H    VAL  40           H        VAL  40   5.696  -2.453  -6.260
  282    HA   VAL  40           HA       VAL  40   3.349  -4.030  -7.137
  283    HB   VAL  40           HB       VAL  40   3.778  -1.004  -7.084
  284   HG11  VAL  40          HG11      VAL  40   1.283  -2.545  -7.913
  285   HG12  VAL  40          HG12      VAL  40   2.320  -1.591  -8.974
  286   HG13  VAL  40          HG13      VAL  40   1.389  -0.793  -7.708
  287   HG21  VAL  40          HG21      VAL  40   3.492  -1.963  -4.853
  288   HG22  VAL  40          HG22      VAL  40   2.014  -2.795  -5.359
  289   HG23  VAL  40          HG23      VAL  40   2.059  -1.031  -5.295
  290    HA   PRO  41           HA       PRO  41   5.302  -3.975 -11.330
  291    HB2  PRO  41           HB2      PRO  41   3.130  -5.931 -11.952
  292    HB3  PRO  41           HB3      PRO  41   4.883  -6.115 -12.098
  293    HG2  PRO  41           HG2      PRO  41   3.513  -7.413 -10.175
  294    HG3  PRO  41           HG3      PRO  41   5.142  -6.769  -9.869
  295    HD2  PRO  41           HD2      PRO  41   2.463  -5.543  -9.144
  296    HD3  PRO  41           HD3      PRO  41   3.904  -5.768  -8.123
  297    H    GLY  42           H        GLY  42   2.024  -3.330 -10.302
  298    HA2  GLY  42           HA2      GLY  42   0.765  -2.508 -12.672
  299    HA3  GLY  42           HA3      GLY  42   0.385  -1.914 -11.066
  300    H    VAL  43           H        VAL  43   3.075  -0.761 -10.652
  301    HA   VAL  43           HA       VAL  43   2.893   1.689 -12.234
  302    HB   VAL  43           HB       VAL  43   5.016   0.944 -10.155
  303   HG11  VAL  43          HG11      VAL  43   4.260   3.649 -11.336
  304   HG12  VAL  43          HG12      VAL  43   5.744   2.749 -11.638
  305   HG13  VAL  43          HG13      VAL  43   5.426   3.397 -10.030
  306   HG21  VAL  43          HG21      VAL  43   2.436   2.512  -9.725
  307   HG22  VAL  43          HG22      VAL  43   3.714   2.284  -8.526
  308   HG23  VAL  43          HG23      VAL  43   2.794   0.897  -9.104
  309    HA   PRO  44           HA       PRO  44   5.747  -0.347 -15.174
  310    HB2  PRO  44           HB2      PRO  44   5.547   1.399 -17.247
  311    HB3  PRO  44           HB3      PRO  44   4.227   0.305 -16.814
  312    HG2  PRO  44           HG2      PRO  44   4.554   3.225 -16.164
  313    HG3  PRO  44           HG3      PRO  44   3.100   2.355 -16.696
  314    HD2  PRO  44           HD2      PRO  44   3.636   3.004 -14.054
  315    HD3  PRO  44           HD3      PRO  44   2.596   1.652 -14.546
  316    H    ARG  45           H        ARG  45   7.452   0.190 -13.505
  317    HA   ARG  45           HA       ARG  45   9.494   0.965 -12.868
  318    HB2  ARG  45           HB2      ARG  45   9.673   1.759 -15.804
  319    HB3  ARG  45           HB3      ARG  45  11.041   1.788 -14.695
  320    HG2  ARG  45           HG2      ARG  45  10.861  -0.652 -14.394
  321    HG3  ARG  45           HG3      ARG  45   9.468  -0.688 -15.480
  322    HD2  ARG  45           HD2      ARG  45  12.298   0.140 -16.224
  323    HD3  ARG  45           HD3      ARG  45  11.507  -1.380 -16.662
  324    HE   ARG  45           HE       ARG  45   9.809   0.438 -17.683
  325   HH11  ARG  45          HH11      ARG  45  13.252   0.179 -18.048
  326   HH12  ARG  45          HH12      ARG  45  13.229   0.896 -19.619
  327   HH21  ARG  45          HH21      ARG  45   9.829   1.366 -19.663
  328   HH22  ARG  45          HH22      ARG  45  11.318   1.560 -20.522
  329    H    GLY  46           H        GLY  46  10.945   3.369 -13.879
  330    HA2  GLY  46           HA2      GLY  46   9.687   5.419 -12.290
  331    HA3  GLY  46           HA3      GLY  46  11.204   5.535 -13.158
  332    H    THR  47           H        THR  47   7.775   5.065 -14.138
  333    HA   THR  47           HA       THR  47   7.866   7.013 -16.269
  334    HB   THR  47           HB       THR  47   5.507   5.554 -14.971
  335    HG1  THR  47           HG1      THR  47   7.174   4.363 -16.209
  336   HG21  THR  47          HG21      THR  47   4.211   6.111 -17.026
  337   HG22  THR  47          HG22      THR  47   5.529   7.155 -17.566
  338   HG23  THR  47          HG23      THR  47   4.624   7.558 -16.105
  339    H    GLN  48           H        GLN  48   7.512   7.201 -12.892
  340    HA   GLN  48           HA       GLN  48   7.328   8.858 -11.396
  341    HB2  GLN  48           HB2      GLN  48   7.331  10.742 -13.792
  342    HB3  GLN  48           HB3      GLN  48   7.468  11.258 -12.115
  343    HG2  GLN  48           HG2      GLN  48   9.599  10.052 -11.892
  344    HG3  GLN  48           HG3      GLN  48   9.456   9.465 -13.550
  345   HE21  GLN  48          HE21      GLN  48   9.822  10.929 -15.266
  346   HE22  GLN  48          HE22      GLN  48  10.588  12.456 -15.022
  347    H    LEU  49           H        LEU  49   5.345   8.053 -10.721
  348    HA   LEU  49           HA       LEU  49   2.883   9.523 -11.453
  349    HB2  LEU  49           HB2      LEU  49   3.292   7.096  -9.648
  350    HB3  LEU  49           HB3      LEU  49   1.738   7.804 -10.060
  351    HG   LEU  49           HG       LEU  49   3.631   6.458 -12.033
  352   HD11  LEU  49          HD11      LEU  49   1.960   4.657 -12.141
  353   HD12  LEU  49          HD12      LEU  49   1.013   5.446 -10.880
  354   HD13  LEU  49          HD13      LEU  49   2.625   4.826 -10.516
  355   HD21  LEU  49          HD21      LEU  49   1.781   6.637 -13.665
  356   HD22  LEU  49          HD22      LEU  49   2.347   8.222 -13.150
  357   HD23  LEU  49          HD23      LEU  49   0.837   7.575 -12.502
  358    H    SER  50           H        SER  50   1.631  10.581  -9.724
  359    HA   SER  50           HA       SER  50   3.412  12.144  -8.079
  360    HB2  SER  50           HB2      SER  50   0.382  12.258  -7.984
  361    HB3  SER  50           HB3      SER  50   1.522  13.528  -7.549
  362    HG   SER  50           HG       SER  50   0.542  12.783 -10.013
  363    H    GLN  51           H        GLN  51   0.375  10.471  -6.991
  364    HA   GLN  51           HA       GLN  51   1.710   9.308  -4.703
  365    HB2  GLN  51           HB2      GLN  51   0.349  10.648  -2.990
  366    HB3  GLN  51           HB3      GLN  51   1.673  11.500  -3.774
  367    HG2  GLN  51           HG2      GLN  51  -0.009  12.534  -5.343
  368    HG3  GLN  51           HG3      GLN  51  -1.284  11.786  -4.382
  369   HE21  GLN  51          HE21      GLN  51  -2.167  13.825  -3.858
  370   HE22  GLN  51          HE22      GLN  51  -1.397  14.906  -2.754
  371    H    VAL  52           H        VAL  52  -1.578  10.314  -5.834
  372    HA   VAL  52           HA       VAL  52  -2.892   8.165  -4.431
  373    HB   VAL  52           HB       VAL  52  -4.129   9.824  -6.682
  374   HG11  VAL  52          HG11      VAL  52  -5.396   8.401  -4.304
  375   HG12  VAL  52          HG12      VAL  52  -5.438   7.844  -5.981
  376   HG13  VAL  52          HG13      VAL  52  -6.264   9.337  -5.529
  377   HG21  VAL  52          HG21      VAL  52  -3.158  11.371  -5.021
  378   HG22  VAL  52          HG22      VAL  52  -4.011  10.539  -3.718
  379   HG23  VAL  52          HG23      VAL  52  -4.922  11.412  -4.954
  380    H    GLU  53           H        GLU  53  -1.817   8.674  -7.774
  381    HA   GLU  53           HA       GLU  53  -2.820   6.460  -9.106
  382    HB2  GLU  53           HB2      GLU  53  -0.242   8.029  -9.387
  383    HB3  GLU  53           HB3      GLU  53  -0.482   6.604 -10.384
  384    HG2  GLU  53           HG2      GLU  53  -2.271   9.044 -10.333
  385    HG3  GLU  53           HG3      GLU  53  -1.081   8.651 -11.574
  386    H    ILE  54           H        ILE  54   0.173   6.662  -7.168
  387    HA   ILE  54           HA       ILE  54   1.042   4.005  -7.415
  388    HB   ILE  54           HB       ILE  54   1.425   5.981  -5.118
  389   HG12  ILE  54          HG12      ILE  54   3.283   5.204  -7.427
  390   HG13  ILE  54          HG13      ILE  54   2.389   6.712  -7.293
  391   HG21  ILE  54          HG21      ILE  54   1.787   3.762  -4.188
  392   HG22  ILE  54          HG22      ILE  54   3.349   4.554  -4.379
  393   HG23  ILE  54          HG23      ILE  54   2.845   3.315  -5.533
  394   HD11  ILE  54          HD11      ILE  54   3.722   7.314  -5.319
  395   HD12  ILE  54          HD12      ILE  54   4.717   7.031  -6.747
  396   HD13  ILE  54          HD13      ILE  54   4.625   5.805  -5.485
  397    H    LEU  55           H        LEU  55  -0.966   5.485  -4.824
  398    HA   LEU  55           HA       LEU  55  -1.470   3.307  -3.199
  399    HB2  LEU  55           HB2      LEU  55  -3.270   5.638  -3.902
  400    HB3  LEU  55           HB3      LEU  55  -3.647   4.499  -2.622
  401    HG   LEU  55           HG       LEU  55  -1.184   6.279  -2.657
  402   HD11  LEU  55          HD11      LEU  55  -3.215   7.629  -2.442
  403   HD12  LEU  55          HD12      LEU  55  -2.324   7.602  -0.922
  404   HD13  LEU  55          HD13      LEU  55  -3.775   6.614  -1.111
  405   HD21  LEU  55          HD21      LEU  55  -2.306   4.502  -0.453
  406   HD22  LEU  55          HD22      LEU  55  -0.921   5.586  -0.304
  407   HD23  LEU  55          HD23      LEU  55  -0.835   4.198  -1.384
  408    H    GLN  56           H        GLN  56  -3.442   4.319  -6.005
  409    HA   GLN  56           HA       GLN  56  -5.463   2.365  -5.884
  410    HB2  GLN  56           HB2      GLN  56  -4.321   3.820  -8.314
  411    HB3  GLN  56           HB3      GLN  56  -5.819   2.894  -8.326
  412    HG2  GLN  56           HG2      GLN  56  -6.822   4.457  -6.712
  413    HG3  GLN  56           HG3      GLN  56  -5.311   5.363  -6.636
  414   HE21  GLN  56          HE21      GLN  56  -6.334   7.269  -7.338
  415   HE22  GLN  56          HE22      GLN  56  -6.843   7.498  -8.969
  416    H    ARG  57           H        ARG  57  -2.328   2.341  -7.547
  417    HA   ARG  57           HA       ARG  57  -2.670  -0.251  -8.769
  418    HB2  ARG  57           HB2      ARG  57  -0.173   1.470  -8.458
  419    HB3  ARG  57           HB3      ARG  57  -0.312   0.053  -9.500
  420    HG2  ARG  57           HG2      ARG  57  -2.021   1.183 -10.860
  421    HG3  ARG  57           HG3      ARG  57  -1.987   2.573  -9.778
  422    HD2  ARG  57           HD2      ARG  57   0.428   2.908 -10.401
  423    HD3  ARG  57           HD3      ARG  57   0.239   1.635 -11.613
  424    HE   ARG  57           HE       ARG  57  -1.364   4.133 -11.623
  425   HH11  ARG  57          HH11      ARG  57   0.455   1.767 -13.384
  426   HH12  ARG  57          HH12      ARG  57   0.218   2.576 -14.891
  427   HH21  ARG  57          HH21      ARG  57  -1.626   5.137 -13.559
  428   HH22  ARG  57          HH22      ARG  57  -0.939   4.453 -14.990
  429    H    VAL  58           H        VAL  58  -1.394   0.838  -5.662
  430    HA   VAL  58           HA       VAL  58  -0.055  -1.576  -4.916
  431    HB   VAL  58           HB       VAL  58  -1.356   0.510  -3.086
  432   HG11  VAL  58          HG11      VAL  58   0.066  -0.427  -1.276
  433   HG12  VAL  58          HG12      VAL  58   0.630  -1.693  -2.371
  434   HG13  VAL  58          HG13      VAL  58  -1.066  -1.629  -1.897
  435   HG21  VAL  58          HG21      VAL  58   0.929   1.398  -2.780
  436   HG22  VAL  58          HG22      VAL  58   0.453   1.456  -4.475
  437   HG23  VAL  58          HG23      VAL  58   1.560   0.203  -3.919
  438    H    ILE  59           H        ILE  59  -3.379  -0.365  -4.332
  439    HA   ILE  59           HA       ILE  59  -4.543  -2.594  -3.098
  440    HB   ILE  59           HB       ILE  59  -5.853  -0.763  -5.171
  441   HG12  ILE  59          HG12      ILE  59  -5.826  -0.439  -2.128
  442   HG13  ILE  59          HG13      ILE  59  -4.831   0.489  -3.246
  443   HG21  ILE  59          HG21      ILE  59  -7.213  -2.777  -4.758
  444   HG22  ILE  59          HG22      ILE  59  -8.008  -1.356  -4.088
  445   HG23  ILE  59          HG23      ILE  59  -7.168  -2.480  -3.017
  446   HD11  ILE  59          HD11      ILE  59  -6.834   1.444  -4.254
  447   HD12  ILE  59          HD12      ILE  59  -6.762   1.745  -2.519
  448   HD13  ILE  59          HD13      ILE  59  -7.843   0.504  -3.147
  449    H    ASP  60           H        ASP  60  -4.188  -1.842  -6.564
  450    HA   ASP  60           HA       ASP  60  -5.368  -4.072  -7.751
  451    HB2  ASP  60           HB2      ASP  60  -4.726  -2.031  -8.969
  452    HB3  ASP  60           HB3      ASP  60  -3.023  -2.364  -8.688
  453    H    TYR  61           H        TYR  61  -1.981  -3.646  -6.692
  454    HA   TYR  61           HA       TYR  61  -0.954  -6.163  -7.483
  455    HB2  TYR  61           HB2      TYR  61   0.632  -4.450  -6.917
  456    HB3  TYR  61           HB3      TYR  61  -0.092  -4.187  -5.334
  457    HD1  TYR  61           HD1      TYR  61   1.660  -6.885  -7.315
  458    HD2  TYR  61           HD2      TYR  61   0.932  -5.200  -3.443
  459    HE1  TYR  61           HE1      TYR  61   3.270  -8.452  -6.327
  460    HE2  TYR  61           HE2      TYR  61   2.563  -6.757  -2.472
  461    HH   TYR  61           HH       TYR  61   3.495  -9.041  -3.048
  462    H    ILE  62           H        ILE  62  -2.413  -5.108  -4.388
  463    HA   ILE  62           HA       ILE  62  -1.942  -7.566  -3.012
  464    HB   ILE  62           HB       ILE  62  -3.953  -5.371  -2.328
  465   HG12  ILE  62          HG12      ILE  62  -1.088  -5.752  -1.292
  466   HG13  ILE  62          HG13      ILE  62  -1.577  -4.536  -2.464
  467   HG21  ILE  62          HG21      ILE  62  -2.789  -7.589  -0.597
  468   HG22  ILE  62          HG22      ILE  62  -4.459  -7.471  -1.157
  469   HG23  ILE  62          HG23      ILE  62  -3.828  -6.284  -0.019
  470   HD11  ILE  62          HD11      ILE  62  -2.489  -4.697   0.408
  471   HD12  ILE  62          HD12      ILE  62  -3.009  -3.486  -0.767
  472   HD13  ILE  62          HD13      ILE  62  -1.321  -3.561  -0.268
  473    H    LEU  63           H        LEU  63  -4.724  -6.311  -4.852
  474    HA   LEU  63           HA       LEU  63  -6.544  -8.439  -4.305
  475    HB2  LEU  63           HB2      LEU  63  -6.456  -6.467  -6.622
  476    HB3  LEU  63           HB3      LEU  63  -7.777  -7.591  -6.341
  477    HG   LEU  63           HG       LEU  63  -6.965  -5.295  -4.517
  478   HD11  LEU  63          HD11      LEU  63  -9.139  -4.315  -5.128
  479   HD12  LEU  63          HD12      LEU  63  -9.439  -5.657  -6.236
  480   HD13  LEU  63          HD13      LEU  63  -8.109  -4.540  -6.543
  481   HD21  LEU  63          HD21      LEU  63  -9.201  -7.319  -4.157
  482   HD22  LEU  63          HD22      LEU  63  -8.944  -5.886  -3.161
  483   HD23  LEU  63          HD23      LEU  63  -7.747  -7.176  -3.164
  484    H    ASP  64           H        ASP  64  -4.012  -7.996  -6.720
  485    HA   ASP  64           HA       ASP  64  -4.470 -10.260  -8.328
  486    HB2  ASP  64           HB2      ASP  64  -2.839  -8.541  -8.933
  487    HB3  ASP  64           HB3      ASP  64  -1.857  -8.912  -7.520
  488    H    LEU  65           H        LEU  65  -2.925  -9.939  -5.170
  489    HA   LEU  65           HA       LEU  65  -2.050 -12.702  -4.969
  490    HB2  LEU  65           HB2      LEU  65  -2.207 -10.602  -2.767
  491    HB3  LEU  65           HB3      LEU  65  -1.266 -12.087  -2.744
  492    HG   LEU  65           HG       LEU  65  -0.755  -9.659  -4.500
  493   HD11  LEU  65          HD11      LEU  65  -0.076  -9.292  -2.188
  494   HD12  LEU  65          HD12      LEU  65   1.339  -9.431  -3.229
  495   HD13  LEU  65          HD13      LEU  65   0.867 -10.786  -2.199
  496   HD21  LEU  65          HD21      LEU  65   1.271 -10.831  -5.301
  497   HD22  LEU  65          HD22      LEU  65  -0.207 -11.665  -5.774
  498   HD23  LEU  65          HD23      LEU  65   0.764 -12.288  -4.439
  499    H    GLN  66           H        GLN  66  -4.787 -10.788  -3.803
  500    HA   GLN  66           HA       GLN  66  -5.667 -12.795  -1.878
  501    HB2  GLN  66           HB2      GLN  66  -6.806 -10.061  -2.574
  502    HB3  GLN  66           HB3      GLN  66  -7.484 -11.112  -1.338
  503    HG2  GLN  66           HG2      GLN  66  -4.637 -10.060  -1.256
  504    HG3  GLN  66           HG3      GLN  66  -6.000  -9.254  -0.484
  505   HE21  GLN  66          HE21      GLN  66  -4.972  -9.469   1.555
  506   HE22  GLN  66          HE22      GLN  66  -4.911 -10.982   2.382
  507    H    VAL  67           H        VAL  67  -7.113 -11.248  -4.772
  508    HA   VAL  67           HA       VAL  67  -9.427 -12.991  -4.755
  509    HB   VAL  67           HB       VAL  67  -8.561 -11.058  -6.959
  510   HG11  VAL  67          HG11      VAL  67 -10.272 -12.663  -7.686
  511   HG12  VAL  67          HG12      VAL  67 -10.956 -11.042  -7.588
  512   HG13  VAL  67          HG13      VAL  67 -11.305 -12.223  -6.322
  513   HG21  VAL  67          HG21      VAL  67 -10.058  -9.373  -5.900
  514   HG22  VAL  67          HG22      VAL  67  -8.717  -9.813  -4.846
  515   HG23  VAL  67          HG23      VAL  67 -10.327 -10.467  -4.537
  516    H    VAL  68           H        VAL  68  -9.608 -14.913  -5.775
  517    HA   VAL  68           HA       VAL  68  -9.259 -16.781  -6.973
  518    HB   VAL  68           HB       VAL  68  -7.850 -14.976  -8.998
  519   HG11  VAL  68          HG11      VAL  68  -8.983 -17.780  -9.374
  520   HG12  VAL  68          HG12      VAL  68  -7.276 -17.328  -9.400
  521   HG13  VAL  68          HG13      VAL  68  -8.359 -16.750 -10.668
  522   HG21  VAL  68          HG21      VAL  68 -10.159 -14.230  -8.565
  523   HG22  VAL  68          HG22      VAL  68 -10.772 -15.857  -8.874
  524   HG23  VAL  68          HG23      VAL  68 -10.038 -14.925 -10.182
  525    H1   MET   1           H1       MET   1  -0.094  13.208  20.053
  526    H2   MET   1           H2       MET   1  -0.586  12.927  21.642
  527    H3   MET   1           H3       MET   1   0.949  13.560  21.335
  528    HA   MET   1           HA       MET   1  -1.598  14.902  20.673
  529    HB2  MET   1           HB2      MET   1  -1.168  16.371  22.624
  530    HB3  MET   1           HB3      MET   1  -1.345  14.696  23.113
  531    HG2  MET   1           HG2      MET   1   1.175  14.548  23.200
  532    HG3  MET   1           HG3      MET   1   1.216  16.293  22.961
  533    HE1  MET   1           HE1      MET   1  -1.428  17.158  24.686
  534    HE2  MET   1           HE2      MET   1   0.093  18.049  24.761
  535    HE3  MET   1           HE3      MET   1  -0.689  17.510  26.246
  536    H    GLY   2           H        GLY   2  -1.352  17.081  19.905
  537    HA2  GLY   2           HA2      GLY   2  -0.297  18.878  18.872
  538    HA3  GLY   2           HA3      GLY   2   1.266  18.166  19.241
  539    H    HIS   3           H        HIS   3  -1.541  17.891  17.076
  540    HA   HIS   3           HA       HIS   3  -0.084  16.345  15.063
  541    HB2  HIS   3           HB2      HIS   3  -2.457  15.794  15.591
  542    HB3  HIS   3           HB3      HIS   3  -2.953  17.401  15.074
  543    HD2  HIS   3           HD2      HIS   3  -4.113  17.167  12.635
  544    HE1  HIS   3           HE1      HIS   3  -1.549  14.186  11.077
  545    HE2  HIS   3           HE2      HIS   3  -3.349  15.870  10.528
  546    H    HIS   4           H        HIS   4  -0.086  17.054  12.768
  547    HA   HIS   4           HA       HIS   4   0.515  19.936  12.451
  548    HB2  HIS   4           HB2      HIS   4   1.185  17.620  10.575
  549    HB3  HIS   4           HB3      HIS   4   1.809  19.269  10.479
  550    HD2  HIS   4           HD2      HIS   4   2.653  15.914  12.113
  551    HE1  HIS   4           HE1      HIS   4   5.180  18.840  13.818
  552    HE2  HIS   4           HE2      HIS   4   4.854  16.373  13.403
  553    H    HIS   5           H        HIS   5  -0.735  21.231  11.124
  554    HA   HIS   5           HA       HIS   5  -3.119  20.161   9.857
  555    HB2  HIS   5           HB2      HIS   5  -3.594  22.544   9.245
  556    HB3  HIS   5           HB3      HIS   5  -3.343  22.307  10.963
  557    HD2  HIS   5           HD2      HIS   5  -1.190  23.694  12.073
  558    HE1  HIS   5           HE1      HIS   5  -0.106  25.645   8.484
  559    HE2  HIS   5           HE2      HIS   5   0.410  25.388  10.936
  560    H    HIS   6           H        HIS   6  -3.146  19.328   7.857
  561    HA   HIS   6           HA       HIS   6  -0.904  19.850   5.984
  562    HB2  HIS   6           HB2      HIS   6  -2.849  17.501   6.088
  563    HB3  HIS   6           HB3      HIS   6  -1.506  17.663   4.957
  564    HD2  HIS   6           HD2      HIS   6  -2.229  16.179   8.365
  565    HE1  HIS   6           HE1      HIS   6   1.973  16.513   8.035
  566    HE2  HIS   6           HE2      HIS   6   0.067  15.323   9.193
  567    H    HIS   7           H        HIS   7  -1.267  20.218   3.802
  568    HA   HIS   7           HA       HIS   7  -2.195  20.757   1.836
  569    HB2  HIS   7           HB2      HIS   7  -3.624  18.769   2.048
  570    HB3  HIS   7           HB3      HIS   7  -4.792  19.673   3.001
  571    HD2  HIS   7           HD2      HIS   7  -3.464  19.656  -0.734
  572    HE1  HIS   7           HE1      HIS   7  -7.394  21.219  -0.602
  573    HE2  HIS   7           HE2      HIS   7  -5.465  20.566  -2.103
  574    H    HIS   8           H        HIS   8  -2.418  22.786   1.154
  575    HA   HIS   8           HA       HIS   8  -4.374  24.626   2.418
  576    HB2  HIS   8           HB2      HIS   8  -2.073  25.194   0.499
  577    HB3  HIS   8           HB3      HIS   8  -3.181  26.416   1.109
  578    HD2  HIS   8           HD2      HIS   8  -3.117  26.222   4.196
  579    HE1  HIS   8           HE1      HIS   8   1.079  25.792   3.910
  580    HE2  HIS   8           HE2      HIS   8  -0.866  26.163   5.478
  581    H    SER   9           H        SER   9  -6.335  24.707   1.446
  582    HA   SER   9           HA       SER   9  -6.892  23.597  -1.137
  583    HB2  SER   9           HB2      SER   9  -8.645  25.300   0.687
  584    HB3  SER   9           HB3      SER   9  -9.217  24.462  -0.756
  585    HG   SER   9           HG       SER   9  -9.493  23.358   1.332
  586    H    HIS  10           H        HIS  10  -6.437  24.543  -3.016
  587    HA   HIS  10           HA       HIS  10  -6.656  27.477  -3.384
  588    HB2  HIS  10           HB2      HIS  10  -4.532  27.514  -4.630
  589    HB3  HIS  10           HB3      HIS  10  -4.253  26.898  -3.007
  590    HD1  HIS  10           HD1      HIS  10  -4.200  25.871  -6.608
  591    HD2  HIS  10           HD2      HIS  10  -3.406  24.194  -2.888
  592    HE1  HIS  10           HE1      HIS  10  -3.060  23.688  -7.079
  593    HE2  HIS  10           HE2      HIS  10  -2.631  22.676  -4.822
  594    H    MET  11           H        MET  11  -6.408  27.967  -5.880
  595    HA   MET  11           HA       MET  11  -8.405  26.570  -7.359
  596    HB2  MET  11           HB2      MET  11  -7.963  28.947  -7.749
  597    HB3  MET  11           HB3      MET  11  -6.307  28.603  -8.242
  598    HG2  MET  11           HG2      MET  11  -7.777  29.081 -10.167
  599    HG3  MET  11           HG3      MET  11  -7.105  27.449 -10.236
  600    HE1  MET  11           HE1      MET  11  -8.933  26.650 -12.033
  601    HE2  MET  11           HE2      MET  11  -9.567  28.298 -12.049
  602    HE3  MET  11           HE3      MET  11 -10.663  26.933 -11.832
  603    H    GLY  12           H        GLY  12  -8.119  24.525  -8.102
  604    HA2  GLY  12           HA2      GLY  12  -6.986  23.488 -10.155
  605    HA3  GLY  12           HA3      GLY  12  -5.502  23.667  -9.232
  606    H    GLY  13           H        GLY  13  -6.196  21.214 -10.183
  607    HA2  GLY  13           HA2      GLY  13  -6.242  19.014  -9.483
  608    HA3  GLY  13           HA3      GLY  13  -6.388  19.567  -7.821
  609    H    GLY  14           H        GLY  14  -8.434  19.866 -10.750
  610    HA2  GLY  14           HA2      GLY  14 -10.733  18.680  -9.281
  611    HA3  GLY  14           HA3      GLY  14 -10.890  20.176 -10.187
  612    H    LYS  15           H        LYS  15 -10.656  16.708 -10.403
  613    HA   LYS  15           HA       LYS  15 -10.781  16.612 -13.316
  614    HB2  LYS  15           HB2      LYS  15 -10.903  14.132 -12.974
  615    HB3  LYS  15           HB3      LYS  15  -9.501  14.872 -12.218
  616    HG2  LYS  15           HG2      LYS  15 -10.606  14.743 -10.010
  617    HG3  LYS  15           HG3      LYS  15 -12.025  14.008 -10.759
  618    HD2  LYS  15           HD2      LYS  15 -10.635  12.071 -11.471
  619    HD3  LYS  15           HD3      LYS  15  -9.224  12.807 -10.709
  620    HE2  LYS  15           HE2      LYS  15 -10.382  12.673  -8.503
  621    HE3  LYS  15           HE3      LYS  15 -11.747  11.876  -9.287
  622    HZ1  LYS  15           HZ1      LYS  15 -10.298  10.268  -8.264
  623    HZ2  LYS  15           HZ2      LYS  15  -8.968  10.838  -9.134
  624    HZ3  LYS  15           HZ3      LYS  15 -10.245  10.080  -9.941
  625    H    GLY  16           H        GLY  16 -12.603  14.846 -14.101
  626    HA2  GLY  16           HA2      GLY  16 -15.216  15.387 -12.829
  627    HA3  GLY  16           HA3      GLY  16 -14.991  15.896 -14.495
  628    HA   PRO  17           HA       PRO  17 -15.360  11.081 -14.743
  629    HB2  PRO  17           HB2      PRO  17 -15.048   9.488 -12.606
  630    HB3  PRO  17           HB3      PRO  17 -13.631  10.212 -13.379
  631    HG2  PRO  17           HG2      PRO  17 -15.085  11.099 -10.887
  632    HG3  PRO  17           HG3      PRO  17 -13.335  10.939 -11.157
  633    HD2  PRO  17           HD2      PRO  17 -14.721  13.333 -11.356
  634    HD3  PRO  17           HD3      PRO  17 -13.189  13.009 -12.196
  635    H    ALA  18           H        ALA  18 -17.118   9.380 -14.169
  636    HA   ALA  18           HA       ALA  18 -19.552  10.611 -13.220
  637    HB1  ALA  18           HB1      ALA  18 -19.010   7.693 -13.866
  638    HB2  ALA  18           HB2      ALA  18 -19.608   8.908 -14.995
  639    HB3  ALA  18           HB3      ALA  18 -20.600   8.422 -13.619
  640    H    ALA  19           H        ALA  19 -19.040  11.278 -11.110
  641    HA   ALA  19           HA       ALA  19 -18.889   9.173  -9.023
  642    HB1  ALA  19           HB1      ALA  19 -17.340  10.571  -7.726
  643    HB2  ALA  19           HB2      ALA  19 -17.339  11.793  -8.999
  644    HB3  ALA  19           HB3      ALA  19 -16.654  10.198  -9.309
  645    H    GLU  20           H        GLU  20 -20.327   9.373  -7.426
  646    HA   GLU  20           HA       GLU  20 -21.952  11.852  -7.145
  647    HB2  GLU  20           HB2      GLU  20 -22.701   8.945  -6.592
  648    HB3  GLU  20           HB3      GLU  20 -23.741  10.330  -6.259
  649    HG2  GLU  20           HG2      GLU  20 -23.815  10.891  -8.641
  650    HG3  GLU  20           HG3      GLU  20 -22.703   9.577  -9.006
  651    H    GLU  21           H        GLU  21 -19.493  11.688  -5.938
  652    HA   GLU  21           HA       GLU  21 -19.716  10.920  -3.153
  653    HB2  GLU  21           HB2      GLU  21 -17.488  12.622  -4.321
  654    HB3  GLU  21           HB3      GLU  21 -17.411  11.514  -2.962
  655    HG2  GLU  21           HG2      GLU  21 -17.512  10.826  -5.911
  656    HG3  GLU  21           HG3      GLU  21 -16.187  10.543  -4.788
  657    HA   PRO  22           HA       PRO  22 -21.422  14.794  -1.589
  658    HB2  PRO  22           HB2      PRO  22 -20.147  14.994   0.885
  659    HB3  PRO  22           HB3      PRO  22 -21.527  13.939   0.559
  660    HG2  PRO  22           HG2      PRO  22 -18.590  13.261   0.581
  661    HG3  PRO  22           HG3      PRO  22 -19.950  12.356   1.284
  662    HD2  PRO  22           HD2      PRO  22 -18.856  11.620  -1.064
  663    HD3  PRO  22           HD3      PRO  22 -20.610  11.494  -0.804
  664    H    LEU  23           H        LEU  23 -20.935  16.788  -2.305
  665    HA   LEU  23           HA       LEU  23 -18.252  17.617  -2.933
  666    HB2  LEU  23           HB2      LEU  23 -20.892  19.105  -3.150
  667    HB3  LEU  23           HB3      LEU  23 -19.360  19.723  -3.745
  668    HG   LEU  23           HG       LEU  23 -20.780  17.232  -4.772
  669   HD11  LEU  23          HD11      LEU  23 -21.919  19.282  -5.460
  670   HD12  LEU  23          HD12      LEU  23 -21.129  18.523  -6.838
  671   HD13  LEU  23          HD13      LEU  23 -20.403  19.942  -6.080
  672   HD21  LEU  23          HD21      LEU  23 -18.188  18.497  -5.748
  673   HD22  LEU  23          HD22      LEU  23 -19.035  17.159  -6.525
  674   HD23  LEU  23          HD23      LEU  23 -18.341  16.943  -4.922
  675    H    SER  24           H        SER  24 -17.366  17.534  -0.815
  676    HA   SER  24           HA       SER  24 -17.070  20.161   0.316
  677    HB2  SER  24           HB2      SER  24 -17.497  19.450   2.704
  678    HB3  SER  24           HB3      SER  24 -18.965  19.433   1.725
  679    HG   SER  24           HG       SER  24 -19.127  17.468   2.482
  680    H    LEU  25           H        LEU  25 -16.467  16.832   1.487
  681    HA   LEU  25           HA       LEU  25 -13.652  17.013   0.590
  682    HB2  LEU  25           HB2      LEU  25 -14.713  15.605   3.076
  683    HB3  LEU  25           HB3      LEU  25 -13.117  15.328   2.405
  684    HG   LEU  25           HG       LEU  25 -12.772  17.915   2.768
  685   HD11  LEU  25          HD11      LEU  25 -13.981  18.868   4.690
  686   HD12  LEU  25          HD12      LEU  25 -15.032  17.449   4.734
  687   HD13  LEU  25          HD13      LEU  25 -15.058  18.524   3.337
  688   HD21  LEU  25          HD21      LEU  25 -12.798  15.992   5.117
  689   HD22  LEU  25          HD22      LEU  25 -11.899  17.509   5.036
  690   HD23  LEU  25          HD23      LEU  25 -11.498  16.191   3.936
  691    H    LEU  26           H        LEU  26 -13.328  15.630  -1.042
  692    HA   LEU  26           HA       LEU  26 -15.191  13.448  -1.624
  693    HB2  LEU  26           HB2      LEU  26 -14.088  15.055  -3.339
  694    HB3  LEU  26           HB3      LEU  26 -12.632  14.105  -3.149
  695    HG   LEU  26           HG       LEU  26 -15.267  12.889  -4.095
  696   HD11  LEU  26          HD11      LEU  26 -14.634  14.676  -5.657
  697   HD12  LEU  26          HD12      LEU  26 -14.460  13.090  -6.403
  698   HD13  LEU  26          HD13      LEU  26 -13.028  13.960  -5.844
  699   HD21  LEU  26          HD21      LEU  26 -13.636  11.229  -3.280
  700   HD22  LEU  26          HD22      LEU  26 -12.419  11.861  -4.387
  701   HD23  LEU  26          HD23      LEU  26 -13.871  11.083  -5.020
  702    H    ASP  27           H        ASP  27 -11.786  13.891  -0.697
  703    HA   ASP  27           HA       ASP  27 -10.170  12.595   0.160
  704    HB2  ASP  27           HB2      ASP  27 -12.655  11.303   1.304
  705    HB3  ASP  27           HB3      ASP  27 -11.093  10.567   1.612
  706    H    ASP  28           H        ASP  28 -10.419  12.163  -2.461
  707    HA   ASP  28           HA       ASP  28 -10.860   9.604  -3.468
  708    HB2  ASP  28           HB2      ASP  28 -10.438  11.782  -4.758
  709    HB3  ASP  28           HB3      ASP  28  -8.714  11.512  -4.505
  710    H    MET  29           H        MET  29  -7.891  10.977  -2.134
  711    HA   MET  29           HA       MET  29  -6.183   8.729  -2.358
  712    HB2  MET  29           HB2      MET  29  -5.077  10.776  -2.050
  713    HB3  MET  29           HB3      MET  29  -6.171  11.318  -0.788
  714    HG2  MET  29           HG2      MET  29  -5.092   9.977   0.853
  715    HG3  MET  29           HG3      MET  29  -4.202   9.068  -0.361
  716    HE1  MET  29           HE1      MET  29  -1.422  11.443  -1.489
  717    HE2  MET  29           HE2      MET  29  -2.886  10.849  -2.274
  718    HE3  MET  29           HE3      MET  29  -1.897   9.752  -1.307
  719    H    ASN  30           H        ASN  30  -8.388   9.772   0.267
  720    HA   ASN  30           HA       ASN  30  -7.530   7.833   2.200
  721    HB2  ASN  30           HB2      ASN  30  -8.734  10.071   2.634
  722    HB3  ASN  30           HB3      ASN  30 -10.220   9.252   2.189
  723   HD21  ASN  30          HD21      ASN  30  -9.794  10.471   4.635
  724   HD22  ASN  30          HD22      ASN  30  -9.812   9.263   5.868
  725    H    HIS  31           H        HIS  31 -10.018   7.802  -0.342
  726    HA   HIS  31           HA       HIS  31 -11.390   5.435   0.313
  727    HB2  HIS  31           HB2      HIS  31 -10.779   6.625  -2.413
  728    HB3  HIS  31           HB3      HIS  31 -11.839   5.235  -2.180
  729    HD2  HIS  31           HD2      HIS  31 -12.269   8.796  -2.733
  730    HE1  HIS  31           HE1      HIS  31 -15.462   7.765  -0.184
  731    HE2  HIS  31           HE2      HIS  31 -14.449   9.592  -1.602
  732    H    CYS  32           H        CYS  32  -8.399   5.978  -1.472
  733    HA   CYS  32           HA       CYS  32  -7.786   3.271  -2.097
  734    HB2  CYS  32           HB2      CYS  32  -5.942   5.681  -1.875
  735    HB3  CYS  32           HB3      CYS  32  -5.529   4.138  -2.627
  736    HG   CYS  32           HG       CYS  32  -7.624   6.555  -3.776
  737    H    TYR  33           H        TYR  33  -6.658   5.432   0.522
  738    HA   TYR  33           HA       TYR  33  -5.031   3.619   1.937
  739    HB2  TYR  33           HB2      TYR  33  -6.433   6.190   2.660
  740    HB3  TYR  33           HB3      TYR  33  -5.789   5.219   3.980
  741    HD1  TYR  33           HD1      TYR  33  -3.289   4.354   3.563
  742    HD2  TYR  33           HD2      TYR  33  -4.960   7.865   1.797
  743    HE1  TYR  33           HE1      TYR  33  -1.047   5.273   3.278
  744    HE2  TYR  33           HE2      TYR  33  -2.705   8.780   1.502
  745    HH   TYR  33           HH       TYR  33  -0.509   8.550   2.300
  746    H    SER  34           H        SER  34  -8.517   4.014   1.947
  747    HA   SER  34           HA       SER  34  -9.148   2.638   4.325
  748    HB2  SER  34           HB2      SER  34 -10.785   4.039   3.051
  749    HB3  SER  34           HB3      SER  34 -10.857   2.793   1.804
  750    HG   SER  34           HG       SER  34 -11.650   1.348   3.384
  751    H    ARG  35           H        ARG  35  -9.064   1.474   0.929
  752    HA   ARG  35           HA       ARG  35  -9.571  -1.247   1.485
  753    HB2  ARG  35           HB2      ARG  35  -8.293   0.057  -0.913
  754    HB3  ARG  35           HB3      ARG  35  -8.623  -1.679  -0.812
  755    HG2  ARG  35           HG2      ARG  35 -11.045  -1.084  -0.325
  756    HG3  ARG  35           HG3      ARG  35 -10.639   0.581  -0.751
  757    HD2  ARG  35           HD2      ARG  35  -9.881  -0.215  -2.965
  758    HD3  ARG  35           HD3      ARG  35 -10.386  -1.848  -2.535
  759    HE   ARG  35           HE       ARG  35 -12.529  -0.016  -2.216
  760   HH11  ARG  35          HH11      ARG  35 -10.837  -1.733  -4.710
  761   HH12  ARG  35          HH12      ARG  35 -12.183  -1.673  -5.786
  762   HH21  ARG  35          HH21      ARG  35 -14.214   0.030  -3.613
  763   HH22  ARG  35          HH22      ARG  35 -14.072  -0.702  -5.173
  764    H    LEU  36           H        LEU  36  -6.493   0.536   1.393
  765    HA   LEU  36           HA       LEU  36  -4.713  -1.634   1.590
  766    HB2  LEU  36           HB2      LEU  36  -4.479   1.081   2.945
  767    HB3  LEU  36           HB3      LEU  36  -3.169  -0.070   2.758
  768    HG   LEU  36           HG       LEU  36  -4.555   1.472   0.539
  769   HD11  LEU  36          HD11      LEU  36  -2.351   2.492   0.166
  770   HD12  LEU  36          HD12      LEU  36  -1.695   1.596   1.539
  771   HD13  LEU  36          HD13      LEU  36  -2.949   2.813   1.794
  772   HD21  LEU  36          HD21      LEU  36  -4.076  -0.780  -0.298
  773   HD22  LEU  36          HD22      LEU  36  -2.404  -0.660   0.253
  774   HD23  LEU  36          HD23      LEU  36  -2.986   0.388  -1.042
  775    H    ARG  37           H        ARG  37  -6.268   0.226   4.219
  776    HA   ARG  37           HA       ARG  37  -5.416  -1.257   6.445
  777    HB2  ARG  37           HB2      ARG  37  -7.966   0.332   6.053
  778    HB3  ARG  37           HB3      ARG  37  -7.372  -0.245   7.612
  779    HG2  ARG  37           HG2      ARG  37  -5.344   1.123   7.370
  780    HG3  ARG  37           HG3      ARG  37  -5.888   1.664   5.778
  781    HD2  ARG  37           HD2      ARG  37  -7.251   2.207   8.425
  782    HD3  ARG  37           HD3      ARG  37  -6.334   3.354   7.451
  783    HE   ARG  37           HE       ARG  37  -8.225   2.586   5.722
  784   HH11  ARG  37          HH11      ARG  37  -8.521   3.695   8.993
  785   HH12  ARG  37          HH12      ARG  37 -10.113   4.313   8.733
  786   HH21  ARG  37          HH21      ARG  37 -10.277   3.384   5.462
  787   HH22  ARG  37          HH22      ARG  37 -11.075   4.144   6.786
  788    H    GLU  38           H        GLU  38  -7.906  -1.990   4.113
  789    HA   GLU  38           HA       GLU  38  -9.357  -3.894   5.802
  790    HB2  GLU  38           HB2      GLU  38  -9.756  -3.032   2.904
  791    HB3  GLU  38           HB3      GLU  38 -10.804  -4.175   3.743
  792    HG2  GLU  38           HG2      GLU  38 -11.472  -2.441   5.340
  793    HG3  GLU  38           HG3      GLU  38 -10.361  -1.297   4.597
  794    H    LEU  39           H        LEU  39  -7.028  -3.905   3.180
  795    HA   LEU  39           HA       LEU  39  -7.196  -6.780   2.690
  796    HB2  LEU  39           HB2      LEU  39  -5.481  -4.589   1.481
  797    HB3  LEU  39           HB3      LEU  39  -5.369  -6.275   1.003
  798    HG   LEU  39           HG       LEU  39  -7.895  -4.595   0.725
  799   HD11  LEU  39          HD11      LEU  39  -5.894  -5.322  -1.434
  800   HD12  LEU  39          HD12      LEU  39  -6.153  -3.713  -0.756
  801   HD13  LEU  39          HD13      LEU  39  -7.434  -4.493  -1.682
  802   HD21  LEU  39          HD21      LEU  39  -8.374  -6.997   0.947
  803   HD22  LEU  39          HD22      LEU  39  -7.251  -7.360  -0.368
  804   HD23  LEU  39          HD23      LEU  39  -8.720  -6.438  -0.690
  805    H    VAL  40           H        VAL  40  -5.318  -4.652   4.670
  806    HA   VAL  40           HA       VAL  40  -3.208  -6.643   5.160
  807    HB   VAL  40           HB       VAL  40  -3.564  -3.889   6.441
  808   HG11  VAL  40          HG11      VAL  40  -2.237  -5.356   7.879
  809   HG12  VAL  40          HG12      VAL  40  -1.180  -4.152   7.140
  810   HG13  VAL  40          HG13      VAL  40  -1.198  -5.807   6.525
  811   HG21  VAL  40          HG21      VAL  40  -1.767  -4.719   4.120
  812   HG22  VAL  40          HG22      VAL  40  -1.742  -3.144   4.921
  813   HG23  VAL  40          HG23      VAL  40  -3.180  -3.655   4.035
  814    HA   PRO  41           HA       PRO  41  -5.894  -8.032   8.644
  815    HB2  PRO  41           HB2      PRO  41  -4.331 -10.525   8.657
  816    HB3  PRO  41           HB3      PRO  41  -6.023 -10.286   8.213
  817    HG2  PRO  41           HG2      PRO  41  -4.095 -10.951   6.384
  818    HG3  PRO  41           HG3      PRO  41  -5.533  -9.992   5.965
  819    HD2  PRO  41           HD2      PRO  41  -2.733  -9.022   6.590
  820    HD3  PRO  41           HD3      PRO  41  -3.816  -8.549   5.258
  821    H    GLY  42           H        GLY  42  -2.515  -7.456   8.493
  822    HA2  GLY  42           HA2      GLY  42  -1.794  -8.295  11.177
  823    HA3  GLY  42           HA3      GLY  42  -0.780  -7.455  10.019
  824    H    VAL  43           H        VAL  43  -3.875  -6.028  10.795
  825    HA   VAL  43           HA       VAL  43  -2.630  -3.815  12.241
  826    HB   VAL  43           HB       VAL  43  -5.580  -4.219  11.517
  827   HG11  VAL  43          HG11      VAL  43  -5.295  -2.624  13.355
  828   HG12  VAL  43          HG12      VAL  43  -5.794  -1.774  11.894
  829   HG13  VAL  43          HG13      VAL  43  -4.110  -1.705  12.421
  830   HG21  VAL  43          HG21      VAL  43  -3.442  -2.648  10.001
  831   HG22  VAL  43          HG22      VAL  43  -5.167  -2.673   9.616
  832   HG23  VAL  43          HG23      VAL  43  -4.214  -4.147   9.473
  833    HA   PRO  44           HA       PRO  44  -3.593  -5.930  16.195
  834    HB2  PRO  44           HB2      PRO  44  -2.667  -3.394  17.473
  835    HB3  PRO  44           HB3      PRO  44  -2.046  -5.039  17.662
  836    HG2  PRO  44           HG2      PRO  44  -0.656  -3.190  16.289
  837    HG3  PRO  44           HG3      PRO  44  -0.685  -4.889  15.764
  838    HD2  PRO  44           HD2      PRO  44  -2.284  -2.549  14.688
  839    HD3  PRO  44           HD3      PRO  44  -1.398  -3.811  13.795
  840    H    ARG  45           H        ARG  45  -4.713  -5.153  18.385
  841    HA   ARG  45           HA       ARG  45  -7.401  -4.391  17.489
  842    HB2  ARG  45           HB2      ARG  45  -6.578  -5.492  20.211
  843    HB3  ARG  45           HB3      ARG  45  -8.199  -5.461  19.522
  844    HG2  ARG  45           HG2      ARG  45  -5.859  -7.111  18.515
  845    HG3  ARG  45           HG3      ARG  45  -7.239  -7.720  19.429
  846    HD2  ARG  45           HD2      ARG  45  -8.741  -7.310  17.590
  847    HD3  ARG  45           HD3      ARG  45  -7.517  -6.383  16.712
  848    HE   ARG  45           HE       ARG  45  -6.570  -9.002  17.176
  849   HH11  ARG  45          HH11      ARG  45  -8.929  -7.381  15.218
  850   HH12  ARG  45          HH12      ARG  45  -8.813  -8.539  13.943
  851   HH21  ARG  45          HH21      ARG  45  -6.448 -10.460  15.518
  852   HH22  ARG  45          HH22      ARG  45  -7.443 -10.266  14.119
  853    H    GLY  46           H        GLY  46  -7.821  -2.235  17.534
  854    HA2  GLY  46           HA2      GLY  46  -8.384  -0.181  18.470
  855    HA3  GLY  46           HA3      GLY  46  -7.734  -0.720  20.012
  856    H    THR  47           H        THR  47  -6.298  -0.326  16.758
  857    HA   THR  47           HA       THR  47  -3.995   1.113  17.941
  858    HB   THR  47           HB       THR  47  -4.191  -0.310  15.247
  859    HG1  THR  47           HG1      THR  47  -3.351  -1.134  17.817
  860   HG21  THR  47          HG21      THR  47  -1.721  -0.177  15.227
  861   HG22  THR  47          HG22      THR  47  -1.748   0.735  16.739
  862   HG23  THR  47          HG23      THR  47  -2.430   1.440  15.271
  863    H    GLN  48           H        GLN  48  -3.493   3.166  17.354
  864    HA   GLN  48           HA       GLN  48  -5.136   4.574  15.333
  865    HB2  GLN  48           HB2      GLN  48  -3.335   5.710  17.517
  866    HB3  GLN  48           HB3      GLN  48  -4.358   6.654  16.438
  867    HG2  GLN  48           HG2      GLN  48  -6.367   5.632  17.434
  868    HG3  GLN  48           HG3      GLN  48  -5.350   4.655  18.495
  869   HE21  GLN  48          HE21      GLN  48  -4.246   5.702  20.215
  870   HE22  GLN  48          HE22      GLN  48  -4.708   7.270  20.772
  871    H    LEU  49           H        LEU  49  -4.031   3.946  13.421
  872    HA   LEU  49           HA       LEU  49  -1.166   4.626  13.140
  873    HB2  LEU  49           HB2      LEU  49  -3.032   3.081  11.305
  874    HB3  LEU  49           HB3      LEU  49  -1.354   3.435  10.926
  875    HG   LEU  49           HG       LEU  49  -2.306   1.714  13.251
  876   HD11  LEU  49          HD11      LEU  49  -2.668   0.587  11.111
  877   HD12  LEU  49          HD12      LEU  49  -1.368  -0.189  12.010
  878   HD13  LEU  49          HD13      LEU  49  -0.986   0.872  10.652
  879   HD21  LEU  49          HD21      LEU  49   0.066   1.146  13.595
  880   HD22  LEU  49          HD22      LEU  49  -0.206   2.872  13.816
  881   HD23  LEU  49          HD23      LEU  49   0.538   2.282  12.328
  882    H    SER  50           H        SER  50  -0.607   6.530  12.317
  883    HA   SER  50           HA       SER  50  -2.391   8.336  10.964
  884    HB2  SER  50           HB2      SER  50  -0.524   9.149  12.395
  885    HB3  SER  50           HB3      SER  50   0.643   8.468  11.260
  886    HG   SER  50           HG       SER  50   0.288  10.716  10.932
  887    H    GLN  51           H        GLN  51  -1.546   9.409   8.831
  888    HA   GLN  51           HA       GLN  51  -2.033   7.831   6.636
  889    HB2  GLN  51           HB2      GLN  51  -0.264  10.305   6.741
  890    HB3  GLN  51           HB3      GLN  51  -0.965   9.640   5.269
  891    HG2  GLN  51           HG2      GLN  51  -3.213  10.159   6.055
  892    HG3  GLN  51           HG3      GLN  51  -2.574  10.716   7.603
  893   HE21  GLN  51          HE21      GLN  51  -4.127  12.169   5.535
  894   HE22  GLN  51          HE22      GLN  51  -3.176  13.554   5.144
  895    H    VAL  52           H        VAL  52   1.174   8.663   7.927
  896    HA   VAL  52           HA       VAL  52   2.701   7.348   5.878
  897    HB   VAL  52           HB       VAL  52   3.799   7.993   8.655
  898   HG11  VAL  52          HG11      VAL  52   5.887   8.467   7.402
  899   HG12  VAL  52          HG12      VAL  52   5.069   8.056   5.889
  900   HG13  VAL  52          HG13      VAL  52   5.313   6.819   7.129
  901   HG21  VAL  52          HG21      VAL  52   2.534   9.989   8.004
  902   HG22  VAL  52          HG22      VAL  52   3.354  10.033   6.443
  903   HG23  VAL  52          HG23      VAL  52   4.267  10.314   7.928
  904    H    GLU  53           H        GLU  53   1.662   6.509   9.156
  905    HA   GLU  53           HA       GLU  53   3.099   4.077   9.455
  906    HB2  GLU  53           HB2      GLU  53   0.576   5.011  10.878
  907    HB3  GLU  53           HB3      GLU  53   1.593   3.665  11.388
  908    HG2  GLU  53           HG2      GLU  53   3.497   5.287  11.677
  909    HG3  GLU  53           HG3      GLU  53   2.374   6.598  11.312
  910    H    ILE  54           H        ILE  54  -0.028   4.788   7.977
  911    HA   ILE  54           HA       ILE  54  -0.965   2.108   7.705
  912    HB   ILE  54           HB       ILE  54  -1.530   4.539   5.942
  913   HG12  ILE  54          HG12      ILE  54  -3.223   3.358   8.208
  914   HG13  ILE  54          HG13      ILE  54  -2.222   4.798   8.350
  915   HG21  ILE  54          HG21      ILE  54  -3.547   3.297   5.155
  916   HG22  ILE  54          HG22      ILE  54  -3.004   1.868   6.040
  917   HG23  ILE  54          HG23      ILE  54  -2.045   2.495   4.695
  918   HD11  ILE  54          HD11      ILE  54  -4.543   5.389   8.063
  919   HD12  ILE  54          HD12      ILE  54  -4.626   4.476   6.557
  920   HD13  ILE  54          HD13      ILE  54  -3.610   5.918   6.663
  921    H    LEU  55           H        LEU  55   0.971   4.219   5.540
  922    HA   LEU  55           HA       LEU  55   1.459   2.452   3.417
  923    HB2  LEU  55           HB2      LEU  55   3.324   4.553   4.599
  924    HB3  LEU  55           HB3      LEU  55   3.547   3.790   3.031
  925    HG   LEU  55           HG       LEU  55   1.194   5.573   3.772
  926   HD11  LEU  55          HD11      LEU  55   2.220   7.269   2.314
  927   HD12  LEU  55          HD12      LEU  55   3.622   6.225   2.064
  928   HD13  LEU  55          HD13      LEU  55   3.277   6.869   3.671
  929   HD21  LEU  55          HD21      LEU  55   1.978   4.376   1.091
  930   HD22  LEU  55          HD22      LEU  55   0.661   5.518   1.364
  931   HD23  LEU  55          HD23      LEU  55   0.587   3.908   2.074
  932    H    GLN  56           H        GLN  56   3.371   2.959   6.393
  933    HA   GLN  56           HA       GLN  56   5.375   1.029   6.080
  934    HB2  GLN  56           HB2      GLN  56   4.039   1.987   8.651
  935    HB3  GLN  56           HB3      GLN  56   5.577   1.124   8.578
  936    HG2  GLN  56           HG2      GLN  56   6.632   2.981   7.428
  937    HG3  GLN  56           HG3      GLN  56   5.088   3.815   7.269
  938   HE21  GLN  56          HE21      GLN  56   5.823   5.648   8.357
  939   HE22  GLN  56          HE22      GLN  56   6.122   5.674  10.054
  940    H    ARG  57           H        ARG  57   2.154   0.734   7.563
  941    HA   ARG  57           HA       ARG  57   2.208  -1.910   8.491
  942    HB2  ARG  57           HB2      ARG  57   0.472  -0.203   9.067
  943    HB3  ARG  57           HB3      ARG  57  -0.167  -0.309   7.437
  944    HG2  ARG  57           HG2      ARG  57  -1.660  -1.552   8.793
  945    HG3  ARG  57           HG3      ARG  57  -0.710  -2.751   7.924
  946    HD2  ARG  57           HD2      ARG  57  -0.168  -1.880  10.779
  947    HD3  ARG  57           HD3      ARG  57  -1.121  -3.297  10.337
  948    HE   ARG  57           HE       ARG  57   1.119  -3.909   9.101
  949   HH11  ARG  57          HH11      ARG  57   0.840  -2.526  12.268
  950   HH12  ARG  57          HH12      ARG  57   2.279  -3.295  12.833
  951   HH21  ARG  57          HH21      ARG  57   2.927  -4.862   9.860
  952   HH22  ARG  57          HH22      ARG  57   3.446  -4.596  11.483
  953    H    VAL  58           H        VAL  58   1.361  -0.626   5.298
  954    HA   VAL  58           HA       VAL  58   0.548  -3.100   4.097
  955    HB   VAL  58           HB       VAL  58   1.429  -0.480   2.784
  956   HG11  VAL  58          HG11      VAL  58   0.277  -1.300   0.739
  957   HG12  VAL  58          HG12      VAL  58   0.008  -2.862   1.519
  958   HG13  VAL  58          HG13      VAL  58   1.651  -2.319   1.173
  959   HG21  VAL  58          HG21      VAL  58  -0.566  -0.231   4.211
  960   HG22  VAL  58          HG22      VAL  58  -1.366  -1.551   3.358
  961   HG23  VAL  58          HG23      VAL  58  -0.991  -0.049   2.509
  962    H    ILE  59           H        ILE  59   3.648  -1.295   4.157
  963    HA   ILE  59           HA       ILE  59   5.123  -3.000   2.438
  964    HB   ILE  59           HB       ILE  59   6.177  -1.332   4.776
  965   HG12  ILE  59          HG12      ILE  59   6.033  -0.570   1.809
  966   HG13  ILE  59          HG13      ILE  59   4.893  -0.017   3.027
  967   HG21  ILE  59          HG21      ILE  59   8.364  -1.377   3.594
  968   HG22  ILE  59          HG22      ILE  59   7.685  -2.457   2.375
  969   HG23  ILE  59          HG23      ILE  59   7.842  -3.000   4.047
  970   HD11  ILE  59          HD11      ILE  59   6.529   1.687   2.528
  971   HD12  ILE  59          HD12      ILE  59   7.842   0.595   2.964
  972   HD13  ILE  59          HD13      ILE  59   6.704   1.143   4.197
  973    H    ASP  60           H        ASP  60   4.738  -3.052   6.015
  974    HA   ASP  60           HA       ASP  60   6.166  -5.367   6.666
  975    HB2  ASP  60           HB2      ASP  60   3.619  -4.260   7.923
  976    HB3  ASP  60           HB3      ASP  60   4.561  -5.567   8.634
  977    H    TYR  61           H        TYR  61   2.776  -5.016   5.649
  978    HA   TYR  61           HA       TYR  61   1.886  -7.652   5.843
  979    HB2  TYR  61           HB2      TYR  61   0.235  -5.985   5.486
  980    HB3  TYR  61           HB3      TYR  61   1.072  -5.316   4.095
  981    HD1  TYR  61           HD1      TYR  61  -0.782  -8.395   5.206
  982    HD2  TYR  61           HD2      TYR  61   0.373  -5.932   1.903
  983    HE1  TYR  61           HE1      TYR  61  -2.198  -9.729   3.714
  984    HE2  TYR  61           HE2      TYR  61  -1.052  -7.268   0.421
  985    HH   TYR  61           HH       TYR  61  -1.982  -9.587   0.370
  986    H    ILE  62           H        ILE  62   3.308  -6.010   2.984
  987    HA   ILE  62           HA       ILE  62   3.124  -8.254   1.243
  988    HB   ILE  62           HB       ILE  62   4.985  -5.839   1.007
  989   HG12  ILE  62          HG12      ILE  62   2.222  -6.258  -0.258
  990   HG13  ILE  62          HG13      ILE  62   2.522  -5.254   1.153
  991   HG21  ILE  62          HG21      ILE  62   4.091  -7.826  -1.131
  992   HG22  ILE  62          HG22      ILE  62   5.716  -7.691  -0.455
  993   HG23  ILE  62          HG23      ILE  62   5.057  -6.374  -1.421
  994   HD11  ILE  62          HD11      ILE  62   2.289  -3.907  -0.840
  995   HD12  ILE  62          HD12      ILE  62   3.607  -4.779  -1.622
  996   HD13  ILE  62          HD13      ILE  62   3.929  -3.773  -0.207
  997    H    LEU  63           H        LEU  63   5.862  -6.942   3.158
  998    HA   LEU  63           HA       LEU  63   7.804  -8.874   2.449
  999    HB2  LEU  63           HB2      LEU  63   7.573  -7.222   4.994
 1000    HB3  LEU  63           HB3      LEU  63   9.000  -8.130   4.521
 1001    HG   LEU  63           HG       LEU  63   7.841  -5.755   3.007
 1002   HD11  LEU  63          HD11      LEU  63  10.361  -5.922   4.691
 1003   HD12  LEU  63          HD12      LEU  63   8.872  -5.084   5.129
 1004   HD13  LEU  63          HD13      LEU  63   9.825  -4.520   3.759
 1005   HD21  LEU  63          HD21      LEU  63  10.368  -7.348   2.425
 1006   HD22  LEU  63          HD22      LEU  63   9.868  -5.874   1.594
 1007   HD23  LEU  63          HD23      LEU  63   8.895  -7.337   1.450
 1008    H    ASP  64           H        ASP  64   5.257  -8.939   4.876
 1009    HA   ASP  64           HA       ASP  64   6.014 -11.223   6.373
 1010    HB2  ASP  64           HB2      ASP  64   4.250  -9.542   7.032
 1011    HB3  ASP  64           HB3      ASP  64   3.200 -10.187   5.780
 1012    H    LEU  65           H        LEU  65   4.231 -10.834   3.341
 1013    HA   LEU  65           HA       LEU  65   3.545 -13.604   2.951
 1014    HB2  LEU  65           HB2      LEU  65   3.735 -11.369   0.894
 1015    HB3  LEU  65           HB3      LEU  65   2.893 -12.897   0.689
 1016    HG   LEU  65           HG       LEU  65   2.111 -10.685   2.624
 1017   HD11  LEU  65          HD11      LEU  65   1.664 -10.060   0.310
 1018   HD12  LEU  65          HD12      LEU  65   0.157 -10.349   1.178
 1019   HD13  LEU  65          HD13      LEU  65   0.771 -11.563   0.054
 1020   HD21  LEU  65          HD21      LEU  65   0.698 -13.317   2.076
 1021   HD22  LEU  65          HD22      LEU  65   0.081 -12.005   3.082
 1022   HD23  LEU  65          HD23      LEU  65   1.537 -12.874   3.565
 1023    H    GLN  66           H        GLN  66   6.195 -11.503   1.912
 1024    HA   GLN  66           HA       GLN  66   7.314 -13.297  -0.032
 1025    HB2  GLN  66           HB2      GLN  66   8.696 -10.916   1.282
 1026    HB3  GLN  66           HB3      GLN  66   9.186 -11.722  -0.203
 1027    HG2  GLN  66           HG2      GLN  66   6.716 -10.029   0.221
 1028    HG3  GLN  66           HG3      GLN  66   8.133  -9.613  -0.732
 1029   HE21  GLN  66          HE21      GLN  66   5.339  -9.721  -1.536
 1030   HE22  GLN  66          HE22      GLN  66   5.258 -10.817  -2.861
 1031    H    VAL  67           H        VAL  67   8.904 -14.797   0.148
 1032    HA   VAL  67           HA       VAL  67  10.068 -15.461   2.741
 1033    HB   VAL  67           HB       VAL  67  11.092 -17.410   1.574
 1034   HG11  VAL  67          HG11      VAL  67   8.996 -18.638   1.088
 1035   HG12  VAL  67          HG12      VAL  67   8.109 -17.112   1.046
 1036   HG13  VAL  67          HG13      VAL  67   8.857 -17.658   2.549
 1037   HG21  VAL  67          HG21      VAL  67  11.462 -16.429  -0.667
 1038   HG22  VAL  67          HG22      VAL  67   9.720 -16.367  -0.947
 1039   HG23  VAL  67          HG23      VAL  67  10.533 -17.925  -0.790
 1040    H    VAL  68           H        VAL  68  12.230 -15.254   3.279
 1041    HA   VAL  68           HA       VAL  68  13.963 -13.615   1.500
 1042    HB   VAL  68           HB       VAL  68  13.998 -13.728   4.563
 1043   HG11  VAL  68          HG11      VAL  68  15.550 -11.923   2.667
 1044   HG12  VAL  68          HG12      VAL  68  16.215 -13.231   3.645
 1045   HG13  VAL  68          HG13      VAL  68  15.549 -11.800   4.430
 1046   HG21  VAL  68          HG21      VAL  68  11.950 -12.602   3.763
 1047   HG22  VAL  68          HG22      VAL  68  12.912 -11.516   2.759
 1048   HG23  VAL  68          HG23      VAL  68  13.041 -11.438   4.517
  Start of MODEL    7
    1    H1   MET   1           H1       MET   1  25.667 -13.886   2.668
    2    H2   MET   1           H2       MET   1  26.548 -12.864   3.688
    3    H3   MET   1           H3       MET   1  25.720 -12.223   2.365
    4    HA   MET   1           HA       MET   1  24.547 -11.751   4.384
    5    HB2  MET   1           HB2      MET   1  23.144 -13.810   2.623
    6    HB3  MET   1           HB3      MET   1  22.325 -12.721   3.736
    7    HG2  MET   1           HG2      MET   1  22.103 -11.864   1.500
    8    HG3  MET   1           HG3      MET   1  23.169 -10.790   2.407
    9    HE1  MET   1           HE1      MET   1  22.866 -10.860  -0.822
   10    HE2  MET   1           HE2      MET   1  24.551 -10.685  -1.306
   11    HE3  MET   1           HE3      MET   1  23.921  -9.717   0.024
   12    H    GLY   2           H        GLY   2  24.366 -12.332   6.481
   13    HA2  GLY   2           HA2      GLY   2  24.324 -15.211   7.252
   14    HA3  GLY   2           HA3      GLY   2  24.935 -13.902   8.255
   15    H    HIS   3           H        HIS   3  21.968 -13.670   6.403
   16    HA   HIS   3           HA       HIS   3  20.473 -12.991   8.820
   17    HB2  HIS   3           HB2      HIS   3  19.565 -12.904   5.906
   18    HB3  HIS   3           HB3      HIS   3  18.778 -12.127   7.277
   19    HD2  HIS   3           HD2      HIS   3  19.789  -9.645   7.973
   20    HE1  HIS   3           HE1      HIS   3  22.937  -9.640   5.150
   21    HE2  HIS   3           HE2      HIS   3  21.530  -8.221   6.689
   22    H    HIS   4           H        HIS   4  20.682 -15.349   9.504
   23    HA   HIS   4           HA       HIS   4  18.623 -17.119   8.333
   24    HB2  HIS   4           HB2      HIS   4  19.710 -18.864   9.896
   25    HB3  HIS   4           HB3      HIS   4  20.660 -18.307   8.528
   26    HD2  HIS   4           HD2      HIS   4  20.610 -17.904  12.446
   27    HE1  HIS   4           HE1      HIS   4  24.399 -16.787  10.940
   28    HE2  HIS   4           HE2      HIS   4  23.085 -17.389  13.012
   29    H    HIS   5           H        HIS   5  17.332 -15.163   9.402
   30    HA   HIS   5           HA       HIS   5  16.561 -15.778  12.189
   31    HB2  HIS   5           HB2      HIS   5  15.986 -13.336  10.464
   32    HB3  HIS   5           HB3      HIS   5  15.400 -13.548  12.108
   33    HD2  HIS   5           HD2      HIS   5  18.686 -12.660  10.212
   34    HE1  HIS   5           HE1      HIS   5  19.354 -12.285  14.376
   35    HE2  HIS   5           HE2      HIS   5  20.335 -11.935  12.067
   36    H    HIS   6           H        HIS   6  14.967 -17.226  12.337
   37    HA   HIS   6           HA       HIS   6  12.935 -17.671  10.330
   38    HB2  HIS   6           HB2      HIS   6  12.073 -19.356  11.954
   39    HB3  HIS   6           HB3      HIS   6  13.796 -19.542  11.668
   40    HD2  HIS   6           HD2      HIS   6  11.415 -19.329  14.591
   41    HE1  HIS   6           HE1      HIS   6  15.242 -18.320  16.083
   42    HE2  HIS   6           HE2      HIS   6  12.931 -19.145  16.682
   43    H    HIS   7           H        HIS   7  10.828 -16.924  10.279
   44    HA   HIS   7           HA       HIS   7   9.354 -15.925  12.498
   45    HB2  HIS   7           HB2      HIS   7  10.950 -13.976  12.203
   46    HB3  HIS   7           HB3      HIS   7  10.312 -13.736  10.582
   47    HD2  HIS   7           HD2      HIS   7   9.234 -13.232  14.319
   48    HE1  HIS   7           HE1      HIS   7   6.418 -11.309  11.816
   49    HE2  HIS   7           HE2      HIS   7   7.233 -11.598  14.188
   50    H    HIS   8           H        HIS   8   7.190 -15.306  11.963
   51    HA   HIS   8           HA       HIS   8   6.261 -15.004   9.249
   52    HB2  HIS   8           HB2      HIS   8   4.669 -16.882   9.241
   53    HB3  HIS   8           HB3      HIS   8   6.308 -17.489   9.414
   54    HD2  HIS   8           HD2      HIS   8   6.935 -18.548  11.996
   55    HE1  HIS   8           HE1      HIS   8   2.875 -18.777  13.175
   56    HE2  HIS   8           HE2      HIS   8   5.210 -19.655  13.584
   57    H    SER   9           H        SER   9   4.160 -14.038   9.163
   58    HA   SER   9           HA       SER   9   2.952 -13.234  11.760
   59    HB2  SER   9           HB2      SER   9   4.351 -11.371  10.934
   60    HB3  SER   9           HB3      SER   9   3.504 -11.394   9.388
   61    HG   SER   9           HG       SER   9   2.567  -9.809  10.607
   62    H    HIS  10           H        HIS  10   0.731 -12.778  11.752
   63    HA   HIS  10           HA       HIS  10  -0.877 -13.178   9.316
   64    HB2  HIS  10           HB2      HIS  10  -1.363 -14.745  11.901
   65    HB3  HIS  10           HB3      HIS  10  -2.469 -14.703  10.535
   66    HD1  HIS  10           HD1      HIS  10  -1.694 -15.957   8.349
   67    HD2  HIS  10           HD2      HIS  10   0.735 -16.578  11.666
   68    HE1  HIS  10           HE1      HIS  10  -0.296 -17.951   7.801
   69    HE2  HIS  10           HE2      HIS  10   1.056 -18.392   9.866
   70    H    MET  11           H        MET  11  -1.055 -12.648  12.834
   71    HA   MET  11           HA       MET  11  -2.117 -11.254  14.222
   72    HB2  MET  11           HB2      MET  11  -2.373  -9.368  11.851
   73    HB3  MET  11           HB3      MET  11  -2.573  -8.931  13.546
   74    HG2  MET  11           HG2      MET  11  -0.027  -9.862  12.206
   75    HG3  MET  11           HG3      MET  11  -0.384  -8.236  12.799
   76    HE1  MET  11           HE1      MET  11   2.068  -8.436  14.050
   77    HE2  MET  11           HE2      MET  11   2.239 -10.110  13.515
   78    HE3  MET  11           HE3      MET  11   2.431  -9.704  15.220
   79    H    GLY  12           H        GLY  12  -4.063 -10.448  11.307
   80    HA2  GLY  12           HA2      GLY  12  -6.227 -11.087  10.733
   81    HA3  GLY  12           HA3      GLY  12  -6.318 -12.063  12.189
   82    H    GLY  13           H        GLY  13  -7.317  -9.182  10.702
   83    HA2  GLY  13           HA2      GLY  13  -9.273  -8.385  12.400
   84    HA3  GLY  13           HA3      GLY  13  -7.849  -7.629  13.108
   85    H    GLY  14           H        GLY  14  -6.667  -6.071  11.860
   86    HA2  GLY  14           HA2      GLY  14  -6.450  -4.275  10.443
   87    HA3  GLY  14           HA3      GLY  14  -7.485  -5.117   9.308
   88    H    LYS  15           H        LYS  15  -8.511  -3.184   8.717
   89    HA   LYS  15           HA       LYS  15 -10.315  -1.860   8.540
   90    HB2  LYS  15           HB2      LYS  15 -11.351  -3.171  11.087
   91    HB3  LYS  15           HB3      LYS  15 -12.313  -2.256   9.929
   92    HG2  LYS  15           HG2      LYS  15 -11.812  -3.990   8.192
   93    HG3  LYS  15           HG3      LYS  15 -10.923  -4.914   9.403
   94    HD2  LYS  15           HD2      LYS  15 -13.153  -5.868   9.148
   95    HD3  LYS  15           HD3      LYS  15 -13.016  -5.128  10.745
   96    HE2  LYS  15           HE2      LYS  15 -15.186  -4.610   9.731
   97    HE3  LYS  15           HE3      LYS  15 -14.232  -3.140   9.933
   98    HZ1  LYS  15           HZ1      LYS  15 -13.620  -3.282   7.574
   99    HZ2  LYS  15           HZ2      LYS  15 -15.297  -3.174   7.788
  100    HZ3  LYS  15           HZ3      LYS  15 -14.591  -4.662   7.402
  101    H    GLY  16           H        GLY  16 -10.580   0.289   8.910
  102    HA2  GLY  16           HA2      GLY  16 -10.312   1.503  11.538
  103    HA3  GLY  16           HA3      GLY  16  -8.983   1.852  10.441
  104    HA   PRO  17           HA       PRO  17 -12.373   4.999   9.538
  105    HB2  PRO  17           HB2      PRO  17 -11.387   7.194  10.703
  106    HB3  PRO  17           HB3      PRO  17 -12.110   5.921  11.697
  107    HG2  PRO  17           HG2      PRO  17  -9.191   6.477  11.161
  108    HG3  PRO  17           HG3      PRO  17  -9.996   6.119  12.705
  109    HD2  PRO  17           HD2      PRO  17  -8.675   4.225  11.149
  110    HD3  PRO  17           HD3      PRO  17  -9.936   3.839  12.340
  111    H    ALA  18           H        ALA  18 -11.430   7.647   8.888
  112    HA   ALA  18           HA       ALA  18  -9.844   7.307   6.475
  113    HB1  ALA  18           HB1      ALA  18 -10.886   9.825   7.817
  114    HB2  ALA  18           HB2      ALA  18 -11.702   8.912   6.546
  115    HB3  ALA  18           HB3      ALA  18 -10.180   9.732   6.199
  116    H    ALA  19           H        ALA  19  -9.474   9.339   9.372
  117    HA   ALA  19           HA       ALA  19  -7.803  10.059  10.654
  118    HB1  ALA  19           HB1      ALA  19  -6.068   8.481  11.280
  119    HB2  ALA  19           HB2      ALA  19  -6.429   7.493   9.863
  120    HB3  ALA  19           HB3      ALA  19  -7.630   7.673  11.143
  121    H    GLU  20           H        GLU  20  -7.237  11.878   9.593
  122    HA   GLU  20           HA       GLU  20  -5.005  11.971   7.697
  123    HB2  GLU  20           HB2      GLU  20  -6.626  14.207   8.994
  124    HB3  GLU  20           HB3      GLU  20  -5.495  14.398   7.654
  125    HG2  GLU  20           HG2      GLU  20  -6.910  13.151   6.163
  126    HG3  GLU  20           HG3      GLU  20  -7.950  12.629   7.489
  127    H    GLU  21           H        GLU  21  -3.334  13.867   8.242
  128    HA   GLU  21           HA       GLU  21  -2.567  14.193  10.991
  129    HB2  GLU  21           HB2      GLU  21  -0.485  12.878  10.971
  130    HB3  GLU  21           HB3      GLU  21  -1.869  11.831  10.698
  131    HG2  GLU  21           HG2      GLU  21  -1.361  11.629   8.358
  132    HG3  GLU  21           HG3      GLU  21  -0.121  12.880   8.456
  133    HA   PRO  22           HA       PRO  22   0.050  17.433   9.100
  134    HB2  PRO  22           HB2      PRO  22   2.011  17.758  10.994
  135    HB3  PRO  22           HB3      PRO  22   0.362  18.357  11.211
  136    HG2  PRO  22           HG2      PRO  22   1.603  15.815  12.255
  137    HG3  PRO  22           HG3      PRO  22   0.592  17.000  13.113
  138    HD2  PRO  22           HD2      PRO  22  -0.438  14.687  12.141
  139    HD3  PRO  22           HD3      PRO  22  -1.391  16.188  12.172
  140    H    LEU  23           H        LEU  23   1.115  16.802   7.313
  141    HA   LEU  23           HA       LEU  23   3.106  14.671   7.275
  142    HB2  LEU  23           HB2      LEU  23   2.095  16.444   5.019
  143    HB3  LEU  23           HB3      LEU  23   3.038  14.974   4.836
  144    HG   LEU  23           HG       LEU  23   0.184  15.134   5.893
  145   HD11  LEU  23          HD11      LEU  23   0.303  15.494   3.469
  146   HD12  LEU  23          HD12      LEU  23  -0.460  13.949   3.843
  147   HD13  LEU  23          HD13      LEU  23   1.214  13.992   3.279
  148   HD21  LEU  23          HD21      LEU  23   0.210  12.658   5.879
  149   HD22  LEU  23          HD22      LEU  23   1.371  13.319   7.027
  150   HD23  LEU  23          HD23      LEU  23   1.932  12.682   5.479
  151    H    SER  24           H        SER  24   3.288  17.875   8.066
  152    HA   SER  24           HA       SER  24   5.618  18.718   6.587
  153    HB2  SER  24           HB2      SER  24   4.255  20.022   8.983
  154    HB3  SER  24           HB3      SER  24   5.468  20.783   7.949
  155    HG   SER  24           HG       SER  24   3.608  19.922   6.319
  156    H    LEU  25           H        LEU  25   6.926  16.816   7.249
  157    HA   LEU  25           HA       LEU  25   8.634  17.459   9.589
  158    HB2  LEU  25           HB2      LEU  25   7.824  14.641   8.733
  159    HB3  LEU  25           HB3      LEU  25   8.972  15.022  10.005
  160    HG   LEU  25           HG       LEU  25   5.999  15.686  10.100
  161   HD11  LEU  25          HD11      LEU  25   6.359  13.262  10.198
  162   HD12  LEU  25          HD12      LEU  25   5.809  13.882  11.752
  163   HD13  LEU  25          HD13      LEU  25   7.510  13.472  11.521
  164   HD21  LEU  25          HD21      LEU  25   8.122  15.921  12.267
  165   HD22  LEU  25          HD22      LEU  25   6.393  16.210  12.474
  166   HD23  LEU  25          HD23      LEU  25   7.337  17.267  11.429
  167    H    LEU  26           H        LEU  26   8.680  14.917   7.099
  168    HA   LEU  26           HA       LEU  26  10.667  16.211   5.418
  169    HB2  LEU  26           HB2      LEU  26  11.920  15.012   7.305
  170    HB3  LEU  26           HB3      LEU  26  11.285  13.505   6.688
  171    HG   LEU  26           HG       LEU  26  12.741  15.063   4.616
  172   HD11  LEU  26          HD11      LEU  26  15.015  14.693   5.438
  173   HD12  LEU  26          HD12      LEU  26  14.380  14.110   6.980
  174   HD13  LEU  26          HD13      LEU  26  14.123  15.786   6.495
  175   HD21  LEU  26          HD21      LEU  26  13.833  12.920   4.152
  176   HD22  LEU  26          HD22      LEU  26  12.088  12.722   4.282
  177   HD23  LEU  26          HD23      LEU  26  13.130  12.223   5.615
  178    H    ASP  27           H        ASP  27  11.135  14.317   3.554
  179    HA   ASP  27           HA       ASP  27   8.645  13.521   2.423
  180    HB2  ASP  27           HB2      ASP  27  11.541  12.945   1.692
  181    HB3  ASP  27           HB3      ASP  27  10.185  12.366   0.727
  182    H    ASP  28           H        ASP  28   8.681  12.291   4.957
  183    HA   ASP  28           HA       ASP  28   9.605   9.647   5.088
  184    HB2  ASP  28           HB2      ASP  28   7.191  10.889   6.470
  185    HB3  ASP  28           HB3      ASP  28   8.002   9.406   6.969
  186    H    MET  29           H        MET  29   6.475  10.957   3.950
  187    HA   MET  29           HA       MET  29   5.231   8.496   3.313
  188    HB2  MET  29           HB2      MET  29   4.796  11.138   1.860
  189    HB3  MET  29           HB3      MET  29   3.693   9.769   1.911
  190    HG2  MET  29           HG2      MET  29   3.730  10.207   4.505
  191    HG3  MET  29           HG3      MET  29   4.287  11.808   4.023
  192    HE1  MET  29           HE1      MET  29   0.185   9.944   3.112
  193    HE2  MET  29           HE2      MET  29   1.425   9.258   4.176
  194    HE3  MET  29           HE3      MET  29   1.656   9.260   2.426
  195    H    ASN  30           H        ASN  30   7.329  10.642   1.401
  196    HA   ASN  30           HA       ASN  30   7.086   9.279  -1.093
  197    HB2  ASN  30           HB2      ASN  30   7.771  11.657  -0.913
  198    HB3  ASN  30           HB3      ASN  30   9.264  11.175  -0.118
  199   HD21  ASN  30          HD21      ASN  30   7.524  11.218  -3.151
  200   HD22  ASN  30          HD22      ASN  30   8.886  10.905  -4.159
  201    H    HIS  31           H        HIS  31   9.252   8.887   1.662
  202    HA   HIS  31           HA       HIS  31  11.093   7.033   0.504
  203    HB2  HIS  31           HB2      HIS  31  10.299   7.526   3.403
  204    HB3  HIS  31           HB3      HIS  31  11.583   6.415   2.931
  205    HD2  HIS  31           HD2      HIS  31  11.845   9.580   0.826
  206    HE1  HIS  31           HE1      HIS  31  14.369  10.089   4.169
  207    HE2  HIS  31           HE2      HIS  31  13.612  11.067   1.969
  208    H    CYS  32           H        CYS  32   8.039   6.646   2.305
  209    HA   CYS  32           HA       CYS  32   7.915   3.797   2.221
  210    HB2  CYS  32           HB2      CYS  32   5.678   5.846   2.477
  211    HB3  CYS  32           HB3      CYS  32   5.487   4.112   2.743
  212    HG   CYS  32           HG       CYS  32   7.745   5.883   4.582
  213    H    TYR  33           H        TYR  33   6.809   6.325   0.020
  214    HA   TYR  33           HA       TYR  33   5.249   4.681  -1.710
  215    HB2  TYR  33           HB2      TYR  33   6.215   7.533  -1.815
  216    HB3  TYR  33           HB3      TYR  33   5.559   6.812  -3.278
  217    HD1  TYR  33           HD1      TYR  33   3.328   5.197  -2.360
  218    HD2  TYR  33           HD2      TYR  33   4.561   9.059  -0.992
  219    HE1  TYR  33           HE1      TYR  33   1.033   5.695  -1.699
  220    HE2  TYR  33           HE2      TYR  33   2.249   9.546  -0.314
  221    HH   TYR  33           HH       TYR  33   0.004   8.831  -0.809
  222    H    SER  34           H        SER  34   8.599   5.858  -1.846
  223    HA   SER  34           HA       SER  34   9.237   4.931  -4.452
  224    HB2  SER  34           HB2      SER  34  11.615   5.138  -3.739
  225    HB3  SER  34           HB3      SER  34  10.678   6.554  -3.262
  226    HG   SER  34           HG       SER  34  11.975   4.717  -1.703
  227    H    ARG  35           H        ARG  35   9.491   3.457  -1.235
  228    HA   ARG  35           HA       ARG  35  10.565   0.968  -1.957
  229    HB2  ARG  35           HB2      ARG  35  10.433   2.005   0.336
  230    HB3  ARG  35           HB3      ARG  35   8.740   1.509   0.395
  231    HG2  ARG  35           HG2      ARG  35   9.323  -0.808   0.318
  232    HG3  ARG  35           HG3      ARG  35  10.994  -0.447  -0.120
  233    HD2  ARG  35           HD2      ARG  35  11.348   0.590   2.080
  234    HD3  ARG  35           HD3      ARG  35   9.678   0.214   2.508
  235    HE   ARG  35           HE       ARG  35  10.953  -2.154   1.729
  236   HH11  ARG  35          HH11      ARG  35  11.018   0.039   4.407
  237   HH12  ARG  35          HH12      ARG  35  11.678  -1.145   5.472
  238   HH21  ARG  35          HH21      ARG  35  11.807  -3.629   3.120
  239   HH22  ARG  35          HH22      ARG  35  12.115  -3.177   4.762
  240    H    LEU  36           H        LEU  36   7.163   2.059  -1.685
  241    HA   LEU  36           HA       LEU  36   5.900  -0.391  -2.282
  242    HB2  LEU  36           HB2      LEU  36   4.989   2.473  -2.733
  243    HB3  LEU  36           HB3      LEU  36   3.960   1.090  -3.083
  244    HG   LEU  36           HG       LEU  36   5.058   1.793  -0.329
  245   HD11  LEU  36          HD11      LEU  36   2.246   2.102  -1.416
  246   HD12  LEU  36          HD12      LEU  36   3.370   3.412  -1.055
  247   HD13  LEU  36          HD13      LEU  36   2.753   2.403   0.252
  248   HD21  LEU  36          HD21      LEU  36   4.751  -0.635  -0.579
  249   HD22  LEU  36          HD22      LEU  36   3.095  -0.386  -1.139
  250   HD23  LEU  36          HD23      LEU  36   3.544   0.035   0.515
  251    H    ARG  37           H        ARG  37   7.016   2.217  -4.478
  252    HA   ARG  37           HA       ARG  37   6.215   1.209  -6.961
  253    HB2  ARG  37           HB2      ARG  37   8.721   2.763  -6.259
  254    HB3  ARG  37           HB3      ARG  37   8.191   2.459  -7.908
  255    HG2  ARG  37           HG2      ARG  37   6.153   3.772  -7.534
  256    HG3  ARG  37           HG3      ARG  37   6.592   4.000  -5.839
  257    HD2  ARG  37           HD2      ARG  37   8.646   5.198  -6.565
  258    HD3  ARG  37           HD3      ARG  37   8.125   5.034  -8.243
  259    HE   ARG  37           HE       ARG  37   6.025   6.291  -7.241
  260   HH11  ARG  37          HH11      ARG  37   9.376   7.047  -6.765
  261   HH12  ARG  37          HH12      ARG  37   9.057   8.719  -6.481
  262   HH21  ARG  37          HH21      ARG  37   5.664   8.429  -6.881
  263   HH22  ARG  37          HH22      ARG  37   6.985   9.485  -6.526
  264    H    GLU  38           H        GLU  38   8.751   0.122  -4.870
  265    HA   GLU  38           HA       GLU  38  10.147  -1.494  -6.868
  266    HB2  GLU  38           HB2      GLU  38  10.608  -1.110  -3.876
  267    HB3  GLU  38           HB3      GLU  38  11.646  -2.070  -4.924
  268    HG2  GLU  38           HG2      GLU  38  12.258  -0.074  -6.214
  269    HG3  GLU  38           HG3      GLU  38  11.140   0.905  -5.270
  270    H    LEU  39           H        LEU  39   7.874  -1.871  -4.199
  271    HA   LEU  39           HA       LEU  39   7.984  -4.782  -4.159
  272    HB2  LEU  39           HB2      LEU  39   6.173  -2.866  -2.653
  273    HB3  LEU  39           HB3      LEU  39   6.268  -4.598  -2.373
  274    HG   LEU  39           HG       LEU  39   8.475  -2.568  -1.848
  275   HD11  LEU  39          HD11      LEU  39   8.190  -3.151   0.517
  276   HD12  LEU  39          HD12      LEU  39   6.846  -4.216   0.096
  277   HD13  LEU  39          HD13      LEU  39   6.713  -2.477  -0.171
  278   HD21  LEU  39          HD21      LEU  39   9.791  -4.420  -0.910
  279   HD22  LEU  39          HD22      LEU  39   9.489  -4.656  -2.627
  280   HD23  LEU  39          HD23      LEU  39   8.563  -5.574  -1.437
  281    H    VAL  40           H        VAL  40   6.254  -2.487  -6.004
  282    HA   VAL  40           HA       VAL  40   4.119  -4.419  -6.700
  283    HB   VAL  40           HB       VAL  40   4.359  -1.512  -7.615
  284   HG11  VAL  40          HG11      VAL  40   2.017  -3.451  -7.830
  285   HG12  VAL  40          HG12      VAL  40   3.014  -2.868  -9.165
  286   HG13  VAL  40          HG13      VAL  40   1.977  -1.745  -8.286
  287   HG21  VAL  40          HG21      VAL  40   2.663  -2.671  -5.366
  288   HG22  VAL  40          HG22      VAL  40   2.577  -1.011  -5.961
  289   HG23  VAL  40          HG23      VAL  40   4.053  -1.592  -5.187
  290    HA   PRO  41           HA       PRO  41   6.973  -5.386 -10.214
  291    HB2  PRO  41           HB2      PRO  41   5.187  -7.745 -10.546
  292    HB3  PRO  41           HB3      PRO  41   6.931  -7.702 -10.266
  293    HG2  PRO  41           HG2      PRO  41   5.193  -8.512  -8.345
  294    HG3  PRO  41           HG3      PRO  41   6.688  -7.635  -7.953
  295    HD2  PRO  41           HD2      PRO  41   3.865  -6.589  -8.126
  296    HD3  PRO  41           HD3      PRO  41   5.117  -6.257  -6.908
  297    H    GLY  42           H        GLY  42   3.423  -5.321 -10.212
  298    HA2  GLY  42           HA2      GLY  42   3.115  -5.454 -13.096
  299    HA3  GLY  42           HA3      GLY  42   1.843  -5.236 -11.910
  300    H    VAL  43           H        VAL  43   4.634  -3.487 -13.242
  301    HA   VAL  43           HA       VAL  43   3.025  -1.022 -13.537
  302    HB   VAL  43           HB       VAL  43   5.888  -1.179 -12.462
  303   HG11  VAL  43          HG11      VAL  43   5.793   1.288 -12.242
  304   HG12  VAL  43          HG12      VAL  43   4.232   1.298 -13.068
  305   HG13  VAL  43          HG13      VAL  43   5.680   0.767 -13.923
  306   HG21  VAL  43          HG21      VAL  43   3.349  -0.240 -11.065
  307   HG22  VAL  43          HG22      VAL  43   4.982  -0.147 -10.401
  308   HG23  VAL  43          HG23      VAL  43   4.252  -1.719 -10.718
  309    HA   PRO  44           HA       PRO  44   4.983  -1.171 -17.715
  310    HB2  PRO  44           HB2      PRO  44   3.826   1.580 -17.947
  311    HB3  PRO  44           HB3      PRO  44   3.609   0.177 -19.001
  312    HG2  PRO  44           HG2      PRO  44   1.628   1.015 -17.381
  313    HG3  PRO  44           HG3      PRO  44   1.895  -0.718 -17.682
  314    HD2  PRO  44           HD2      PRO  44   2.714   0.945 -15.296
  315    HD3  PRO  44           HD3      PRO  44   1.991  -0.680 -15.332
  316    H    ARG  45           H        ARG  45   7.132  -0.768 -17.860
  317    HA   ARG  45           HA       ARG  45   8.474   0.906 -15.961
  318    HB2  ARG  45           HB2      ARG  45   9.305  -1.316 -16.869
  319    HB3  ARG  45           HB3      ARG  45   9.677  -0.499 -18.380
  320    HG2  ARG  45           HG2      ARG  45  11.275   0.974 -17.170
  321    HG3  ARG  45           HG3      ARG  45  10.908   0.116 -15.673
  322    HD2  ARG  45           HD2      ARG  45  11.725  -2.000 -16.753
  323    HD3  ARG  45           HD3      ARG  45  12.218  -1.041 -18.154
  324    HE   ARG  45           HE       ARG  45  13.319  -0.081 -15.683
  325   HH11  ARG  45          HH11      ARG  45  13.841  -2.353 -18.243
  326   HH12  ARG  45          HH12      ARG  45  15.523  -2.506 -17.890
  327   HH21  ARG  45          HH21      ARG  45  15.454  -0.304 -15.258
  328   HH22  ARG  45          HH22      ARG  45  16.421  -1.369 -16.214
  329    H    GLY  46           H        GLY  46   8.395   3.086 -16.203
  330    HA2  GLY  46           HA2      GLY  46   9.388   5.035 -17.262
  331    HA3  GLY  46           HA3      GLY  46   9.042   4.328 -18.832
  332    H    THR  47           H        THR  47   6.815   4.462 -16.085
  333    HA   THR  47           HA       THR  47   5.039   6.321 -17.572
  334    HB   THR  47           HB       THR  47   4.246   4.434 -15.291
  335    HG1  THR  47           HG1      THR  47   4.975   3.350 -17.255
  336   HG21  THR  47          HG21      THR  47   2.643   6.312 -15.618
  337   HG22  THR  47          HG22      THR  47   1.930   4.772 -16.100
  338   HG23  THR  47          HG23      THR  47   2.510   5.897 -17.331
  339    H    GLN  48           H        GLN  48   3.913   6.432 -14.398
  340    HA   GLN  48           HA       GLN  48   5.592   8.761 -13.679
  341    HB2  GLN  48           HB2      GLN  48   2.538   8.691 -13.728
  342    HB3  GLN  48           HB3      GLN  48   3.502  10.003 -13.058
  343    HG2  GLN  48           HG2      GLN  48   4.412  10.509 -15.265
  344    HG3  GLN  48           HG3      GLN  48   3.544   9.140 -15.961
  345   HE21  GLN  48          HE21      GLN  48   3.398  12.038 -16.567
  346   HE22  GLN  48          HE22      GLN  48   1.729  12.440 -16.416
  347    H    LEU  49           H        LEU  49   2.605   7.381 -12.258
  348    HA   LEU  49           HA       LEU  49   2.023   6.856 -10.145
  349    HB2  LEU  49           HB2      LEU  49   4.706   5.443 -10.030
  350    HB3  LEU  49           HB3      LEU  49   3.298   5.103  -9.040
  351    HG   LEU  49           HG       LEU  49   3.720   4.462 -11.970
  352   HD11  LEU  49          HD11      LEU  49   3.198   2.170 -11.264
  353   HD12  LEU  49          HD12      LEU  49   2.997   2.722  -9.601
  354   HD13  LEU  49          HD13      LEU  49   4.576   2.824 -10.381
  355   HD21  LEU  49          HD21      LEU  49   1.067   4.368 -10.496
  356   HD22  LEU  49          HD22      LEU  49   1.384   3.657 -12.080
  357   HD23  LEU  49          HD23      LEU  49   1.475   5.403 -11.874
  358    H    SER  50           H        SER  50   2.305   9.223  -9.698
  359    HA   SER  50           HA       SER  50   4.639  10.108  -8.240
  360    HB2  SER  50           HB2      SER  50   3.402  11.652  -9.734
  361    HB3  SER  50           HB3      SER  50   1.982  11.535  -8.694
  362    HG   SER  50           HG       SER  50   4.374  12.905  -8.318
  363    H    GLN  51           H        GLN  51   1.162  10.092  -7.260
  364    HA   GLN  51           HA       GLN  51   1.990   9.621  -4.441
  365    HB2  GLN  51           HB2      GLN  51  -0.189  11.553  -5.361
  366    HB3  GLN  51           HB3      GLN  51   0.304  11.261  -3.696
  367    HG2  GLN  51           HG2      GLN  51   2.444  12.316  -4.075
  368    HG3  GLN  51           HG3      GLN  51   2.133  12.437  -5.808
  369   HE21  GLN  51          HE21      GLN  51   1.356  13.766  -2.669
  370   HE22  GLN  51          HE22      GLN  51   0.583  15.193  -3.251
  371    H    VAL  52           H        VAL  52  -1.182  10.075  -6.010
  372    HA   VAL  52           HA       VAL  52  -2.417   8.017  -4.427
  373    HB   VAL  52           HB       VAL  52  -3.802   9.267  -6.830
  374   HG11  VAL  52          HG11      VAL  52  -5.005   7.551  -5.564
  375   HG12  VAL  52          HG12      VAL  52  -5.789   9.119  -5.366
  376   HG13  VAL  52          HG13      VAL  52  -4.785   8.463  -4.068
  377   HG21  VAL  52          HG21      VAL  52  -4.442  11.233  -5.476
  378   HG22  VAL  52          HG22      VAL  52  -2.699  11.171  -5.747
  379   HG23  VAL  52          HG23      VAL  52  -3.365  10.692  -4.183
  380    H    GLU  53           H        GLU  53  -1.366   8.307  -7.755
  381    HA   GLU  53           HA       GLU  53  -2.443   6.126  -9.061
  382    HB2  GLU  53           HB2      GLU  53   0.412   7.175  -9.282
  383    HB3  GLU  53           HB3      GLU  53  -0.406   6.199 -10.498
  384    HG2  GLU  53           HG2      GLU  53  -1.877   7.980 -11.092
  385    HG3  GLU  53           HG3      GLU  53  -1.458   8.912  -9.655
  386    H    ILE  54           H        ILE  54   0.376   6.205  -6.910
  387    HA   ILE  54           HA       ILE  54   1.195   3.506  -7.067
  388    HB   ILE  54           HB       ILE  54   1.429   5.489  -4.755
  389   HG12  ILE  54          HG12      ILE  54   3.471   4.754  -6.917
  390   HG13  ILE  54          HG13      ILE  54   2.515   6.231  -6.889
  391   HG21  ILE  54          HG21      ILE  54   1.746   3.219  -3.894
  392   HG22  ILE  54          HG22      ILE  54   3.285   4.074  -3.906
  393   HG23  ILE  54          HG23      ILE  54   2.937   2.872  -5.153
  394   HD11  ILE  54          HD11      ILE  54   4.765   6.638  -6.140
  395   HD12  ILE  54          HD12      ILE  54   4.600   5.427  -4.871
  396   HD13  ILE  54          HD13      ILE  54   3.630   6.902  -4.815
  397    H    LEU  55           H        LEU  55  -0.898   5.143  -4.635
  398    HA   LEU  55           HA       LEU  55  -1.585   3.043  -2.986
  399    HB2  LEU  55           HB2      LEU  55  -3.318   5.381  -3.859
  400    HB3  LEU  55           HB3      LEU  55  -3.693   4.337  -2.500
  401    HG   LEU  55           HG       LEU  55  -1.246   6.138  -2.684
  402   HD11  LEU  55          HD11      LEU  55  -2.357   7.518  -0.967
  403   HD12  LEU  55          HD12      LEU  55  -3.792   6.492  -1.062
  404   HD13  LEU  55          HD13      LEU  55  -3.302   7.460  -2.455
  405   HD21  LEU  55          HD21      LEU  55  -0.807   4.136  -1.334
  406   HD22  LEU  55          HD22      LEU  55  -2.262   4.437  -0.379
  407   HD23  LEU  55          HD23      LEU  55  -0.907   5.565  -0.308
  408    H    GLN  56           H        GLN  56  -3.323   4.072  -5.912
  409    HA   GLN  56           HA       GLN  56  -5.439   2.232  -5.889
  410    HB2  GLN  56           HB2      GLN  56  -4.080   3.612  -8.241
  411    HB3  GLN  56           HB3      GLN  56  -5.625   2.773  -8.342
  412    HG2  GLN  56           HG2      GLN  56  -6.653   4.385  -6.817
  413    HG3  GLN  56           HG3      GLN  56  -5.099   5.177  -6.560
  414   HE21  GLN  56          HE21      GLN  56  -5.999   7.167  -7.262
  415   HE22  GLN  56          HE22      GLN  56  -6.306   7.484  -8.928
  416    H    ARG  57           H        ARG  57  -2.219   1.978  -7.461
  417    HA   ARG  57           HA       ARG  57  -2.683  -0.635  -8.575
  418    HB2  ARG  57           HB2      ARG  57  -0.118   0.954  -8.232
  419    HB3  ARG  57           HB3      ARG  57  -0.195  -0.612  -9.035
  420    HG2  ARG  57           HG2      ARG  57  -1.881   0.425 -10.641
  421    HG3  ARG  57           HG3      ARG  57  -1.464   1.987  -9.931
  422    HD2  ARG  57           HD2      ARG  57   0.888   1.661 -10.571
  423    HD3  ARG  57           HD3      ARG  57   0.497   0.086 -11.272
  424    HE   ARG  57           HE       ARG  57  -0.445   2.705 -12.282
  425   HH11  ARG  57          HH11      ARG  57   0.258  -0.626 -12.884
  426   HH12  ARG  57          HH12      ARG  57   0.006  -0.476 -14.585
  427   HH21  ARG  57          HH21      ARG  57  -0.749   2.877 -14.456
  428   HH22  ARG  57          HH22      ARG  57  -0.543   1.494 -15.472
  429    H    VAL  58           H        VAL  58  -1.452   0.463  -5.477
  430    HA   VAL  58           HA       VAL  58  -0.270  -2.022  -4.669
  431    HB   VAL  58           HB       VAL  58  -1.276   0.332  -3.001
  432   HG11  VAL  58          HG11      VAL  58  -0.032  -0.650  -1.092
  433   HG12  VAL  58          HG12      VAL  58   0.307  -2.089  -2.060
  434   HG13  VAL  58          HG13      VAL  58  -1.354  -1.690  -1.621
  435   HG21  VAL  58          HG21      VAL  58   1.563  -0.515  -3.721
  436   HG22  VAL  58          HG22      VAL  58   1.123   0.872  -2.719
  437   HG23  VAL  58          HG23      VAL  58   0.684   0.842  -4.424
  438    H    ILE  59           H        ILE  59  -3.491  -0.549  -4.158
  439    HA   ILE  59           HA       ILE  59  -4.745  -2.658  -2.752
  440    HB   ILE  59           HB       ILE  59  -5.964  -0.683  -4.736
  441   HG12  ILE  59          HG12      ILE  59  -5.848  -0.486  -1.689
  442   HG13  ILE  59          HG13      ILE  59  -4.742   0.347  -2.773
  443   HG21  ILE  59          HG21      ILE  59  -8.126  -1.095  -3.588
  444   HG22  ILE  59          HG22      ILE  59  -7.364  -2.346  -2.605
  445   HG23  ILE  59          HG23      ILE  59  -7.505  -2.558  -4.349
  446   HD11  ILE  59          HD11      ILE  59  -6.601   1.595  -3.724
  447   HD12  ILE  59          HD12      ILE  59  -6.481   1.812  -1.979
  448   HD13  ILE  59          HD13      ILE  59  -7.719   0.752  -2.648
  449    H    ASP  60           H        ASP  60  -4.599  -1.951  -6.244
  450    HA   ASP  60           HA       ASP  60  -5.940  -4.173  -7.290
  451    HB2  ASP  60           HB2      ASP  60  -5.400  -2.186  -8.610
  452    HB3  ASP  60           HB3      ASP  60  -3.678  -2.485  -8.426
  453    H    TYR  61           H        TYR  61  -2.538  -3.803  -6.374
  454    HA   TYR  61           HA       TYR  61  -1.495  -6.267  -7.278
  455    HB2  TYR  61           HB2      TYR  61   0.057  -4.532  -6.711
  456    HB3  TYR  61           HB3      TYR  61  -0.635  -4.315  -5.113
  457    HD1  TYR  61           HD1      TYR  61   1.329  -6.774  -7.180
  458    HD2  TYR  61           HD2      TYR  61   0.356  -5.407  -3.239
  459    HE1  TYR  61           HE1      TYR  61   3.063  -8.235  -6.239
  460    HE2  TYR  61           HE2      TYR  61   2.104  -6.865  -2.311
  461    HH   TYR  61           HH       TYR  61   3.330  -8.890  -2.903
  462    H    ILE  62           H        ILE  62  -2.708  -5.338  -4.029
  463    HA   ILE  62           HA       ILE  62  -2.290  -7.872  -2.812
  464    HB   ILE  62           HB       ILE  62  -4.191  -5.649  -1.935
  465   HG12  ILE  62          HG12      ILE  62  -1.310  -6.172  -1.028
  466   HG13  ILE  62          HG13      ILE  62  -1.787  -4.907  -2.150
  467   HG21  ILE  62          HG21      ILE  62  -3.044  -7.967  -0.328
  468   HG22  ILE  62          HG22      ILE  62  -4.728  -7.775  -0.822
  469   HG23  ILE  62          HG23      ILE  62  -4.016  -6.648   0.330
  470   HD11  ILE  62          HD11      ILE  62  -2.605  -5.107   0.751
  471   HD12  ILE  62          HD12      ILE  62  -3.110  -3.840  -0.373
  472   HD13  ILE  62          HD13      ILE  62  -1.410  -4.007   0.065
  473    H    LEU  63           H        LEU  63  -5.227  -6.378  -4.217
  474    HA   LEU  63           HA       LEU  63  -7.068  -8.458  -3.808
  475    HB2  LEU  63           HB2      LEU  63  -6.895  -6.324  -5.956
  476    HB3  LEU  63           HB3      LEU  63  -8.249  -7.438  -5.856
  477    HG   LEU  63           HG       LEU  63  -7.464  -5.446  -3.688
  478   HD11  LEU  63          HD11      LEU  63  -9.512  -4.233  -4.325
  479   HD12  LEU  63          HD12      LEU  63  -9.775  -5.369  -5.652
  480   HD13  LEU  63          HD13      LEU  63  -8.363  -4.309  -5.661
  481   HD21  LEU  63          HD21      LEU  63  -9.587  -6.081  -2.614
  482   HD22  LEU  63          HD22      LEU  63  -8.504  -7.463  -2.742
  483   HD23  LEU  63          HD23      LEU  63  -9.862  -7.306  -3.859
  484    H    ASP  64           H        ASP  64  -4.701  -7.988  -6.414
  485    HA   ASP  64           HA       ASP  64  -5.529 -10.089  -8.124
  486    HB2  ASP  64           HB2      ASP  64  -3.949  -8.254  -8.764
  487    HB3  ASP  64           HB3      ASP  64  -2.718  -8.974  -7.736
  488    H    LEU  65           H        LEU  65  -3.390 -10.035  -5.298
  489    HA   LEU  65           HA       LEU  65  -2.513 -12.773  -5.452
  490    HB2  LEU  65           HB2      LEU  65  -2.541 -10.916  -3.041
  491    HB3  LEU  65           HB3      LEU  65  -1.601 -12.391  -3.201
  492    HG   LEU  65           HG       LEU  65  -1.203  -9.835  -4.799
  493   HD11  LEU  65          HD11      LEU  65  -0.419  -9.617  -2.502
  494   HD12  LEU  65          HD12      LEU  65   0.942  -9.656  -3.620
  495   HD13  LEU  65          HD13      LEU  65   0.545 -11.088  -2.667
  496   HD21  LEU  65          HD21      LEU  65   0.796 -10.934  -5.762
  497   HD22  LEU  65          HD22      LEU  65  -0.698 -11.745  -6.228
  498   HD23  LEU  65          HD23      LEU  65   0.333 -12.449  -4.979
  499    H    GLN  66           H        GLN  66  -5.057 -11.078  -3.701
  500    HA   GLN  66           HA       GLN  66  -6.054 -13.384  -2.257
  501    HB2  GLN  66           HB2      GLN  66  -7.185 -10.578  -2.628
  502    HB3  GLN  66           HB3      GLN  66  -7.844 -11.783  -1.523
  503    HG2  GLN  66           HG2      GLN  66  -5.829 -11.723  -0.168
  504    HG3  GLN  66           HG3      GLN  66  -5.028 -10.665  -1.329
  505   HE21  GLN  66          HE21      GLN  66  -5.566 -10.223   1.529
  506   HE22  GLN  66          HE22      GLN  66  -6.482  -8.765   1.618
  507    H    VAL  67           H        VAL  67  -8.600 -13.674  -2.380
  508    HA   VAL  67           HA       VAL  67  -9.316 -14.284  -5.176
  509    HB   VAL  67           HB       VAL  67 -10.734 -15.104  -2.598
  510   HG11  VAL  67          HG11      VAL  67 -11.107 -16.139  -5.433
  511   HG12  VAL  67          HG12      VAL  67 -12.248 -15.143  -4.531
  512   HG13  VAL  67          HG13      VAL  67 -11.899 -16.784  -3.990
  513   HG21  VAL  67          HG21      VAL  67  -8.791 -16.715  -4.304
  514   HG22  VAL  67          HG22      VAL  67  -9.694 -17.330  -2.916
  515   HG23  VAL  67          HG23      VAL  67  -8.475 -16.078  -2.688
  516    H    VAL  68           H        VAL  68 -10.434 -12.763  -6.267
  517    HA   VAL  68           HA       VAL  68 -12.385 -11.001  -4.884
  518    HB   VAL  68           HB       VAL  68 -11.053 -10.629  -7.616
  519   HG11  VAL  68          HG11      VAL  68 -12.866  -8.723  -6.080
  520   HG12  VAL  68          HG12      VAL  68 -13.264  -9.563  -7.578
  521   HG13  VAL  68          HG13      VAL  68 -12.002  -8.333  -7.569
  522   HG21  VAL  68          HG21      VAL  68  -9.435 -10.359  -5.781
  523   HG22  VAL  68          HG22      VAL  68 -10.499  -9.203  -4.980
  524   HG23  VAL  68          HG23      VAL  68  -9.771  -8.800  -6.536
  525    H1   MET   1           H1       MET   1  26.193  13.808   6.743
  526    H2   MET   1           H2       MET   1  27.262  12.588   7.204
  527    H3   MET   1           H3       MET   1  27.217  13.099   5.597
  528    HA   MET   1           HA       MET   1  28.001  15.286   6.228
  529    HB2  MET   1           HB2      MET   1  28.322  14.085   9.014
  530    HB3  MET   1           HB3      MET   1  28.781  15.712   8.520
  531    HG2  MET   1           HG2      MET   1  25.977  14.600   8.748
  532    HG3  MET   1           HG3      MET   1  26.720  15.856   9.743
  533    HE1  MET   1           HE1      MET   1  23.841  16.061   8.178
  534    HE2  MET   1           HE2      MET   1  23.918  17.722   7.592
  535    HE3  MET   1           HE3      MET   1  24.446  17.342   9.230
  536    H    GLY   2           H        GLY   2  28.954  12.015   6.416
  537    HA2  GLY   2           HA2      GLY   2  30.909  10.935   5.879
  538    HA3  GLY   2           HA3      GLY   2  31.631  12.489   5.487
  539    H    HIS   3           H        HIS   3  32.969  13.466   6.963
  540    HA   HIS   3           HA       HIS   3  33.125  12.919   9.755
  541    HB2  HIS   3           HB2      HIS   3  34.111  10.763   8.798
  542    HB3  HIS   3           HB3      HIS   3  35.415  11.720   8.114
  543    HD2  HIS   3           HD2      HIS   3  37.363  12.562   9.950
  544    HE1  HIS   3           HE1      HIS   3  35.763  10.356  13.188
  545    HE2  HIS   3           HE2      HIS   3  37.650  11.852  12.425
  546    H    HIS   4           H        HIS   4  34.994  13.820   6.873
  547    HA   HIS   4           HA       HIS   4  36.435  15.966   8.291
  548    HB2  HIS   4           HB2      HIS   4  36.801  14.960   5.437
  549    HB3  HIS   4           HB3      HIS   4  37.909  15.990   6.342
  550    HD2  HIS   4           HD2      HIS   4  39.135  14.602   8.620
  551    HE1  HIS   4           HE1      HIS   4  38.631  10.843   6.745
  552    HE2  HIS   4           HE2      HIS   4  39.604  12.062   8.738
  553    H    HIS   5           H        HIS   5  36.922  17.893   6.630
  554    HA   HIS   5           HA       HIS   5  34.390  19.185   5.898
  555    HB2  HIS   5           HB2      HIS   5  35.849  21.212   5.640
  556    HB3  HIS   5           HB3      HIS   5  36.015  20.464   7.222
  557    HD2  HIS   5           HD2      HIS   5  38.223  21.641   4.361
  558    HE1  HIS   5           HE1      HIS   5  40.570  19.017   6.705
  559    HE2  HIS   5           HE2      HIS   5  40.546  20.544   4.693
  560    H    HIS   6           H        HIS   6  35.315  16.949   4.251
  561    HA   HIS   6           HA       HIS   6  36.712  17.848   1.926
  562    HB2  HIS   6           HB2      HIS   6  36.340  15.542   1.088
  563    HB3  HIS   6           HB3      HIS   6  36.989  15.568   2.727
  564    HD2  HIS   6           HD2      HIS   6  35.088  13.115   1.295
  565    HE1  HIS   6           HE1      HIS   6  32.510  14.187   4.473
  566    HE2  HIS   6           HE2      HIS   6  33.180  12.347   2.864
  567    H    HIS   7           H        HIS   7  35.645  16.985  -0.318
  568    HA   HIS   7           HA       HIS   7  33.832  19.247  -0.736
  569    HB2  HIS   7           HB2      HIS   7  35.294  17.617  -2.843
  570    HB3  HIS   7           HB3      HIS   7  34.690  19.267  -2.990
  571    HD2  HIS   7           HD2      HIS   7  36.247  21.213  -1.534
  572    HE1  HIS   7           HE1      HIS   7  39.529  18.600  -1.029
  573    HE2  HIS   7           HE2      HIS   7  38.614  20.901  -0.527
  574    H    HIS   8           H        HIS   8  32.815  16.462   0.101
  575    HA   HIS   8           HA       HIS   8  31.303  15.481  -2.174
  576    HB2  HIS   8           HB2      HIS   8  31.388  14.628   0.745
  577    HB3  HIS   8           HB3      HIS   8  30.357  13.850  -0.454
  578    HD2  HIS   8           HD2      HIS   8  31.896  11.500   0.087
  579    HE1  HIS   8           HE1      HIS   8  35.259  12.921  -2.056
  580    HE2  HIS   8           HE2      HIS   8  34.293  10.987  -0.752
  581    H    SER   9           H        SER   9  30.237  17.591  -2.520
  582    HA   SER   9           HA       SER   9  27.967  18.258  -0.763
  583    HB2  SER   9           HB2      SER   9  28.950  19.638  -3.307
  584    HB3  SER   9           HB3      SER   9  27.711  20.252  -2.208
  585    HG   SER   9           HG       SER   9  29.613  19.897  -0.601
  586    H    HIS  10           H        HIS  10  25.963  17.454  -1.138
  587    HA   HIS  10           HA       HIS  10  25.171  16.512  -3.843
  588    HB2  HIS  10           HB2      HIS  10  24.733  14.976  -1.238
  589    HB3  HIS  10           HB3      HIS  10  24.128  14.492  -2.820
  590    HD1  HIS  10           HD1      HIS  10  27.261  14.653  -0.770
  591    HD2  HIS  10           HD2      HIS  10  26.007  13.239  -4.474
  592    HE1  HIS  10           HE1      HIS  10  29.105  13.169  -1.589
  593    HE2  HIS  10           HE2      HIS  10  28.271  12.217  -3.756
  594    H    MET  11           H        MET  11  22.865  16.370  -4.179
  595    HA   MET  11           HA       MET  11  21.196  18.109  -2.474
  596    HB2  MET  11           HB2      MET  11  20.644  16.893  -5.217
  597    HB3  MET  11           HB3      MET  11  19.571  17.998  -4.373
  598    HG2  MET  11           HG2      MET  11  22.381  18.795  -5.159
  599    HG3  MET  11           HG3      MET  11  21.016  18.951  -6.260
  600    HE1  MET  11           HE1      MET  11  23.011  20.584  -3.387
  601    HE2  MET  11           HE2      MET  11  21.757  19.883  -2.365
  602    HE3  MET  11           HE3      MET  11  21.838  21.630  -2.589
  603    H    GLY  12           H        GLY  12  20.434  16.924  -0.737
  604    HA2  GLY  12           HA2      GLY  12  18.855  14.477  -1.238
  605    HA3  GLY  12           HA3      GLY  12  20.226  14.356  -0.147
  606    H    GLY  13           H        GLY  13  19.085  13.877   1.697
  607    HA2  GLY  13           HA2      GLY  13  17.953  14.278   3.655
  608    HA3  GLY  13           HA3      GLY  13  17.870  15.976   3.214
  609    H    GLY  14           H        GLY  14  15.932  16.788   2.522
  610    HA2  GLY  14           HA2      GLY  14  13.913  15.682   1.052
  611    HA3  GLY  14           HA3      GLY  14  13.545  15.155   2.691
  612    H    LYS  15           H        LYS  15  12.819  17.486   0.486
  613    HA   LYS  15           HA       LYS  15  12.210  19.581   2.508
  614    HB2  LYS  15           HB2      LYS  15  12.680  19.891  -0.489
  615    HB3  LYS  15           HB3      LYS  15  12.206  21.195   0.594
  616    HG2  LYS  15           HG2      LYS  15  14.342  20.892   1.854
  617    HG3  LYS  15           HG3      LYS  15  14.819  19.651   0.696
  618    HD2  LYS  15           HD2      LYS  15  14.266  22.569   0.016
  619    HD3  LYS  15           HD3      LYS  15  15.868  21.856   0.209
  620    HE2  LYS  15           HE2      LYS  15  15.467  20.383  -1.712
  621    HE3  LYS  15           HE3      LYS  15  13.835  21.031  -1.899
  622    HZ1  LYS  15           HZ1      LYS  15  15.395  22.042  -3.443
  623    HZ2  LYS  15           HZ2      LYS  15  16.351  22.589  -2.163
  624    HZ3  LYS  15           HZ3      LYS  15  14.791  23.195  -2.372
  625    H    GLY  16           H        GLY  16  10.890  17.507   0.019
  626    HA2  GLY  16           HA2      GLY  16   8.720  16.934  -0.482
  627    HA3  GLY  16           HA3      GLY  16   8.156  18.055   0.742
  628    HA   PRO  17           HA       PRO  17   8.843  20.609  -3.421
  629    HB2  PRO  17           HB2      PRO  17   8.670  18.484  -5.508
  630    HB3  PRO  17           HB3      PRO  17   9.806  19.831  -5.367
  631    HG2  PRO  17           HG2      PRO  17  10.588  17.303  -4.877
  632    HG3  PRO  17           HG3      PRO  17  11.223  18.657  -3.915
  633    HD2  PRO  17           HD2      PRO  17   9.032  16.692  -3.209
  634    HD3  PRO  17           HD3      PRO  17  10.382  17.279  -2.210
  635    H    ALA  18           H        ALA  18   6.734  21.144  -2.632
  636    HA   ALA  18           HA       ALA  18   4.367  19.978  -3.962
  637    HB1  ALA  18           HB1      ALA  18   4.292  20.253  -1.509
  638    HB2  ALA  18           HB2      ALA  18   3.061  21.236  -2.301
  639    HB3  ALA  18           HB3      ALA  18   4.537  21.990  -1.688
  640    H    ALA  19           H        ALA  19   2.678  21.522  -4.744
  641    HA   ALA  19           HA       ALA  19   3.599  24.105  -5.791
  642    HB1  ALA  19           HB1      ALA  19   3.111  23.519  -8.137
  643    HB2  ALA  19           HB2      ALA  19   2.729  21.866  -7.657
  644    HB3  ALA  19           HB3      ALA  19   4.376  22.474  -7.484
  645    H    GLU  20           H        GLU  20   1.789  25.131  -7.186
  646    HA   GLU  20           HA       GLU  20  -0.587  25.478  -5.739
  647    HB2  GLU  20           HB2      GLU  20   0.026  26.100  -8.663
  648    HB3  GLU  20           HB3      GLU  20  -1.415  26.662  -7.830
  649    HG2  GLU  20           HG2      GLU  20   1.415  27.369  -7.004
  650    HG3  GLU  20           HG3      GLU  20   0.390  28.378  -8.023
  651    H    GLU  21           H        GLU  21  -2.191  24.019  -5.450
  652    HA   GLU  21           HA       GLU  21  -2.961  22.164  -7.629
  653    HB2  GLU  21           HB2      GLU  21  -3.276  20.386  -5.927
  654    HB3  GLU  21           HB3      GLU  21  -1.609  20.943  -5.999
  655    HG2  GLU  21           HG2      GLU  21  -2.050  22.368  -3.976
  656    HG3  GLU  21           HG3      GLU  21  -3.661  21.659  -3.876
  657    HA   PRO  22           HA       PRO  22  -7.202  23.593  -6.990
  658    HB2  PRO  22           HB2      PRO  22  -8.061  20.834  -7.806
  659    HB3  PRO  22           HB3      PRO  22  -8.455  22.394  -8.536
  660    HG2  PRO  22           HG2      PRO  22  -6.739  20.729  -9.743
  661    HG3  PRO  22           HG3      PRO  22  -6.459  22.485  -9.753
  662    HD2  PRO  22           HD2      PRO  22  -5.175  20.372  -8.014
  663    HD3  PRO  22           HD3      PRO  22  -4.418  21.743  -8.862
  664    H    LEU  23           H        LEU  23  -8.099  23.828  -4.984
  665    HA   LEU  23           HA       LEU  23  -7.769  21.936  -2.866
  666    HB2  LEU  23           HB2      LEU  23  -9.527  24.404  -3.004
  667    HB3  LEU  23           HB3      LEU  23  -9.206  23.491  -1.539
  668    HG   LEU  23           HG       LEU  23  -7.178  25.094  -3.146
  669   HD11  LEU  23          HD11      LEU  23  -8.306  25.549  -0.366
  670   HD12  LEU  23          HD12      LEU  23  -8.666  26.495  -1.810
  671   HD13  LEU  23          HD13      LEU  23  -7.039  26.512  -1.134
  672   HD21  LEU  23          HD21      LEU  23  -5.542  24.525  -1.369
  673   HD22  LEU  23          HD22      LEU  23  -6.054  23.107  -2.276
  674   HD23  LEU  23          HD23      LEU  23  -6.707  23.401  -0.662
  675    H    SER  24           H        SER  24 -10.243  22.225  -5.272
  676    HA   SER  24           HA       SER  24 -12.405  20.978  -3.869
  677    HB2  SER  24           HB2      SER  24 -11.879  21.147  -6.872
  678    HB3  SER  24           HB3      SER  24 -13.406  20.655  -6.134
  679    HG   SER  24           HG       SER  24 -13.860  22.700  -6.153
  680    H    LEU  25           H        LEU  25 -11.512  19.167  -2.813
  681    HA   LEU  25           HA       LEU  25 -10.322  17.003  -4.394
  682    HB2  LEU  25           HB2      LEU  25  -9.846  15.955  -2.150
  683    HB3  LEU  25           HB3      LEU  25  -9.062  17.486  -2.464
  684    HG   LEU  25           HG       LEU  25 -10.953  18.553  -1.015
  685   HD11  LEU  25          HD11      LEU  25 -11.945  17.106   0.717
  686   HD12  LEU  25          HD12      LEU  25 -11.275  15.683  -0.089
  687   HD13  LEU  25          HD13      LEU  25 -12.498  16.665  -0.898
  688   HD21  LEU  25          HD21      LEU  25  -8.899  16.763   0.322
  689   HD22  LEU  25          HD22      LEU  25  -9.718  18.138   1.069
  690   HD23  LEU  25          HD23      LEU  25  -8.614  18.400  -0.279
  691    H    LEU  26           H        LEU  26 -11.013  14.822  -4.275
  692    HA   LEU  26           HA       LEU  26 -13.895  14.391  -3.668
  693    HB2  LEU  26           HB2      LEU  26 -12.595  14.152  -6.140
  694    HB3  LEU  26           HB3      LEU  26 -12.611  12.499  -5.572
  695    HG   LEU  26           HG       LEU  26 -15.074  14.246  -5.932
  696   HD11  LEU  26          HD11      LEU  26 -14.064  13.681  -8.090
  697   HD12  LEU  26          HD12      LEU  26 -15.599  12.842  -7.878
  698   HD13  LEU  26          HD13      LEU  26 -14.081  11.966  -7.665
  699   HD21  LEU  26          HD21      LEU  26 -15.422  12.577  -4.164
  700   HD22  LEU  26          HD22      LEU  26 -14.906  11.292  -5.256
  701   HD23  LEU  26          HD23      LEU  26 -16.388  12.190  -5.586
  702    H    ASP  27           H        ASP  27 -11.271  14.057  -2.079
  703    HA   ASP  27           HA       ASP  27 -10.257  12.691  -0.590
  704    HB2  ASP  27           HB2      ASP  27 -13.044  11.463  -0.578
  705    HB3  ASP  27           HB3      ASP  27 -11.796  10.995   0.568
  706    H    ASP  28           H        ASP  28  -9.823  11.965  -3.351
  707    HA   ASP  28           HA       ASP  28 -10.261   9.264  -3.962
  708    HB2  ASP  28           HB2      ASP  28  -9.480  11.239  -5.498
  709    HB3  ASP  28           HB3      ASP  28  -7.848  10.781  -5.024
  710    H    MET  29           H        MET  29  -7.468  10.794  -2.337
  711    HA   MET  29           HA       MET  29  -5.886   8.448  -1.999
  712    HB2  MET  29           HB2      MET  29  -5.922  10.925  -0.216
  713    HB3  MET  29           HB3      MET  29  -4.648   9.713  -0.290
  714    HG2  MET  29           HG2      MET  29  -4.365  10.354  -2.734
  715    HG3  MET  29           HG3      MET  29  -5.412  11.729  -2.391
  716    HE1  MET  29           HE1      MET  29  -2.517  10.000  -0.243
  717    HE2  MET  29           HE2      MET  29  -1.178  11.060  -0.685
  718    HE3  MET  29           HE3      MET  29  -1.951  10.056  -1.915
  719    H    ASN  30           H        ASN  30  -8.425   9.954  -0.033
  720    HA   ASN  30           HA       ASN  30  -8.193   8.468   2.363
  721    HB2  ASN  30           HB2      ASN  30  -9.426  10.634   2.105
  722    HB3  ASN  30           HB3      ASN  30 -10.653   9.814   1.159
  723   HD21  ASN  30          HD21      ASN  30 -11.145  11.343   3.441
  724   HD22  ASN  30          HD22      ASN  30 -11.799  10.308   4.657
  725    H    HIS  31           H        HIS  31 -10.377   7.983  -0.461
  726    HA   HIS  31           HA       HIS  31 -11.637   5.622   0.406
  727    HB2  HIS  31           HB2      HIS  31 -11.140   6.614  -2.423
  728    HB3  HIS  31           HB3      HIS  31 -12.194   5.257  -2.029
  729    HD2  HIS  31           HD2      HIS  31 -12.394   8.991  -2.444
  730    HE1  HIS  31           HE1      HIS  31 -15.821   7.862  -0.247
  731    HE2  HIS  31           HE2      HIS  31 -14.602   9.782  -1.359
  732    H    CYS  32           H        CYS  32  -8.654   6.110  -1.435
  733    HA   CYS  32           HA       CYS  32  -8.000   3.397  -1.901
  734    HB2  CYS  32           HB2      CYS  32  -6.244   5.869  -1.723
  735    HB3  CYS  32           HB3      CYS  32  -5.635   4.282  -2.189
  736    HG   CYS  32           HG       CYS  32  -7.027   6.570  -4.066
  737    H    TYR  33           H        TYR  33  -7.140   5.573   0.797
  738    HA   TYR  33           HA       TYR  33  -5.481   3.756   2.210
  739    HB2  TYR  33           HB2      TYR  33  -6.851   6.347   2.950
  740    HB3  TYR  33           HB3      TYR  33  -6.083   5.387   4.212
  741    HD1  TYR  33           HD1      TYR  33  -3.655   4.387   3.005
  742    HD2  TYR  33           HD2      TYR  33  -5.428   8.247   2.542
  743    HE1  TYR  33           HE1      TYR  33  -1.458   5.328   2.542
  744    HE2  TYR  33           HE2      TYR  33  -3.205   9.200   2.058
  745    HH   TYR  33           HH       TYR  33  -0.509   7.304   1.339
  746    H    SER  34           H        SER  34  -8.947   4.414   2.358
  747    HA   SER  34           HA       SER  34  -9.634   2.900   4.638
  748    HB2  SER  34           HB2      SER  34 -11.303   3.542   2.162
  749    HB3  SER  34           HB3      SER  34 -11.953   2.866   3.658
  750    HG   SER  34           HG       SER  34 -10.537   5.330   3.531
  751    H    ARG  35           H        ARG  35  -9.410   2.031   1.203
  752    HA   ARG  35           HA       ARG  35 -10.221  -0.674   1.435
  753    HB2  ARG  35           HB2      ARG  35  -8.901   0.955  -0.702
  754    HB3  ARG  35           HB3      ARG  35  -8.989  -0.803  -0.879
  755    HG2  ARG  35           HG2      ARG  35 -11.330  -0.832  -0.891
  756    HG3  ARG  35           HG3      ARG  35 -11.465   0.762  -0.147
  757    HD2  ARG  35           HD2      ARG  35 -12.120   0.871  -2.445
  758    HD3  ARG  35           HD3      ARG  35 -10.635   1.771  -2.213
  759    HE   ARG  35           HE       ARG  35  -9.492   0.249  -3.543
  760   HH11  ARG  35          HH11      ARG  35 -12.716  -0.953  -3.068
  761   HH12  ARG  35          HH12      ARG  35 -12.614  -2.029  -4.414
  762   HH21  ARG  35          HH21      ARG  35  -9.412  -1.123  -5.260
  763   HH22  ARG  35          HH22      ARG  35 -10.767  -2.129  -5.636
  764    H    LEU  36           H        LEU  36  -6.982   0.847   1.481
  765    HA   LEU  36           HA       LEU  36  -5.397  -1.469   1.603
  766    HB2  LEU  36           HB2      LEU  36  -4.979   1.277   2.836
  767    HB3  LEU  36           HB3      LEU  36  -3.756   0.020   2.896
  768    HG   LEU  36           HG       LEU  36  -4.857   1.234   0.329
  769   HD11  LEU  36          HD11      LEU  36  -2.190   1.723   1.683
  770   HD12  LEU  36          HD12      LEU  36  -3.516   2.878   1.548
  771   HD13  LEU  36          HD13      LEU  36  -2.673   2.335   0.098
  772   HD21  LEU  36          HD21      LEU  36  -4.133  -1.092  -0.001
  773   HD22  LEU  36          HD22      LEU  36  -2.570  -0.729   0.736
  774   HD23  LEU  36          HD23      LEU  36  -3.023   0.024  -0.795
  775    H    ARG  37           H        ARG  37  -6.896   0.382   4.269
  776    HA   ARG  37           HA       ARG  37  -6.024  -1.080   6.480
  777    HB2  ARG  37           HB2      ARG  37  -8.692   0.304   6.085
  778    HB3  ARG  37           HB3      ARG  37  -8.053  -0.213   7.644
  779    HG2  ARG  37           HG2      ARG  37  -6.256   1.404   7.528
  780    HG3  ARG  37           HG3      ARG  37  -6.657   1.799   5.853
  781    HD2  ARG  37           HD2      ARG  37  -8.850   2.648   6.586
  782    HD3  ARG  37           HD3      ARG  37  -8.434   2.291   8.259
  783    HE   ARG  37           HE       ARG  37  -7.416   4.468   6.603
  784   HH11  ARG  37          HH11      ARG  37  -7.178   2.802   9.608
  785   HH12  ARG  37          HH12      ARG  37  -6.462   4.148  10.413
  786   HH21  ARG  37          HH21      ARG  37  -6.552   6.203   7.685
  787   HH22  ARG  37          HH22      ARG  37  -6.110   6.029   9.347
  788    H    GLU  38           H        GLU  38  -8.529  -1.869   4.167
  789    HA   GLU  38           HA       GLU  38  -9.871  -3.882   5.775
  790    HB2  GLU  38           HB2      GLU  38 -10.102  -3.151   2.820
  791    HB3  GLU  38           HB3      GLU  38 -11.144  -4.313   3.628
  792    HG2  GLU  38           HG2      GLU  38 -10.938  -1.387   4.391
  793    HG3  GLU  38           HG3      GLU  38 -12.150  -2.046   3.298
  794    H    LEU  39           H        LEU  39  -7.508  -3.791   3.138
  795    HA   LEU  39           HA       LEU  39  -7.516  -6.641   2.653
  796    HB2  LEU  39           HB2      LEU  39  -5.623  -4.514   1.616
  797    HB3  LEU  39           HB3      LEU  39  -5.754  -6.156   1.007
  798    HG   LEU  39           HG       LEU  39  -7.862  -3.977   0.788
  799   HD11  LEU  39          HD11      LEU  39  -6.005  -3.682  -0.771
  800   HD12  LEU  39          HD12      LEU  39  -7.483  -4.126  -1.623
  801   HD13  LEU  39          HD13      LEU  39  -6.223  -5.333  -1.363
  802   HD21  LEU  39          HD21      LEU  39  -8.051  -6.853  -0.167
  803   HD22  LEU  39          HD22      LEU  39  -9.209  -5.568  -0.514
  804   HD23  LEU  39          HD23      LEU  39  -8.989  -6.125   1.143
  805    H    VAL  40           H        VAL  40  -5.673  -4.503   4.698
  806    HA   VAL  40           HA       VAL  40  -3.519  -6.477   5.106
  807    HB   VAL  40           HB       VAL  40  -3.709  -3.696   6.351
  808   HG11  VAL  40          HG11      VAL  40  -2.142  -5.201   7.500
  809   HG12  VAL  40          HG12      VAL  40  -1.257  -3.935   6.650
  810   HG13  VAL  40          HG13      VAL  40  -1.331  -5.563   5.974
  811   HG21  VAL  40          HG21      VAL  40  -2.336  -4.485   3.754
  812   HG22  VAL  40          HG22      VAL  40  -2.190  -2.916   4.556
  813   HG23  VAL  40          HG23      VAL  40  -3.755  -3.441   3.926
  814    HA   PRO  41           HA       PRO  41  -5.860  -7.652   8.919
  815    HB2  PRO  41           HB2      PRO  41  -4.212 -10.093   8.945
  816    HB3  PRO  41           HB3      PRO  41  -5.953  -9.940   8.697
  817    HG2  PRO  41           HG2      PRO  41  -4.231 -10.693   6.700
  818    HG3  PRO  41           HG3      PRO  41  -5.754  -9.830   6.396
  819    HD2  PRO  41           HD2      PRO  41  -2.947  -8.728   6.542
  820    HD3  PRO  41           HD3      PRO  41  -4.231  -8.378   5.357
  821    H    GLY  42           H        GLY  42  -2.612  -6.922   8.325
  822    HA2  GLY  42           HA2      GLY  42  -1.296  -7.667  10.708
  823    HA3  GLY  42           HA3      GLY  42  -0.750  -6.464   9.557
  824    H    VAL  43           H        VAL  43  -3.492  -5.038  10.172
  825    HA   VAL  43           HA       VAL  43  -2.535  -3.315  12.279
  826    HB   VAL  43           HB       VAL  43  -5.321  -3.408  11.038
  827   HG11  VAL  43          HG11      VAL  43  -5.551  -1.061  11.802
  828   HG12  VAL  43          HG12      VAL  43  -3.981  -1.165  12.603
  829   HG13  VAL  43          HG13      VAL  43  -5.318  -2.166  13.160
  830   HG21  VAL  43          HG21      VAL  43  -3.655  -3.054   9.277
  831   HG22  VAL  43          HG22      VAL  43  -2.941  -1.720  10.185
  832   HG23  VAL  43          HG23      VAL  43  -4.581  -1.576   9.547
  833    HA   PRO  44           HA       PRO  44  -4.299  -5.971  15.627
  834    HB2  PRO  44           HB2      PRO  44  -3.469  -3.620  17.301
  835    HB3  PRO  44           HB3      PRO  44  -3.114  -5.341  17.525
  836    HG2  PRO  44           HG2      PRO  44  -1.214  -3.670  16.644
  837    HG3  PRO  44           HG3      PRO  44  -1.349  -5.312  15.974
  838    HD2  PRO  44           HD2      PRO  44  -2.277  -2.693  14.786
  839    HD3  PRO  44           HD3      PRO  44  -1.461  -4.058  13.993
  840    H    ARG  45           H        ARG  45  -6.476  -6.011  15.846
  841    HA   ARG  45           HA       ARG  45  -8.253  -3.961  15.233
  842    HB2  ARG  45           HB2      ARG  45  -8.928  -6.298  15.164
  843    HB3  ARG  45           HB3      ARG  45  -8.705  -6.461  16.902
  844    HG2  ARG  45           HG2      ARG  45 -10.582  -4.873  17.278
  845    HG3  ARG  45           HG3      ARG  45 -10.811  -4.756  15.532
  846    HD2  ARG  45           HD2      ARG  45 -11.415  -7.102  15.403
  847    HD3  ARG  45           HD3      ARG  45 -11.027  -7.339  17.111
  848    HE   ARG  45           HE       ARG  45 -13.076  -5.359  16.621
  849   HH11  ARG  45          HH11      ARG  45 -12.506  -8.738  17.158
  850   HH12  ARG  45          HH12      ARG  45 -14.110  -9.019  17.734
  851   HH21  ARG  45          HH21      ARG  45 -15.122  -5.765  17.372
  852   HH22  ARG  45          HH22      ARG  45 -15.559  -7.364  17.853
  853    H    GLY  46           H        GLY  46  -8.303  -2.058  16.264
  854    HA2  GLY  46           HA2      GLY  46  -9.390  -1.181  18.480
  855    HA3  GLY  46           HA3      GLY  46  -7.927  -1.846  19.188
  856    H    THR  47           H        THR  47  -6.167  -1.134  16.968
  857    HA   THR  47           HA       THR  47  -5.762   1.709  17.537
  858    HB   THR  47           HB       THR  47  -3.794   0.156  17.441
  859    HG1  THR  47           HG1      THR  47  -2.696   1.676  15.717
  860   HG21  THR  47          HG21      THR  47  -2.849  -0.545  15.306
  861   HG22  THR  47          HG22      THR  47  -4.225   0.138  14.438
  862   HG23  THR  47          HG23      THR  47  -4.449  -1.247  15.511
  863    H    GLN  48           H        GLN  48  -5.879   3.397  16.047
  864    HA   GLN  48           HA       GLN  48  -7.576   2.971  13.712
  865    HB2  GLN  48           HB2      GLN  48  -6.444   5.532  14.912
  866    HB3  GLN  48           HB3      GLN  48  -7.551   5.475  13.543
  867    HG2  GLN  48           HG2      GLN  48  -9.256   4.373  15.020
  868    HG3  GLN  48           HG3      GLN  48  -8.147   4.557  16.377
  869   HE21  GLN  48          HE21      GLN  48  -9.653   5.838  17.499
  870   HE22  GLN  48          HE22      GLN  48  -9.994   7.468  17.044
  871    H    LEU  49           H        LEU  49  -4.366   4.486  14.296
  872    HA   LEU  49           HA       LEU  49  -2.540   4.894  13.026
  873    HB2  LEU  49           HB2      LEU  49  -3.633   2.823  11.079
  874    HB3  LEU  49           HB3      LEU  49  -2.009   3.484  11.052
  875    HG   LEU  49           HG       LEU  49  -3.154   1.745  13.268
  876   HD11  LEU  49          HD11      LEU  49  -2.809   0.460  11.216
  877   HD12  LEU  49          HD12      LEU  49  -1.641  -0.005  12.449
  878   HD13  LEU  49          HD13      LEU  49  -1.141   1.037  11.113
  879   HD21  LEU  49          HD21      LEU  49  -0.857   1.657  14.153
  880   HD22  LEU  49          HD22      LEU  49  -1.479   3.303  14.159
  881   HD23  LEU  49          HD23      LEU  49  -0.326   2.805  12.919
  882    H    SER  50           H        SER  50  -2.065   6.624  11.725
  883    HA   SER  50           HA       SER  50  -4.076   7.523   9.748
  884    HB2  SER  50           HB2      SER  50  -2.836   9.729   9.821
  885    HB3  SER  50           HB3      SER  50  -3.612   9.259  11.330
  886    HG   SER  50           HG       SER  50  -0.852   8.835  10.751
  887    H    GLN  51           H        GLN  51  -2.506   9.103   8.087
  888    HA   GLN  51           HA       GLN  51  -2.511   7.422   5.956
  889    HB2  GLN  51           HB2      GLN  51  -0.837   9.937   6.222
  890    HB3  GLN  51           HB3      GLN  51  -1.352   9.205   4.704
  891    HG2  GLN  51           HG2      GLN  51  -3.692   9.678   5.223
  892    HG3  GLN  51           HG3      GLN  51  -3.241  10.313   6.806
  893   HE21  GLN  51          HE21      GLN  51  -2.178  12.349   6.908
  894   HE22  GLN  51          HE22      GLN  51  -2.216  13.462   5.591
  895    H    VAL  52           H        VAL  52   0.548   8.431   7.591
  896    HA   VAL  52           HA       VAL  52   2.221   7.001   5.738
  897    HB   VAL  52           HB       VAL  52   3.097   8.040   8.466
  898   HG11  VAL  52          HG11      VAL  52   4.636   7.653   5.870
  899   HG12  VAL  52          HG12      VAL  52   4.767   6.647   7.315
  900   HG13  VAL  52          HG13      VAL  52   5.301   8.327   7.364
  901   HG21  VAL  52          HG21      VAL  52   1.914   9.857   7.325
  902   HG22  VAL  52          HG22      VAL  52   2.879   9.608   5.871
  903   HG23  VAL  52          HG23      VAL  52   3.649  10.191   7.350
  904    H    GLU  53           H        GLU  53   1.017   6.286   9.016
  905    HA   GLU  53           HA       GLU  53   2.513   3.907   9.488
  906    HB2  GLU  53           HB2      GLU  53  -0.186   4.703  10.657
  907    HB3  GLU  53           HB3      GLU  53   0.802   3.363  11.224
  908    HG2  GLU  53           HG2      GLU  53   1.273   5.037  12.764
  909    HG3  GLU  53           HG3      GLU  53   2.636   5.139  11.652
  910    H    ILE  54           H        ILE  54  -0.546   4.477   7.827
  911    HA   ILE  54           HA       ILE  54  -1.369   1.832   7.328
  912    HB   ILE  54           HB       ILE  54  -1.592   4.299   5.540
  913   HG12  ILE  54          HG12      ILE  54  -3.737   3.091   7.363
  914   HG13  ILE  54          HG13      ILE  54  -2.712   4.451   7.820
  915   HG21  ILE  54          HG21      ILE  54  -3.440   3.131   4.360
  916   HG22  ILE  54          HG22      ILE  54  -3.104   1.668   5.289
  917   HG23  ILE  54          HG23      ILE  54  -1.899   2.298   4.163
  918   HD11  ILE  54          HD11      ILE  54  -4.701   4.386   5.557
  919   HD12  ILE  54          HD12      ILE  54  -3.633   5.744   5.932
  920   HD13  ILE  54          HD13      ILE  54  -4.859   5.238   7.091
  921    H    LEU  55           H        LEU  55   0.756   3.974   5.385
  922    HA   LEU  55           HA       LEU  55   1.438   2.200   3.331
  923    HB2  LEU  55           HB2      LEU  55   3.130   4.438   4.505
  924    HB3  LEU  55           HB3      LEU  55   3.404   3.672   2.947
  925    HG   LEU  55           HG       LEU  55   0.970   5.353   3.681
  926   HD11  LEU  55          HD11      LEU  55   1.872   7.008   2.094
  927   HD12  LEU  55          HD12      LEU  55   3.300   6.001   1.843
  928   HD13  LEU  55          HD13      LEU  55   2.995   6.722   3.424
  929   HD21  LEU  55          HD21      LEU  55   1.698   4.060   1.029
  930   HD22  LEU  55          HD22      LEU  55   0.343   5.158   1.306
  931   HD23  LEU  55          HD23      LEU  55   0.368   3.582   2.090
  932    H    GLN  56           H        GLN  56   3.163   2.821   6.392
  933    HA   GLN  56           HA       GLN  56   5.327   1.052   6.109
  934    HB2  GLN  56           HB2      GLN  56   3.881   1.989   8.618
  935    HB3  GLN  56           HB3      GLN  56   5.434   1.157   8.633
  936    HG2  GLN  56           HG2      GLN  56   6.494   3.012   7.459
  937    HG3  GLN  56           HG3      GLN  56   4.938   3.813   7.250
  938   HE21  GLN  56          HE21      GLN  56   5.709   5.674   8.319
  939   HE22  GLN  56          HE22      GLN  56   5.932   5.719  10.028
  940    H    ARG  57           H        ARG  57   2.067   0.502   7.385
  941    HA   ARG  57           HA       ARG  57   2.442  -2.167   8.332
  942    HB2  ARG  57           HB2      ARG  57   0.621  -0.521   9.019
  943    HB3  ARG  57           HB3      ARG  57  -0.164  -0.833   7.481
  944    HG2  ARG  57           HG2      ARG  57  -1.333  -2.167   9.021
  945    HG3  ARG  57           HG3      ARG  57  -0.256  -3.302   8.212
  946    HD2  ARG  57           HD2      ARG  57   0.406  -2.008  10.871
  947    HD3  ARG  57           HD3      ARG  57  -0.480  -3.524  10.743
  948    HE   ARG  57           HE       ARG  57   1.811  -3.960   9.311
  949   HH11  ARG  57          HH11      ARG  57   1.183  -2.957  12.566
  950   HH12  ARG  57          HH12      ARG  57   2.593  -3.729  13.192
  951   HH21  ARG  57          HH21      ARG  57   3.591  -4.972  10.149
  952   HH22  ARG  57          HH22      ARG  57   3.947  -4.841  11.832
  953    H    VAL  58           H        VAL  58   1.286  -0.807   5.261
  954    HA   VAL  58           HA       VAL  58   0.547  -3.228   3.971
  955    HB   VAL  58           HB       VAL  58   1.383  -0.546   2.761
  956   HG11  VAL  58          HG11      VAL  58   0.078  -2.921   1.373
  957   HG12  VAL  58          HG12      VAL  58   1.710  -2.315   1.094
  958   HG13  VAL  58          HG13      VAL  58   0.321  -1.324   0.655
  959   HG21  VAL  58          HG21      VAL  58  -0.677  -0.420   4.126
  960   HG22  VAL  58          HG22      VAL  58  -1.398  -1.721   3.183
  961   HG23  VAL  58          HG23      VAL  58  -1.039  -0.172   2.417
  962    H    ILE  59           H        ILE  59   3.580  -1.309   3.894
  963    HA   ILE  59           HA       ILE  59   5.114  -2.876   2.162
  964    HB   ILE  59           HB       ILE  59   5.978  -1.239   4.591
  965   HG12  ILE  59          HG12      ILE  59   6.134  -0.575   1.607
  966   HG13  ILE  59          HG13      ILE  59   4.901   0.031   2.706
  967   HG21  ILE  59          HG21      ILE  59   8.292  -1.275   3.683
  968   HG22  ILE  59          HG22      ILE  59   7.780  -2.423   2.443
  969   HG23  ILE  59          HG23      ILE  59   7.741  -2.886   4.144
  970   HD11  ILE  59          HD11      ILE  59   6.623   1.230   3.968
  971   HD12  ILE  59          HD12      ILE  59   6.593   1.703   2.270
  972   HD13  ILE  59          HD13      ILE  59   7.855   0.622   2.856
  973    H    ASP  60           H        ASP  60   4.790  -3.131   5.721
  974    HA   ASP  60           HA       ASP  60   6.438  -5.368   6.158
  975    HB2  ASP  60           HB2      ASP  60   5.614  -3.845   7.937
  976    HB3  ASP  60           HB3      ASP  60   3.983  -4.470   7.723
  977    H    TYR  61           H        TYR  61   2.943  -5.220   5.425
  978    HA   TYR  61           HA       TYR  61   2.230  -7.929   5.559
  979    HB2  TYR  61           HB2      TYR  61   0.522  -6.224   5.311
  980    HB3  TYR  61           HB3      TYR  61   1.204  -5.662   3.795
  981    HD1  TYR  61           HD1      TYR  61  -0.676  -8.491   5.376
  982    HD2  TYR  61           HD2      TYR  61   0.528  -6.666   1.692
  983    HE1  TYR  61           HE1      TYR  61  -2.215  -9.953   4.140
  984    HE2  TYR  61           HE2      TYR  61  -1.020  -8.133   0.465
  985    HH   TYR  61           HH       TYR  61  -2.108 -10.399   0.823
  986    H    ILE  62           H        ILE  62   3.577  -6.085   2.819
  987    HA   ILE  62           HA       ILE  62   3.621  -8.268   0.962
  988    HB   ILE  62           HB       ILE  62   5.229  -5.669   0.856
  989   HG12  ILE  62          HG12      ILE  62   2.490  -6.257  -0.388
  990   HG13  ILE  62          HG13      ILE  62   2.742  -5.282   1.051
  991   HG21  ILE  62          HG21      ILE  62   4.464  -7.583  -1.392
  992   HG22  ILE  62          HG22      ILE  62   6.080  -7.373  -0.718
  993   HG23  ILE  62          HG23      ILE  62   5.315  -6.047  -1.592
  994   HD11  ILE  62          HD11      ILE  62   4.002  -3.649  -0.285
  995   HD12  ILE  62          HD12      ILE  62   2.363  -3.888  -0.888
  996   HD13  ILE  62          HD13      ILE  62   3.724  -4.629  -1.728
  997    H    LEU  63           H        LEU  63   6.037  -6.923   3.225
  998    HA   LEU  63           HA       LEU  63   8.319  -8.357   2.340
  999    HB2  LEU  63           HB2      LEU  63   7.685  -7.264   5.106
 1000    HB3  LEU  63           HB3      LEU  63   9.259  -7.871   4.619
 1001    HG   LEU  63           HG       LEU  63   7.870  -5.396   3.534
 1002   HD11  LEU  63          HD11      LEU  63  10.353  -5.670   5.245
 1003   HD12  LEU  63          HD12      LEU  63   8.778  -5.075   5.774
 1004   HD13  LEU  63          HD13      LEU  63   9.712  -4.159   4.592
 1005   HD21  LEU  63          HD21      LEU  63   9.919  -4.978   2.230
 1006   HD22  LEU  63          HD22      LEU  63   9.108  -6.455   1.714
 1007   HD23  LEU  63          HD23      LEU  63  10.555  -6.551   2.722
 1008    H    ASP  64           H        ASP  64   5.761  -9.168   4.646
 1009    HA   ASP  64           HA       ASP  64   6.804 -11.569   5.682
 1010    HB2  ASP  64           HB2      ASP  64   4.845 -10.377   6.640
 1011    HB3  ASP  64           HB3      ASP  64   3.891 -10.788   5.219
 1012    H    LEU  65           H        LEU  65   4.834 -10.943   2.786
 1013    HA   LEU  65           HA       LEU  65   4.475 -13.647   1.966
 1014    HB2  LEU  65           HB2      LEU  65   4.400 -11.129   0.254
 1015    HB3  LEU  65           HB3      LEU  65   3.699 -12.684  -0.164
 1016    HG   LEU  65           HG       LEU  65   2.778 -10.870   2.098
 1017   HD11  LEU  65          HD11      LEU  65   0.726 -10.554   0.790
 1018   HD12  LEU  65          HD12      LEU  65   1.403 -11.523  -0.522
 1019   HD13  LEU  65          HD13      LEU  65   2.143  -9.980  -0.087
 1020   HD21  LEU  65          HD21      LEU  65   0.913 -12.454   2.411
 1021   HD22  LEU  65          HD22      LEU  65   2.472 -13.210   2.732
 1022   HD23  LEU  65          HD23      LEU  65   1.633 -13.538   1.215
 1023    H    GLN  66           H        GLN  66   7.014 -11.304   1.370
 1024    HA   GLN  66           HA       GLN  66   8.268 -12.754  -0.817
 1025    HB2  GLN  66           HB2      GLN  66   9.211 -10.329   0.757
 1026    HB3  GLN  66           HB3      GLN  66  10.014 -10.967  -0.675
 1027    HG2  GLN  66           HG2      GLN  66   8.101 -10.414  -2.063
 1028    HG3  GLN  66           HG3      GLN  66   7.169  -9.912  -0.647
 1029   HE21  GLN  66          HE21      GLN  66   7.797  -8.006   0.442
 1030   HE22  GLN  66          HE22      GLN  66   8.725  -6.783  -0.332
 1031    H    VAL  67           H        VAL  67   9.364 -11.904   2.507
 1032    HA   VAL  67           HA       VAL  67  11.839 -13.390   2.106
 1033    HB   VAL  67           HB       VAL  67  11.121 -11.670   4.514
 1034   HG11  VAL  67          HG11      VAL  67  13.561 -11.374   4.760
 1035   HG12  VAL  67          HG12      VAL  67  13.825 -12.425   3.362
 1036   HG13  VAL  67          HG13      VAL  67  13.095 -13.076   4.828
 1037   HG21  VAL  67          HG21      VAL  67  12.387 -10.736   1.903
 1038   HG22  VAL  67          HG22      VAL  67  12.224  -9.751   3.359
 1039   HG23  VAL  67          HG23      VAL  67  10.784 -10.300   2.500
 1040    H    VAL  68           H        VAL  68   9.037 -14.432   2.997
 1041    HA   VAL  68           HA       VAL  68  10.062 -16.485   4.884
 1042    HB   VAL  68           HB       VAL  68   7.134 -15.666   4.526
 1043   HG11  VAL  68          HG11      VAL  68   7.351 -18.040   5.097
 1044   HG12  VAL  68          HG12      VAL  68   6.687 -17.144   6.462
 1045   HG13  VAL  68          HG13      VAL  68   8.382 -17.642   6.478
 1046   HG21  VAL  68          HG21      VAL  68   9.011 -15.097   6.864
 1047   HG22  VAL  68          HG22      VAL  68   7.285 -14.728   6.822
 1048   HG23  VAL  68          HG23      VAL  68   8.386 -13.910   5.715
  Start of MODEL    8
    1    H1   MET   1           H1       MET   1   2.122 -33.151  -8.877
    2    H2   MET   1           H2       MET   1   1.013 -32.304  -9.823
    3    H3   MET   1           H3       MET   1   0.463 -33.338  -8.610
    4    HA   MET   1           HA       MET   1   2.049 -30.877  -8.180
    5    HB2  MET   1           HB2      MET   1  -0.359 -30.579  -9.003
    6    HB3  MET   1           HB3      MET   1  -0.897 -31.346  -7.518
    7    HG2  MET   1           HG2      MET   1   0.690 -28.767  -7.673
    8    HG3  MET   1           HG3      MET   1  -1.056 -28.873  -7.462
    9    HE1  MET   1           HE1      MET   1   0.739 -27.159  -5.496
   10    HE2  MET   1           HE2      MET   1   0.130 -27.656  -3.920
   11    HE3  MET   1           HE3      MET   1  -1.000 -27.365  -5.241
   12    H    GLY   2           H        GLY   2   3.354 -31.303  -6.480
   13    HA2  GLY   2           HA2      GLY   2   2.891 -33.305  -4.485
   14    HA3  GLY   2           HA3      GLY   2   4.166 -32.099  -4.480
   15    H    HIS   3           H        HIS   3   3.704 -29.963  -3.614
   16    HA   HIS   3           HA       HIS   3   1.207 -29.287  -2.399
   17    HB2  HIS   3           HB2      HIS   3   1.756 -29.409  -0.046
   18    HB3  HIS   3           HB3      HIS   3   2.091 -30.990  -0.730
   19    HD2  HIS   3           HD2      HIS   3   5.009 -31.329  -1.292
   20    HE1  HIS   3           HE1      HIS   3   5.939 -28.774   1.947
   21    HE2  HIS   3           HE2      HIS   3   6.779 -30.640   0.468
   22    H    HIS   4           H        HIS   4   1.408 -27.278  -1.019
   23    HA   HIS   4           HA       HIS   4   3.658 -25.500  -1.788
   24    HB2  HIS   4           HB2      HIS   4   1.569 -25.002  -3.087
   25    HB3  HIS   4           HB3      HIS   4   0.696 -24.767  -1.580
   26    HD2  HIS   4           HD2      HIS   4   0.478 -22.152  -0.985
   27    HE1  HIS   4           HE1      HIS   4   3.979 -20.811  -2.932
   28    HE2  HIS   4           HE2      HIS   4   1.869 -20.105  -1.731
   29    H    HIS   5           H        HIS   5   2.895 -27.190   0.673
   30    HA   HIS   5           HA       HIS   5   2.484 -25.227   2.814
   31    HB2  HIS   5           HB2      HIS   5   2.917 -28.241   3.033
   32    HB3  HIS   5           HB3      HIS   5   2.295 -27.178   4.291
   33    HD2  HIS   5           HD2      HIS   5   1.004 -29.471   1.597
   34    HE1  HIS   5           HE1      HIS   5  -2.191 -26.892   2.568
   35    HE2  HIS   5           HE2      HIS   5  -1.538 -29.047   1.426
   36    H    HIS   6           H        HIS   6   4.962 -25.004   1.310
   37    HA   HIS   6           HA       HIS   6   7.183 -26.240   2.615
   38    HB2  HIS   6           HB2      HIS   6   7.264 -23.695   0.939
   39    HB3  HIS   6           HB3      HIS   6   8.567 -24.853   1.180
   40    HD2  HIS   6           HD2      HIS   6   7.397 -27.590   0.163
   41    HE1  HIS   6           HE1      HIS   6   5.996 -25.440  -3.197
   42    HE2  HIS   6           HE2      HIS   6   6.334 -27.735  -2.194
   43    H    HIS   7           H        HIS   7   5.780 -22.994   2.736
   44    HA   HIS   7           HA       HIS   7   7.383 -22.251   5.123
   45    HB2  HIS   7           HB2      HIS   7   6.956 -19.885   4.411
   46    HB3  HIS   7           HB3      HIS   7   7.829 -20.802   3.190
   47    HD2  HIS   7           HD2      HIS   7   4.950 -18.427   3.314
   48    HE1  HIS   7           HE1      HIS   7   4.183 -20.923  -0.016
   49    HE2  HIS   7           HE2      HIS   7   3.689 -18.698   1.067
   50    H    HIS   8           H        HIS   8   6.319 -21.322   6.920
   51    HA   HIS   8           HA       HIS   8   3.349 -21.236   6.942
   52    HB2  HIS   8           HB2      HIS   8   5.044 -22.551   9.120
   53    HB3  HIS   8           HB3      HIS   8   3.294 -22.370   9.152
   54    HD2  HIS   8           HD2      HIS   8   1.976 -23.931   7.014
   55    HE1  HIS   8           HE1      HIS   8   5.169 -26.706   6.953
   56    HE2  HIS   8           HE2      HIS   8   2.854 -26.187   6.086
   57    H    SER   9           H        SER   9   3.116 -19.042   7.142
   58    HA   SER   9           HA       SER   9   4.587 -17.530   9.199
   59    HB2  SER   9           HB2      SER   9   3.555 -15.525   8.181
   60    HB3  SER   9           HB3      SER   9   4.336 -16.509   6.946
   61    HG   SER   9           HG       SER   9   1.990 -15.634   6.738
   62    H    HIS  10           H        HIS  10   3.468 -16.250  10.819
   63    HA   HIS  10           HA       HIS  10   1.036 -17.528  11.852
   64    HB2  HIS  10           HB2      HIS  10   2.969 -17.067  13.366
   65    HB3  HIS  10           HB3      HIS  10   2.771 -15.342  13.089
   66    HD1  HIS  10           HD1      HIS  10   0.460 -14.297  13.992
   67    HD2  HIS  10           HD2      HIS  10   1.393 -18.090  15.408
   68    HE1  HIS  10           HE1      HIS  10  -1.001 -14.643  15.985
   69    HE2  HIS  10           HE2      HIS  10  -0.278 -16.847  16.934
   70    H    MET  11           H        MET  11  -0.686 -16.809  10.622
   71    HA   MET  11           HA       MET  11  -1.065 -13.994   9.982
   72    HB2  MET  11           HB2      MET  11  -1.775 -15.819   8.410
   73    HB3  MET  11           HB3      MET  11  -2.981 -16.339   9.581
   74    HG2  MET  11           HG2      MET  11  -4.123 -14.169   9.373
   75    HG3  MET  11           HG3      MET  11  -2.908 -13.637   8.207
   76    HE1  MET  11           HE1      MET  11  -4.759 -13.022   6.399
   77    HE2  MET  11           HE2      MET  11  -6.011 -13.472   7.558
   78    HE3  MET  11           HE3      MET  11  -6.052 -14.121   5.921
   79    H    GLY  12           H        GLY  12  -2.101 -12.551  11.254
   80    HA2  GLY  12           HA2      GLY  12  -4.447 -12.955  12.722
   81    HA3  GLY  12           HA3      GLY  12  -3.099 -13.150  13.838
   82    H    GLY  13           H        GLY  13  -5.103 -11.149  14.013
   83    HA2  GLY  13           HA2      GLY  13  -3.773  -8.872  14.747
   84    HA3  GLY  13           HA3      GLY  13  -4.128  -8.604  13.043
   85    H    GLY  14           H        GLY  14  -5.157  -6.918  14.965
   86    HA2  GLY  14           HA2      GLY  14  -8.034  -7.628  15.215
   87    HA3  GLY  14           HA3      GLY  14  -7.182  -6.428  16.176
   88    H    LYS  15           H        LYS  15  -7.749  -4.416  15.678
   89    HA   LYS  15           HA       LYS  15  -7.777  -3.464  12.936
   90    HB2  LYS  15           HB2      LYS  15 -10.081  -2.463  13.139
   91    HB3  LYS  15           HB3      LYS  15 -10.075  -4.220  13.074
   92    HG2  LYS  15           HG2      LYS  15 -10.369  -4.297  15.550
   93    HG3  LYS  15           HG3      LYS  15 -10.443  -2.535  15.578
   94    HD2  LYS  15           HD2      LYS  15 -12.406  -4.365  14.129
   95    HD3  LYS  15           HD3      LYS  15 -12.700  -3.560  15.672
   96    HE2  LYS  15           HE2      LYS  15 -12.474  -1.357  14.541
   97    HE3  LYS  15           HE3      LYS  15 -12.243  -2.180  12.999
   98    HZ1  LYS  15           HZ1      LYS  15 -14.675  -2.274  14.700
   99    HZ2  LYS  15           HZ2      LYS  15 -14.463  -3.170  13.292
  100    HZ3  LYS  15           HZ3      LYS  15 -14.514  -1.481  13.217
  101    H    GLY  16           H        GLY  16  -6.859  -1.498  12.891
  102    HA2  GLY  16           HA2      GLY  16  -6.469   0.013  15.418
  103    HA3  GLY  16           HA3      GLY  16  -5.396   0.035  14.035
  104    HA   PRO  17           HA       PRO  17  -9.032   3.207  13.315
  105    HB2  PRO  17           HB2      PRO  17  -9.573   4.750  15.463
  106    HB3  PRO  17           HB3      PRO  17 -10.297   3.144  15.295
  107    HG2  PRO  17           HG2      PRO  17  -7.883   3.966  16.916
  108    HG3  PRO  17           HG3      PRO  17  -9.272   2.972  17.412
  109    HD2  PRO  17           HD2      PRO  17  -6.880   1.896  16.589
  110    HD3  PRO  17           HD3      PRO  17  -8.437   1.064  16.377
  111    H    ALA  18           H        ALA  18  -8.964   5.779  13.494
  112    HA   ALA  18           HA       ALA  18  -6.321   6.696  12.798
  113    HB1  ALA  18           HB1      ALA  18  -8.895   8.274  13.161
  114    HB2  ALA  18           HB2      ALA  18  -8.326   7.553  11.656
  115    HB3  ALA  18           HB3      ALA  18  -7.416   8.868  12.400
  116    H    ALA  19           H        ALA  19  -4.970   8.076  13.927
  117    HA   ALA  19           HA       ALA  19  -5.323   8.138  16.858
  118    HB1  ALA  19           HB1      ALA  19  -2.882   8.388  16.950
  119    HB2  ALA  19           HB2      ALA  19  -2.808   8.480  15.189
  120    HB3  ALA  19           HB3      ALA  19  -3.329   6.989  15.972
  121    H    GLU  20           H        GLU  20  -4.894   9.998  18.100
  122    HA   GLU  20           HA       GLU  20  -5.114  12.627  16.877
  123    HB2  GLU  20           HB2      GLU  20  -4.936  13.459  19.246
  124    HB3  GLU  20           HB3      GLU  20  -6.248  12.322  18.972
  125    HG2  GLU  20           HG2      GLU  20  -4.929  10.517  20.019
  126    HG3  GLU  20           HG3      GLU  20  -3.587  11.636  20.267
  127    H    GLU  21           H        GLU  21  -3.223  12.151  15.561
  128    HA   GLU  21           HA       GLU  21  -0.626  11.628  16.590
  129    HB2  GLU  21           HB2      GLU  21   0.102  11.843  14.231
  130    HB3  GLU  21           HB3      GLU  21  -1.358  10.864  14.361
  131    HG2  GLU  21           HG2      GLU  21  -2.713  12.868  13.707
  132    HG3  GLU  21           HG3      GLU  21  -1.219  13.772  13.481
  133    HA   PRO  22           HA       PRO  22   0.985  15.918  17.008
  134    HB2  PRO  22           HB2      PRO  22   3.673  15.391  16.906
  135    HB3  PRO  22           HB3      PRO  22   2.695  15.033  18.337
  136    HG2  PRO  22           HG2      PRO  22   3.577  13.172  16.133
  137    HG3  PRO  22           HG3      PRO  22   3.615  12.921  17.894
  138    HD2  PRO  22           HD2      PRO  22   1.637  11.896  16.325
  139    HD3  PRO  22           HD3      PRO  22   1.339  12.409  18.000
  140    H    LEU  23           H        LEU  23   1.736  17.513  15.548
  141    HA   LEU  23           HA       LEU  23   1.604  16.818  12.724
  142    HB2  LEU  23           HB2      LEU  23   1.909  19.545  14.037
  143    HB3  LEU  23           HB3      LEU  23   1.517  19.253  12.351
  144    HG   LEU  23           HG       LEU  23  -0.258  18.612  14.743
  145   HD11  LEU  23          HD11      LEU  23  -1.749  20.359  13.858
  146   HD12  LEU  23          HD12      LEU  23  -0.583  20.716  12.581
  147   HD13  LEU  23          HD13      LEU  23  -0.162  21.005  14.272
  148   HD21  LEU  23          HD21      LEU  23  -0.837  18.162  11.791
  149   HD22  LEU  23          HD22      LEU  23  -2.001  17.979  13.105
  150   HD23  LEU  23          HD23      LEU  23  -0.605  16.912  13.018
  151    H    SER  24           H        SER  24   3.774  15.579  13.299
  152    HA   SER  24           HA       SER  24   6.199  17.176  13.012
  153    HB2  SER  24           HB2      SER  24   7.360  14.945  13.119
  154    HB3  SER  24           HB3      SER  24   6.303  15.242  14.496
  155    HG   SER  24           HG       SER  24   5.673  13.648  12.222
  156    H    LEU  25           H        LEU  25   5.891  18.149  10.993
  157    HA   LEU  25           HA       LEU  25   5.249  16.648   8.610
  158    HB2  LEU  25           HB2      LEU  25   6.165  19.528   8.907
  159    HB3  LEU  25           HB3      LEU  25   5.551  18.810   7.427
  160    HG   LEU  25           HG       LEU  25   3.975  19.293   9.985
  161   HD11  LEU  25          HD11      LEU  25   2.697  20.915   8.655
  162   HD12  LEU  25          HD12      LEU  25   3.737  20.606   7.262
  163   HD13  LEU  25          HD13      LEU  25   4.407  21.340   8.720
  164   HD21  LEU  25          HD21      LEU  25   3.185  17.213   8.943
  165   HD22  LEU  25          HD22      LEU  25   2.992  18.038   7.394
  166   HD23  LEU  25          HD23      LEU  25   1.983  18.489   8.769
  167    H    LEU  26           H        LEU  26   6.750  15.227   7.994
  168    HA   LEU  26           HA       LEU  26   9.255  16.245   6.850
  169    HB2  LEU  26           HB2      LEU  26   9.632  15.276   9.225
  170    HB3  LEU  26           HB3      LEU  26   9.268  13.709   8.546
  171    HG   LEU  26           HG       LEU  26  11.568  15.392   7.464
  172   HD11  LEU  26          HD11      LEU  26  13.114  14.241   8.995
  173   HD12  LEU  26          HD12      LEU  26  11.751  13.448   9.793
  174   HD13  LEU  26          HD13      LEU  26  11.931  15.200   9.882
  175   HD21  LEU  26          HD21      LEU  26  10.938  13.452   6.086
  176   HD22  LEU  26          HD22      LEU  26  11.142  12.379   7.471
  177   HD23  LEU  26          HD23      LEU  26  12.534  13.231   6.793
  178    H    ASP  27           H        ASP  27  10.042  14.839   5.130
  179    HA   ASP  27           HA       ASP  27   7.844  13.852   3.536
  180    HB2  ASP  27           HB2      ASP  27   9.562  13.742   1.714
  181    HB3  ASP  27           HB3      ASP  27   9.488  15.311   2.506
  182    H    ASP  28           H        ASP  28   8.565  12.085   5.825
  183    HA   ASP  28           HA       ASP  28   9.861   9.712   5.149
  184    HB2  ASP  28           HB2      ASP  28   7.328   9.939   6.839
  185    HB3  ASP  28           HB3      ASP  28   8.521   8.646   6.918
  186    H    MET  29           H        MET  29   6.636  10.836   4.303
  187    HA   MET  29           HA       MET  29   5.414   8.450   3.461
  188    HB2  MET  29           HB2      MET  29   4.868  11.189   2.238
  189    HB3  MET  29           HB3      MET  29   3.771   9.814   2.321
  190    HG2  MET  29           HG2      MET  29   4.027  10.103   4.911
  191    HG3  MET  29           HG3      MET  29   4.588  11.717   4.488
  192    HE1  MET  29           HE1      MET  29   0.368  10.042   3.664
  193    HE2  MET  29           HE2      MET  29   1.630   9.198   4.564
  194    HE3  MET  29           HE3      MET  29   1.784   9.417   2.819
  195    H    ASN  30           H        ASN  30   7.520  10.711   1.740
  196    HA   ASN  30           HA       ASN  30   7.198   9.760  -0.914
  197    HB2  ASN  30           HB2      ASN  30   9.573  11.201   0.349
  198    HB3  ASN  30           HB3      ASN  30   9.326  10.991  -1.384
  199   HD21  ASN  30          HD21      ASN  30   9.273  13.222  -1.762
  200   HD22  ASN  30          HD22      ASN  30   7.952  14.212  -1.260
  201    H    HIS  31           H        HIS  31   9.535   8.955   1.639
  202    HA   HIS  31           HA       HIS  31  11.113   7.089   0.163
  203    HB2  HIS  31           HB2      HIS  31  10.715   7.328   3.182
  204    HB3  HIS  31           HB3      HIS  31  11.987   6.392   2.398
  205    HD2  HIS  31           HD2      HIS  31  11.104  10.087   3.237
  206    HE1  HIS  31           HE1      HIS  31  14.948   9.974   1.490
  207    HE2  HIS  31           HE2      HIS  31  13.121  11.464   2.404
  208    H    CYS  32           H        CYS  32   8.239   6.733   2.223
  209    HA   CYS  32           HA       CYS  32   8.003   3.909   2.186
  210    HB2  CYS  32           HB2      CYS  32   5.801   6.006   2.422
  211    HB3  CYS  32           HB3      CYS  32   5.610   4.292   2.795
  212    HG   CYS  32           HG       CYS  32   8.014   6.022   4.435
  213    H    TYR  33           H        TYR  33   6.527   6.384   0.092
  214    HA   TYR  33           HA       TYR  33   5.081   4.695  -1.636
  215    HB2  TYR  33           HB2      TYR  33   6.007   7.568  -1.797
  216    HB3  TYR  33           HB3      TYR  33   5.291   6.824  -3.222
  217    HD1  TYR  33           HD1      TYR  33   3.136   5.192  -2.160
  218    HD2  TYR  33           HD2      TYR  33   4.360   9.101  -0.938
  219    HE1  TYR  33           HE1      TYR  33   0.858   5.674  -1.451
  220    HE2  TYR  33           HE2      TYR  33   2.059   9.580  -0.202
  221    HH   TYR  33           HH       TYR  33  -0.201   8.815  -0.643
  222    H    SER  34           H        SER  34   8.401   5.911  -1.848
  223    HA   SER  34           HA       SER  34   9.035   5.115  -4.474
  224    HB2  SER  34           HB2      SER  34  10.513   6.602  -3.183
  225    HB3  SER  34           HB3      SER  34  10.868   5.304  -2.048
  226    HG   SER  34           HG       SER  34  11.910   4.174  -3.731
  227    H    ARG  35           H        ARG  35   9.447   3.357  -1.376
  228    HA   ARG  35           HA       ARG  35  10.503   0.990  -2.593
  229    HB2  ARG  35           HB2      ARG  35  10.897   1.914  -0.203
  230    HB3  ARG  35           HB3      ARG  35   9.392   1.094   0.217
  231    HG2  ARG  35           HG2      ARG  35  10.282  -1.039  -0.302
  232    HG3  ARG  35           HG3      ARG  35  11.641  -0.348  -1.190
  233    HD2  ARG  35           HD2      ARG  35  12.425  -1.200   0.905
  234    HD3  ARG  35           HD3      ARG  35  12.536   0.556   0.935
  235    HE   ARG  35           HE       ARG  35  10.091  -0.125   2.079
  236   HH11  ARG  35          HH11      ARG  35  13.451  -0.570   2.864
  237   HH12  ARG  35          HH12      ARG  35  13.134  -0.617   4.564
  238   HH21  ARG  35          HH21      ARG  35   9.750  -0.175   4.242
  239   HH22  ARG  35          HH22      ARG  35  11.074  -0.409   5.330
  240    H    LEU  36           H        LEU  36   7.216   2.048  -1.749
  241    HA   LEU  36           HA       LEU  36   5.865  -0.426  -2.125
  242    HB2  LEU  36           HB2      LEU  36   4.930   2.427  -2.634
  243    HB3  LEU  36           HB3      LEU  36   3.874   1.037  -2.807
  244    HG   LEU  36           HG       LEU  36   5.206   1.912  -0.213
  245   HD11  LEU  36          HD11      LEU  36   2.295   2.119  -1.048
  246   HD12  LEU  36          HD12      LEU  36   3.425   3.461  -0.867
  247   HD13  LEU  36          HD13      LEU  36   2.947   2.521   0.545
  248   HD21  LEU  36          HD21      LEU  36   4.947  -0.528  -0.278
  249   HD22  LEU  36          HD22      LEU  36   3.242  -0.359  -0.704
  250   HD23  LEU  36          HD23      LEU  36   3.819   0.180   0.875
  251    H    ARG  37           H        ARG  37   6.764   2.143  -4.436
  252    HA   ARG  37           HA       ARG  37   5.887   1.017  -6.853
  253    HB2  ARG  37           HB2      ARG  37   8.182   2.875  -6.215
  254    HB3  ARG  37           HB3      ARG  37   7.776   2.416  -7.869
  255    HG2  ARG  37           HG2      ARG  37   5.635   3.468  -7.755
  256    HG3  ARG  37           HG3      ARG  37   5.737   3.656  -5.999
  257    HD2  ARG  37           HD2      ARG  37   6.104   5.761  -7.215
  258    HD3  ARG  37           HD3      ARG  37   7.488   5.302  -6.227
  259    HE   ARG  37           HE       ARG  37   7.730   4.438  -8.960
  260   HH11  ARG  37          HH11      ARG  37   8.250   7.170  -6.878
  261   HH12  ARG  37          HH12      ARG  37   9.433   7.861  -7.929
  262   HH21  ARG  37          HH21      ARG  37   9.268   5.357 -10.254
  263   HH22  ARG  37          HH22      ARG  37  10.008   6.846  -9.790
  264    H    GLU  38           H        GLU  38   8.446  -0.006  -4.814
  265    HA   GLU  38           HA       GLU  38   9.911  -1.482  -6.891
  266    HB2  GLU  38           HB2      GLU  38  10.499  -1.020  -3.934
  267    HB3  GLU  38           HB3      GLU  38  11.543  -1.932  -5.024
  268    HG2  GLU  38           HG2      GLU  38  11.894   0.103  -6.393
  269    HG3  GLU  38           HG3      GLU  38  10.861   1.014  -5.292
  270    H    LEU  39           H        LEU  39   7.777  -1.991  -4.153
  271    HA   LEU  39           HA       LEU  39   8.108  -4.874  -4.031
  272    HB2  LEU  39           HB2      LEU  39   6.277  -2.919  -2.609
  273    HB3  LEU  39           HB3      LEU  39   6.148  -4.655  -2.372
  274    HG   LEU  39           HG       LEU  39   8.652  -3.027  -1.767
  275   HD11  LEU  39          HD11      LEU  39   6.583  -4.101   0.177
  276   HD12  LEU  39          HD12      LEU  39   6.851  -2.404  -0.228
  277   HD13  LEU  39          HD13      LEU  39   8.106  -3.313   0.609
  278   HD21  LEU  39          HD21      LEU  39   9.446  -5.076  -0.626
  279   HD22  LEU  39          HD22      LEU  39   9.170  -5.367  -2.340
  280   HD23  LEU  39          HD23      LEU  39   7.998  -5.941  -1.151
  281    H    VAL  40           H        VAL  40   5.914  -2.639  -5.586
  282    HA   VAL  40           HA       VAL  40   4.000  -4.706  -6.376
  283    HB   VAL  40           HB       VAL  40   4.103  -1.779  -7.264
  284   HG11  VAL  40          HG11      VAL  40   1.716  -2.094  -7.881
  285   HG12  VAL  40          HG12      VAL  40   1.830  -3.802  -7.449
  286   HG13  VAL  40          HG13      VAL  40   2.777  -3.169  -8.796
  287   HG21  VAL  40          HG21      VAL  40   2.517  -3.019  -4.976
  288   HG22  VAL  40          HG22      VAL  40   2.342  -1.362  -5.559
  289   HG23  VAL  40          HG23      VAL  40   3.865  -1.881  -4.832
  290    HA   PRO  41           HA       PRO  41   6.789  -5.553  -9.951
  291    HB2  PRO  41           HB2      PRO  41   4.752  -7.666 -10.568
  292    HB3  PRO  41           HB3      PRO  41   6.499  -7.821 -10.326
  293    HG2  PRO  41           HG2      PRO  41   4.786  -8.684  -8.452
  294    HG3  PRO  41           HG3      PRO  41   6.301  -7.876  -7.987
  295    HD2  PRO  41           HD2      PRO  41   3.509  -6.710  -8.143
  296    HD3  PRO  41           HD3      PRO  41   4.715  -6.566  -6.841
  297    H    GLY  42           H        GLY  42   3.337  -4.925 -10.036
  298    HA2  GLY  42           HA2      GLY  42   3.127  -4.681 -12.932
  299    HA3  GLY  42           HA3      GLY  42   1.855  -4.417 -11.753
  300    H    VAL  43           H        VAL  43   5.043  -2.807 -11.939
  301    HA   VAL  43           HA       VAL  43   3.749  -0.185 -12.294
  302    HB   VAL  43           HB       VAL  43   6.666  -0.880 -11.670
  303   HG11  VAL  43          HG11      VAL  43   7.020   1.544 -11.294
  304   HG12  VAL  43          HG12      VAL  43   5.377   1.879 -11.849
  305   HG13  VAL  43          HG13      VAL  43   6.568   1.210 -12.965
  306   HG21  VAL  43          HG21      VAL  43   5.140  -1.321  -9.788
  307   HG22  VAL  43          HG22      VAL  43   4.503   0.322  -9.886
  308   HG23  VAL  43          HG23      VAL  43   6.186   0.051  -9.426
  309    HA   PRO  44           HA       PRO  44   4.704  -0.806 -16.751
  310    HB2  PRO  44           HB2      PRO  44   3.379   1.857 -17.041
  311    HB3  PRO  44           HB3      PRO  44   2.987   0.320 -17.825
  312    HG2  PRO  44           HG2      PRO  44   1.407   1.329 -15.893
  313    HG3  PRO  44           HG3      PRO  44   1.698  -0.422 -16.010
  314    HD2  PRO  44           HD2      PRO  44   2.989   1.596 -14.159
  315    HD3  PRO  44           HD3      PRO  44   2.344  -0.021 -13.782
  316    H    ARG  45           H        ARG  45   6.588  -0.271 -17.736
  317    HA   ARG  45           HA       ARG  45   8.448   1.525 -16.640
  318    HB2  ARG  45           HB2      ARG  45   9.818   1.049 -18.734
  319    HB3  ARG  45           HB3      ARG  45   9.332  -0.340 -17.786
  320    HG2  ARG  45           HG2      ARG  45   9.023  -1.113 -19.955
  321    HG3  ARG  45           HG3      ARG  45   7.397  -0.582 -19.535
  322    HD2  ARG  45           HD2      ARG  45   7.715   1.487 -20.804
  323    HD3  ARG  45           HD3      ARG  45   9.396   1.055 -21.136
  324    HE   ARG  45           HE       ARG  45   7.921  -1.037 -22.128
  325   HH11  ARG  45          HH11      ARG  45   7.968   2.373 -22.772
  326   HH12  ARG  45          HH12      ARG  45   7.508   2.157 -24.421
  327   HH21  ARG  45          HH21      ARG  45   7.344  -1.261 -24.231
  328   HH22  ARG  45          HH22      ARG  45   7.146   0.136 -25.231
  329    H    GLY  46           H        GLY  46   8.972   3.617 -16.971
  330    HA2  GLY  46           HA2      GLY  46   9.037   5.734 -17.869
  331    HA3  GLY  46           HA3      GLY  46   8.213   5.148 -19.301
  332    H    THR  47           H        THR  47   6.234   4.223 -16.802
  333    HA   THR  47           HA       THR  47   4.442   6.522 -17.170
  334    HB   THR  47           HB       THR  47   3.936   3.863 -15.755
  335    HG1  THR  47           HG1      THR  47   2.654   3.506 -17.710
  336   HG21  THR  47          HG21      THR  47   1.534   4.465 -15.895
  337   HG22  THR  47          HG22      THR  47   1.961   6.037 -16.574
  338   HG23  THR  47          HG23      THR  47   2.417   5.637 -14.915
  339    H    GLN  48           H        GLN  48   4.837   8.196 -15.833
  340    HA   GLN  48           HA       GLN  48   5.899   8.007 -13.186
  341    HB2  GLN  48           HB2      GLN  48   5.318  10.470 -13.047
  342    HB3  GLN  48           HB3      GLN  48   6.366  10.024 -14.385
  343    HG2  GLN  48           HG2      GLN  48   4.471  10.164 -15.949
  344    HG3  GLN  48           HG3      GLN  48   3.382  10.540 -14.615
  345   HE21  GLN  48          HE21      GLN  48   2.791  12.516 -15.641
  346   HE22  GLN  48          HE22      GLN  48   3.852  13.879 -15.650
  347    H    LEU  49           H        LEU  49   4.769   6.966 -11.671
  348    HA   LEU  49           HA       LEU  49   1.877   7.042 -11.454
  349    HB2  LEU  49           HB2      LEU  49   3.934   5.821  -9.566
  350    HB3  LEU  49           HB3      LEU  49   2.197   5.566  -9.489
  351    HG   LEU  49           HG       LEU  49   4.034   4.640 -11.729
  352   HD11  LEU  49          HD11      LEU  49   2.588   3.025  -9.606
  353   HD12  LEU  49          HD12      LEU  49   4.325   3.326  -9.686
  354   HD13  LEU  49          HD13      LEU  49   3.542   2.365 -10.939
  355   HD21  LEU  49          HD21      LEU  49   1.036   4.217 -11.430
  356   HD22  LEU  49          HD22      LEU  49   2.063   3.467 -12.653
  357   HD23  LEU  49          HD23      LEU  49   1.838   5.213 -12.652
  358    H    SER  50           H        SER  50   0.905   8.818 -10.626
  359    HA   SER  50           HA       SER  50   1.968  10.660  -8.741
  360    HB2  SER  50           HB2      SER  50  -0.975  10.069  -9.325
  361    HB3  SER  50           HB3      SER  50  -0.333  11.542  -8.591
  362    HG   SER  50           HG       SER  50  -0.514  12.072 -10.682
  363    H    GLN  51           H        GLN  51   0.923  11.046  -6.536
  364    HA   GLN  51           HA       GLN  51   1.559   8.960  -4.798
  365    HB2  GLN  51           HB2      GLN  51  -0.244  11.328  -4.153
  366    HB3  GLN  51           HB3      GLN  51   0.552  10.297  -2.973
  367    HG2  GLN  51           HG2      GLN  51   1.924  12.171  -2.985
  368    HG3  GLN  51           HG3      GLN  51   2.772  11.103  -4.094
  369   HE21  GLN  51          HE21      GLN  51   0.809  13.976  -3.824
  370   HE22  GLN  51          HE22      GLN  51   1.147  14.600  -5.393
  371    H    VAL  52           H        VAL  52  -1.634   9.899  -6.029
  372    HA   VAL  52           HA       VAL  52  -3.169   8.015  -4.493
  373    HB   VAL  52           HB       VAL  52  -4.027   9.281  -7.146
  374   HG11  VAL  52          HG11      VAL  52  -5.495   7.466  -6.350
  375   HG12  VAL  52          HG12      VAL  52  -6.322   9.019  -6.263
  376   HG13  VAL  52          HG13      VAL  52  -5.684   8.278  -4.791
  377   HG21  VAL  52          HG21      VAL  52  -3.276  11.091  -5.675
  378   HG22  VAL  52          HG22      VAL  52  -4.279  10.482  -4.357
  379   HG23  VAL  52          HG23      VAL  52  -5.037  11.125  -5.817
  380    H    GLU  53           H        GLU  53  -1.683   7.966  -7.722
  381    HA   GLU  53           HA       GLU  53  -2.850   5.572  -8.700
  382    HB2  GLU  53           HB2      GLU  53  -0.179   6.782  -9.537
  383    HB3  GLU  53           HB3      GLU  53  -1.135   5.627 -10.458
  384    HG2  GLU  53           HG2      GLU  53  -1.803   8.520  -9.872
  385    HG3  GLU  53           HG3      GLU  53  -1.426   7.797 -11.434
  386    H    ILE  54           H        ILE  54   0.101   6.183  -6.845
  387    HA   ILE  54           HA       ILE  54   1.229   3.594  -6.889
  388    HB   ILE  54           HB       ILE  54   1.383   5.721  -4.698
  389   HG12  ILE  54          HG12      ILE  54   3.379   5.149  -6.952
  390   HG13  ILE  54          HG13      ILE  54   2.196   6.452  -6.984
  391   HG21  ILE  54          HG21      ILE  54   2.056   3.590  -3.741
  392   HG22  ILE  54          HG22      ILE  54   3.498   4.572  -3.986
  393   HG23  ILE  54          HG23      ILE  54   3.131   3.255  -5.105
  394   HD11  ILE  54          HD11      ILE  54   3.273   7.480  -5.044
  395   HD12  ILE  54          HD12      ILE  54   4.388   7.272  -6.394
  396   HD13  ILE  54          HD13      ILE  54   4.464   6.175  -5.016
  397    H    LEU  55           H        LEU  55  -1.084   5.118  -4.615
  398    HA   LEU  55           HA       LEU  55  -1.581   2.985  -2.873
  399    HB2  LEU  55           HB2      LEU  55  -3.550   5.085  -3.874
  400    HB3  LEU  55           HB3      LEU  55  -3.810   4.056  -2.475
  401    HG   LEU  55           HG       LEU  55  -1.608   6.147  -2.706
  402   HD11  LEU  55          HD11      LEU  55  -3.814   7.209  -2.584
  403   HD12  LEU  55          HD12      LEU  55  -2.917   7.468  -1.091
  404   HD13  LEU  55          HD13      LEU  55  -4.210   6.268  -1.143
  405   HD21  LEU  55          HD21      LEU  55  -2.441   4.448  -0.330
  406   HD22  LEU  55          HD22      LEU  55  -1.249   5.747  -0.297
  407   HD23  LEU  55          HD23      LEU  55  -0.939   4.299  -1.246
  408    H    GLN  56           H        GLN  56  -3.243   3.800  -5.928
  409    HA   GLN  56           HA       GLN  56  -5.096   1.693  -6.062
  410    HB2  GLN  56           HB2      GLN  56  -3.739   3.240  -8.307
  411    HB3  GLN  56           HB3      GLN  56  -5.134   2.191  -8.539
  412    HG2  GLN  56           HG2      GLN  56  -6.533   3.650  -7.190
  413    HG3  GLN  56           HG3      GLN  56  -5.140   4.630  -6.735
  414   HE21  GLN  56          HE21      GLN  56  -6.166   6.498  -7.562
  415   HE22  GLN  56          HE22      GLN  56  -6.250   6.807  -9.256
  416    H    ARG  57           H        ARG  57  -1.724   1.832  -7.203
  417    HA   ARG  57           HA       ARG  57  -1.656  -0.679  -8.545
  418    HB2  ARG  57           HB2      ARG  57   0.562   1.067  -7.415
  419    HB3  ARG  57           HB3      ARG  57   0.888  -0.422  -8.288
  420    HG2  ARG  57           HG2      ARG  57  -0.676   1.872  -9.514
  421    HG3  ARG  57           HG3      ARG  57   1.080   1.757  -9.609
  422    HD2  ARG  57           HD2      ARG  57   0.102   0.910 -11.662
  423    HD3  ARG  57           HD3      ARG  57   0.852  -0.426 -10.788
  424    HE   ARG  57           HE       ARG  57  -2.073   0.081 -10.780
  425   HH11  ARG  57          HH11      ARG  57   0.553  -2.158 -11.058
  426   HH12  ARG  57          HH12      ARG  57  -0.495  -3.519 -11.212
  427   HH21  ARG  57          HH21      ARG  57  -3.367  -1.704 -10.941
  428   HH22  ARG  57          HH22      ARG  57  -2.665  -3.275 -11.113
  429    H    VAL  58           H        VAL  58  -0.899   0.276  -5.209
  430    HA   VAL  58           HA       VAL  58   0.026  -2.266  -4.300
  431    HB   VAL  58           HB       VAL  58  -1.110   0.105  -2.745
  432   HG11  VAL  58          HG11      VAL  58  -0.116  -0.899  -0.721
  433   HG12  VAL  58          HG12      VAL  58   0.331  -2.337  -1.643
  434   HG13  VAL  58          HG13      VAL  58  -1.369  -1.929  -1.406
  435   HG21  VAL  58          HG21      VAL  58   0.978   0.624  -3.947
  436   HG22  VAL  58          HG22      VAL  58   1.782  -0.754  -3.198
  437   HG23  VAL  58          HG23      VAL  58   1.257   0.609  -2.204
  438    H    ILE  59           H        ILE  59  -3.178  -0.674  -4.124
  439    HA   ILE  59           HA       ILE  59  -4.620  -2.646  -2.739
  440    HB   ILE  59           HB       ILE  59  -5.555  -0.644  -4.846
  441   HG12  ILE  59          HG12      ILE  59  -5.792  -0.555  -1.796
  442   HG13  ILE  59          HG13      ILE  59  -4.602   0.329  -2.744
  443   HG21  ILE  59          HG21      ILE  59  -7.214  -2.456  -4.757
  444   HG22  ILE  59          HG22      ILE  59  -7.876  -0.991  -4.039
  445   HG23  ILE  59          HG23      ILE  59  -7.321  -2.305  -3.001
  446   HD11  ILE  59          HD11      ILE  59  -6.404   1.592  -3.816
  447   HD12  ILE  59          HD12      ILE  59  -6.403   1.769  -2.064
  448   HD13  ILE  59          HD13      ILE  59  -7.586   0.718  -2.838
  449    H    ASP  60           H        ASP  60  -4.177  -2.194  -6.259
  450    HA   ASP  60           HA       ASP  60  -5.656  -4.469  -7.093
  451    HB2  ASP  60           HB2      ASP  60  -5.131  -2.496  -8.545
  452    HB3  ASP  60           HB3      ASP  60  -3.446  -3.008  -8.595
  453    H    TYR  61           H        TYR  61  -2.240  -4.018  -6.240
  454    HA   TYR  61           HA       TYR  61  -1.124  -6.457  -7.060
  455    HB2  TYR  61           HB2      TYR  61   0.362  -4.749  -6.250
  456    HB3  TYR  61           HB3      TYR  61  -0.496  -4.609  -4.723
  457    HD1  TYR  61           HD1      TYR  61   1.734  -6.904  -6.683
  458    HD2  TYR  61           HD2      TYR  61   0.218  -5.883  -2.817
  459    HE1  TYR  61           HE1      TYR  61   3.335  -8.452  -5.641
  460    HE2  TYR  61           HE2      TYR  61   1.821  -7.430  -1.785
  461    HH   TYR  61           HH       TYR  61   3.109  -9.460  -2.433
  462    H    ILE  62           H        ILE  62  -2.756  -5.650  -4.000
  463    HA   ILE  62           HA       ILE  62  -2.497  -8.254  -2.817
  464    HB   ILE  62           HB       ILE  62  -4.385  -5.973  -2.051
  465   HG12  ILE  62          HG12      ILE  62  -1.595  -6.580  -0.930
  466   HG13  ILE  62          HG13      ILE  62  -1.924  -5.328  -2.121
  467   HG21  ILE  62          HG21      ILE  62  -3.421  -8.348  -0.394
  468   HG22  ILE  62          HG22      ILE  62  -5.056  -8.104  -1.009
  469   HG23  ILE  62          HG23      ILE  62  -4.403  -7.010   0.208
  470   HD11  ILE  62          HD11      ILE  62  -3.333  -4.159  -0.489
  471   HD12  ILE  62          HD12      ILE  62  -1.682  -4.386   0.086
  472   HD13  ILE  62          HD13      ILE  62  -2.977  -5.414   0.703
  473    H    LEU  63           H        LEU  63  -5.216  -6.537  -4.412
  474    HA   LEU  63           HA       LEU  63  -7.195  -8.546  -4.196
  475    HB2  LEU  63           HB2      LEU  63  -6.857  -6.338  -6.256
  476    HB3  LEU  63           HB3      LEU  63  -8.299  -7.335  -6.127
  477    HG   LEU  63           HG       LEU  63  -7.278  -5.458  -3.953
  478   HD11  LEU  63          HD11      LEU  63  -9.218  -4.045  -4.511
  479   HD12  LEU  63          HD12      LEU  63  -9.614  -5.118  -5.856
  480   HD13  LEU  63          HD13      LEU  63  -8.107  -4.201  -5.872
  481   HD21  LEU  63          HD21      LEU  63  -8.485  -7.387  -3.004
  482   HD22  LEU  63          HD22      LEU  63  -9.862  -7.062  -4.061
  483   HD23  LEU  63          HD23      LEU  63  -9.411  -5.901  -2.809
  484    H    ASP  64           H        ASP  64  -4.594  -8.128  -6.526
  485    HA   ASP  64           HA       ASP  64  -5.366 -10.019  -8.490
  486    HB2  ASP  64           HB2      ASP  64  -3.585  -8.343  -8.841
  487    HB3  ASP  64           HB3      ASP  64  -2.598  -9.091  -7.594
  488    H    LEU  65           H        LEU  65  -3.496 -10.322  -5.490
  489    HA   LEU  65           HA       LEU  65  -2.843 -13.109  -5.750
  490    HB2  LEU  65           HB2      LEU  65  -2.825 -11.366  -3.258
  491    HB3  LEU  65           HB3      LEU  65  -2.001 -12.907  -3.448
  492    HG   LEU  65           HG       LEU  65  -1.338 -10.333  -4.928
  493   HD11  LEU  65          HD11      LEU  65  -0.645 -10.263  -2.585
  494   HD12  LEU  65          HD12      LEU  65   0.751 -10.332  -3.658
  495   HD13  LEU  65          HD13      LEU  65   0.240 -11.780  -2.785
  496   HD21  LEU  65          HD21      LEU  65   0.598 -11.534  -5.866
  497   HD22  LEU  65          HD22      LEU  65  -0.927 -12.242  -6.394
  498   HD23  LEU  65          HD23      LEU  65   0.026 -13.038  -5.136
  499    H    GLN  66           H        GLN  66  -5.425 -11.306  -4.206
  500    HA   GLN  66           HA       GLN  66  -6.626 -13.563  -2.842
  501    HB2  GLN  66           HB2      GLN  66  -7.699 -10.764  -3.401
  502    HB3  GLN  66           HB3      GLN  66  -8.474 -11.945  -2.350
  503    HG2  GLN  66           HG2      GLN  66  -6.564 -11.885  -0.821
  504    HG3  GLN  66           HG3      GLN  66  -5.714 -10.771  -1.893
  505   HE21  GLN  66          HE21      GLN  66  -6.448 -10.368   0.892
  506   HE22  GLN  66          HE22      GLN  66  -7.459  -8.969   0.938
  507    H    VAL  67           H        VAL  67  -8.484 -14.739  -3.480
  508    HA   VAL  67           HA       VAL  67  -9.232 -14.619  -6.327
  509    HB   VAL  67           HB       VAL  67  -9.941 -16.724  -4.225
  510   HG11  VAL  67          HG11      VAL  67 -10.341 -16.808  -7.243
  511   HG12  VAL  67          HG12      VAL  67 -11.610 -16.666  -6.027
  512   HG13  VAL  67          HG13      VAL  67 -10.653 -18.143  -6.126
  513   HG21  VAL  67          HG21      VAL  67  -7.519 -16.697  -4.683
  514   HG22  VAL  67          HG22      VAL  67  -7.820 -16.839  -6.415
  515   HG23  VAL  67          HG23      VAL  67  -8.254 -18.164  -5.330
  516    H    VAL  68           H        VAL  68 -10.901 -13.342  -6.826
  517    HA   VAL  68           HA       VAL  68 -12.848 -12.213  -6.893
  518    HB   VAL  68           HB       VAL  68 -13.970 -14.523  -5.234
  519   HG11  VAL  68          HG11      VAL  68 -16.154 -13.966  -6.273
  520   HG12  VAL  68          HG12      VAL  68 -15.423 -12.569  -7.065
  521   HG13  VAL  68          HG13      VAL  68 -15.533 -12.627  -5.305
  522   HG21  VAL  68          HG21      VAL  68 -13.764 -14.264  -8.264
  523   HG22  VAL  68          HG22      VAL  68 -14.568 -15.576  -7.397
  524   HG23  VAL  68          HG23      VAL  68 -12.824 -15.360  -7.247
  525    H1   MET   1           H1       MET   1  16.614 -22.851  -3.748
  526    H2   MET   1           H2       MET   1  17.491 -22.968  -5.187
  527    H3   MET   1           H3       MET   1  15.986 -22.204  -5.177
  528    HA   MET   1           HA       MET   1  17.778 -20.608  -5.281
  529    HB2  MET   1           HB2      MET   1  15.645 -19.990  -4.188
  530    HB3  MET   1           HB3      MET   1  16.231 -20.607  -2.647
  531    HG2  MET   1           HG2      MET   1  16.328 -18.149  -2.751
  532    HG3  MET   1           HG3      MET   1  17.933 -18.855  -2.560
  533    HE1  MET   1           HE1      MET   1  15.695 -18.510  -5.851
  534    HE2  MET   1           HE2      MET   1  16.358 -17.013  -6.509
  535    HE3  MET   1           HE3      MET   1  15.464 -16.986  -4.991
  536    H    GLY   2           H        GLY   2  19.825 -20.026  -4.697
  537    HA2  GLY   2           HA2      GLY   2  21.396 -21.667  -2.924
  538    HA3  GLY   2           HA3      GLY   2  21.939 -20.260  -3.823
  539    H    HIS   3           H        HIS   3  22.540 -20.983  -1.050
  540    HA   HIS   3           HA       HIS   3  20.997 -19.273   0.710
  541    HB2  HIS   3           HB2      HIS   3  23.595 -20.776   1.262
  542    HB3  HIS   3           HB3      HIS   3  22.539 -20.049   2.475
  543    HD2  HIS   3           HD2      HIS   3  22.885 -23.309   0.444
  544    HE1  HIS   3           HE1      HIS   3  19.221 -23.483   2.547
  545    HE2  HIS   3           HE2      HIS   3  20.985 -24.825   1.334
  546    H    HIS   4           H        HIS   4  21.298 -17.168   0.944
  547    HA   HIS   4           HA       HIS   4  23.288 -15.695  -0.454
  548    HB2  HIS   4           HB2      HIS   4  22.167 -13.698   0.610
  549    HB3  HIS   4           HB3      HIS   4  21.063 -14.778  -0.230
  550    HD2  HIS   4           HD2      HIS   4  21.406 -13.110   3.169
  551    HE1  HIS   4           HE1      HIS   4  18.660 -16.290   3.650
  552    HE2  HIS   4           HE2      HIS   4  19.835 -14.376   4.795
  553    H    HIS   5           H        HIS   5  25.359 -15.491   0.193
  554    HA   HIS   5           HA       HIS   5  26.068 -15.046   3.018
  555    HB2  HIS   5           HB2      HIS   5  27.473 -16.551   1.545
  556    HB3  HIS   5           HB3      HIS   5  27.895 -15.143   0.574
  557    HD2  HIS   5           HD2      HIS   5  28.452 -16.436   4.264
  558    HE1  HIS   5           HE1      HIS   5  31.484 -13.665   3.276
  559    HE2  HIS   5           HE2      HIS   5  30.563 -15.180   5.075
  560    H    HIS   6           H        HIS   6  25.716 -13.377  -0.038
  561    HA   HIS   6           HA       HIS   6  26.606 -10.769   1.005
  562    HB2  HIS   6           HB2      HIS   6  26.342  -9.991  -1.311
  563    HB3  HIS   6           HB3      HIS   6  27.258 -11.492  -1.312
  564    HD2  HIS   6           HD2      HIS   6  24.223  -9.998  -3.036
  565    HE1  HIS   6           HE1      HIS   6  23.904 -14.195  -3.483
  566    HE2  HIS   6           HE2      HIS   6  23.098 -11.951  -4.318
  567    H    HIS   7           H        HIS   7  25.174  -8.893   0.880
  568    HA   HIS   7           HA       HIS   7  22.345  -9.221   0.290
  569    HB2  HIS   7           HB2      HIS   7  22.473  -9.868   2.705
  570    HB3  HIS   7           HB3      HIS   7  23.213  -8.316   3.080
  571    HD2  HIS   7           HD2      HIS   7  21.423  -6.231   3.470
  572    HE1  HIS   7           HE1      HIS   7  17.955  -8.406   2.407
  573    HE2  HIS   7           HE2      HIS   7  18.835  -6.334   3.552
  574    H    HIS   8           H        HIS   8  21.376  -7.311  -0.342
  575    HA   HIS   8           HA       HIS   8  22.546  -4.703   0.181
  576    HB2  HIS   8           HB2      HIS   8  23.830  -5.461  -1.824
  577    HB3  HIS   8           HB3      HIS   8  22.324  -5.736  -2.692
  578    HD2  HIS   8           HD2      HIS   8  24.357  -2.680  -1.236
  579    HE1  HIS   8           HE1      HIS   8  21.765  -1.338  -4.299
  580    HE2  HIS   8           HE2      HIS   8  23.716  -0.727  -2.807
  581    H    SER   9           H        SER   9  21.045  -3.019  -0.091
  582    HA   SER   9           HA       SER   9  18.338  -3.633  -1.109
  583    HB2  SER   9           HB2      SER   9  18.281  -3.948   1.360
  584    HB3  SER   9           HB3      SER   9  18.890  -2.308   1.584
  585    HG   SER   9           HG       SER   9  16.359  -3.195   0.991
  586    H    HIS  10           H        HIS  10  17.109  -1.761  -1.690
  587    HA   HIS  10           HA       HIS  10  18.780   0.488  -2.634
  588    HB2  HIS  10           HB2      HIS  10  17.548  -0.858  -4.323
  589    HB3  HIS  10           HB3      HIS  10  16.026  -0.471  -3.527
  590    HD1  HIS  10           HD1      HIS  10  14.967   1.786  -4.066
  591    HD2  HIS  10           HD2      HIS  10  18.724   1.302  -5.778
  592    HE1  HIS  10           HE1      HIS  10  15.198   3.656  -5.707
  593    HE2  HIS  10           HE2      HIS  10  17.401   3.244  -6.847
  594    H    MET  11           H        MET  11  18.394   2.569  -2.003
  595    HA   MET  11           HA       MET  11  16.686   3.093   0.278
  596    HB2  MET  11           HB2      MET  11  18.497   4.932  -1.354
  597    HB3  MET  11           HB3      MET  11  17.631   5.435   0.093
  598    HG2  MET  11           HG2      MET  11  19.763   3.293  -0.033
  599    HG3  MET  11           HG3      MET  11  19.961   4.926   0.603
  600    HE1  MET  11           HE1      MET  11  17.670   4.821   3.812
  601    HE2  MET  11           HE2      MET  11  17.189   5.367   2.206
  602    HE3  MET  11           HE3      MET  11  18.772   5.804   2.851
  603    H    GLY  12           H        GLY  12  15.002   4.620   0.427
  604    HA2  GLY  12           HA2      GLY  12  13.241   4.906  -1.830
  605    HA3  GLY  12           HA3      GLY  12  13.012   5.578  -0.224
  606    H    GLY  13           H        GLY  13  13.162   6.570  -3.302
  607    HA2  GLY  13           HA2      GLY  13  13.696   9.295  -2.678
  608    HA3  GLY  13           HA3      GLY  13  15.070   8.596  -3.523
  609    H    GLY  14           H        GLY  14  12.993  10.682  -4.242
  610    HA2  GLY  14           HA2      GLY  14  12.705   9.894  -7.050
  611    HA3  GLY  14           HA3      GLY  14  11.208  10.221  -6.182
  612    H    LYS  15           H        LYS  15  11.451  11.816  -8.238
  613    HA   LYS  15           HA       LYS  15  13.085  14.154  -7.834
  614    HB2  LYS  15           HB2      LYS  15  10.935  13.469  -9.863
  615    HB3  LYS  15           HB3      LYS  15  11.599  15.096  -9.774
  616    HG2  LYS  15           HG2      LYS  15  12.764  13.937 -11.513
  617    HG3  LYS  15           HG3      LYS  15  13.881  14.147 -10.168
  618    HD2  LYS  15           HD2      LYS  15  13.415  11.767  -9.482
  619    HD3  LYS  15           HD3      LYS  15  12.423  11.586 -10.933
  620    HE2  LYS  15           HE2      LYS  15  15.396  12.213 -10.856
  621    HE3  LYS  15           HE3      LYS  15  14.671  10.666 -11.297
  622    HZ1  LYS  15           HZ1      LYS  15  15.323  11.948 -13.230
  623    HZ2  LYS  15           HZ2      LYS  15  14.312  13.219 -12.765
  624    HZ3  LYS  15           HZ3      LYS  15  13.646  11.730 -13.198
  625    H    GLY  16           H        GLY  16   9.495  13.859  -7.953
  626    HA2  GLY  16           HA2      GLY  16   9.007  15.312  -5.564
  627    HA3  GLY  16           HA3      GLY  16   8.905  16.405  -6.937
  628    HA   PRO  17           HA       PRO  17   4.645  14.514  -6.618
  629    HB2  PRO  17           HB2      PRO  17   3.185  16.772  -6.467
  630    HB3  PRO  17           HB3      PRO  17   4.081  16.188  -5.056
  631    HG2  PRO  17           HG2      PRO  17   4.836  18.354  -7.013
  632    HG3  PRO  17           HG3      PRO  17   4.928  18.372  -5.239
  633    HD2  PRO  17           HD2      PRO  17   7.081  17.817  -6.897
  634    HD3  PRO  17           HD3      PRO  17   6.958  17.249  -5.218
  635    H    ALA  18           H        ALA  18   2.746  14.801  -8.127
  636    HA   ALA  18           HA       ALA  18   3.667  15.290 -10.889
  637    HB1  ALA  18           HB1      ALA  18   2.686  13.090 -10.347
  638    HB2  ALA  18           HB2      ALA  18   1.723  13.939 -11.555
  639    HB3  ALA  18           HB3      ALA  18   1.175  13.872  -9.878
  640    H    ALA  19           H        ALA  19   1.808  16.056 -12.411
  641    HA   ALA  19           HA       ALA  19   1.040  18.737 -11.617
  642    HB1  ALA  19           HB1      ALA  19   1.941  18.291 -13.864
  643    HB2  ALA  19           HB2      ALA  19   0.326  18.991 -13.959
  644    HB3  ALA  19           HB3      ALA  19   0.559  17.262 -14.230
  645    H    GLU  20           H        GLU  20  -0.862  19.241 -10.694
  646    HA   GLU  20           HA       GLU  20  -3.178  17.394 -10.852
  647    HB2  GLU  20           HB2      GLU  20  -2.634  19.590  -8.805
  648    HB3  GLU  20           HB3      GLU  20  -3.920  18.386  -8.735
  649    HG2  GLU  20           HG2      GLU  20  -2.194  16.600  -8.549
  650    HG3  GLU  20           HG3      GLU  20  -0.941  17.837  -8.544
  651    H    GLU  21           H        GLU  21  -4.656  18.018 -12.318
  652    HA   GLU  21           HA       GLU  21  -4.867  20.673 -13.387
  653    HB2  GLU  21           HB2      GLU  21  -6.677  19.836 -14.792
  654    HB3  GLU  21           HB3      GLU  21  -5.351  18.686 -14.799
  655    HG2  GLU  21           HG2      GLU  21  -7.863  18.363 -13.131
  656    HG3  GLU  21           HG3      GLU  21  -7.662  17.689 -14.742
  657    HA   PRO  22           HA       PRO  22  -7.578  22.660 -10.453
  658    HB2  PRO  22           HB2      PRO  22  -8.911  24.010 -12.793
  659    HB3  PRO  22           HB3      PRO  22  -8.148  24.727 -11.364
  660    HG2  PRO  22           HG2      PRO  22  -6.901  24.787 -13.726
  661    HG3  PRO  22           HG3      PRO  22  -5.983  24.477 -12.235
  662    HD2  PRO  22           HD2      PRO  22  -6.921  22.511 -14.330
  663    HD3  PRO  22           HD3      PRO  22  -5.356  22.597 -13.489
  664    H    LEU  23           H        LEU  23  -9.665  22.703  -9.592
  665    HA   LEU  23           HA       LEU  23 -11.778  22.138  -9.078
  666    HB2  LEU  23           HB2      LEU  23 -12.154  21.718 -12.067
  667    HB3  LEU  23           HB3      LEU  23 -13.454  21.811 -10.891
  668    HG   LEU  23           HG       LEU  23 -11.559  24.091 -11.606
  669   HD11  LEU  23          HD11      LEU  23 -13.123  23.603 -13.422
  670   HD12  LEU  23          HD12      LEU  23 -13.507  25.147 -12.665
  671   HD13  LEU  23          HD13      LEU  23 -14.487  23.723 -12.307
  672   HD21  LEU  23          HD21      LEU  23 -13.023  25.514 -10.208
  673   HD22  LEU  23          HD22      LEU  23 -12.248  24.254  -9.253
  674   HD23  LEU  23          HD23      LEU  23 -13.945  24.091  -9.714
  675    H    SER  24           H        SER  24  -9.598  19.919  -9.800
  676    HA   SER  24           HA       SER  24 -11.391  17.555  -9.825
  677    HB2  SER  24           HB2      SER  24  -9.910  17.621 -11.761
  678    HB3  SER  24           HB3      SER  24  -8.505  17.873 -10.730
  679    HG   SER  24           HG       SER  24  -8.360  15.777 -10.868
  680    H    LEU  25           H        LEU  25 -11.778  17.307  -7.622
  681    HA   LEU  25           HA       LEU  25  -9.831  15.820  -6.130
  682    HB2  LEU  25           HB2      LEU  25  -9.242  18.360  -5.777
  683    HB3  LEU  25           HB3      LEU  25 -10.649  18.407  -4.744
  684    HG   LEU  25           HG       LEU  25  -8.280  16.546  -4.268
  685   HD11  LEU  25          HD11      LEU  25  -7.501  18.126  -2.546
  686   HD12  LEU  25          HD12      LEU  25  -8.767  19.266  -3.010
  687   HD13  LEU  25          HD13      LEU  25  -7.485  18.852  -4.152
  688   HD21  LEU  25          HD21      LEU  25 -10.327  15.780  -3.151
  689   HD22  LEU  25          HD22      LEU  25 -10.530  17.360  -2.392
  690   HD23  LEU  25          HD23      LEU  25  -9.151  16.343  -1.965
  691    H    LEU  26           H        LEU  26 -11.087  14.251  -5.292
  692    HA   LEU  26           HA       LEU  26 -13.611  14.854  -3.908
  693    HB2  LEU  26           HB2      LEU  26 -13.701  14.012  -6.538
  694    HB3  LEU  26           HB3      LEU  26 -13.758  12.465  -5.717
  695    HG   LEU  26           HG       LEU  26 -15.725  14.750  -5.276
  696   HD11  LEU  26          HD11      LEU  26 -17.341  13.409  -6.558
  697   HD12  LEU  26          HD12      LEU  26 -16.086  12.217  -6.905
  698   HD13  LEU  26          HD13      LEU  26 -15.946  13.860  -7.533
  699   HD21  LEU  26          HD21      LEU  26 -15.585  13.343  -3.279
  700   HD22  LEU  26          HD22      LEU  26 -15.841  11.889  -4.247
  701   HD23  LEU  26          HD23      LEU  26 -17.129  13.091  -4.091
  702    H    ASP  27           H        ASP  27 -10.939  14.103  -3.051
  703    HA   ASP  27           HA       ASP  27  -9.923  12.910  -1.430
  704    HB2  ASP  27           HB2      ASP  27 -12.803  12.231  -0.699
  705    HB3  ASP  27           HB3      ASP  27 -11.423  11.924   0.354
  706    H    ASP  28           H        ASP  28 -10.337  11.485  -4.002
  707    HA   ASP  28           HA       ASP  28 -10.974   8.777  -3.716
  708    HB2  ASP  28           HB2      ASP  28 -10.568  10.002  -5.895
  709    HB3  ASP  28           HB3      ASP  28  -8.832   9.906  -5.588
  710    H    MET  29           H        MET  29  -7.920  10.448  -3.110
  711    HA   MET  29           HA       MET  29  -6.219   8.339  -2.453
  712    HB2  MET  29           HB2      MET  29  -5.229  10.481  -2.631
  713    HB3  MET  29           HB3      MET  29  -6.388  11.223  -1.538
  714    HG2  MET  29           HG2      MET  29  -5.305  10.349   0.379
  715    HG3  MET  29           HG3      MET  29  -4.395   9.171  -0.561
  716    HE1  MET  29           HE1      MET  29  -3.084  10.572  -2.887
  717    HE2  MET  29           HE2      MET  29  -2.162   9.614  -1.724
  718    HE3  MET  29           HE3      MET  29  -1.597  11.221  -2.190
  719    H    ASN  30           H        ASN  30  -8.551  10.057  -0.331
  720    HA   ASN  30           HA       ASN  30  -7.935   8.652   2.073
  721    HB2  ASN  30           HB2      ASN  30  -9.111  10.861   2.012
  722    HB3  ASN  30           HB3      ASN  30 -10.526  10.075   1.315
  723   HD21  ASN  30          HD21      ASN  30 -11.885  10.604   3.031
  724   HD22  ASN  30          HD22      ASN  30 -11.727   9.907   4.602
  725    H    HIS  31           H        HIS  31 -10.318   8.082  -0.522
  726    HA   HIS  31           HA       HIS  31 -11.596   5.814   0.643
  727    HB2  HIS  31           HB2      HIS  31 -11.435   6.696  -2.261
  728    HB3  HIS  31           HB3      HIS  31 -12.455   5.377  -1.689
  729    HD2  HIS  31           HD2      HIS  31 -12.769   9.032  -2.350
  730    HE1  HIS  31           HE1      HIS  31 -15.633   8.199   0.637
  731    HE2  HIS  31           HE2      HIS  31 -14.698   9.962  -0.911
  732    H    CYS  32           H        CYS  32  -8.745   6.156  -1.405
  733    HA   CYS  32           HA       CYS  32  -8.260   3.380  -1.872
  734    HB2  CYS  32           HB2      CYS  32  -6.449   5.815  -2.060
  735    HB3  CYS  32           HB3      CYS  32  -5.902   4.187  -2.456
  736    HG   CYS  32           HG       CYS  32  -7.829   6.279  -4.248
  737    H    TYR  33           H        TYR  33  -7.025   5.674   0.559
  738    HA   TYR  33           HA       TYR  33  -5.396   3.921   2.050
  739    HB2  TYR  33           HB2      TYR  33  -6.712   6.570   2.596
  740    HB3  TYR  33           HB3      TYR  33  -6.142   5.672   3.995
  741    HD1  TYR  33           HD1      TYR  33  -3.657   4.693   3.699
  742    HD2  TYR  33           HD2      TYR  33  -5.154   8.150   1.675
  743    HE1  TYR  33           HE1      TYR  33  -1.373   5.543   3.460
  744    HE2  TYR  33           HE2      TYR  33  -2.864   8.997   1.432
  745    HH   TYR  33           HH       TYR  33  -0.175   7.192   1.781
  746    H    SER  34           H        SER  34  -8.865   4.568   2.205
  747    HA   SER  34           HA       SER  34  -9.574   3.127   4.508
  748    HB2  SER  34           HB2      SER  34 -11.144   4.618   3.297
  749    HB3  SER  34           HB3      SER  34 -11.184   3.497   1.946
  750    HG   SER  34           HG       SER  34 -12.980   3.136   3.235
  751    H    ARG  35           H        ARG  35  -9.187   2.040   1.133
  752    HA   ARG  35           HA       ARG  35  -9.934  -0.677   1.684
  753    HB2  ARG  35           HB2      ARG  35  -9.467   0.874  -0.711
  754    HB3  ARG  35           HB3      ARG  35  -8.445  -0.554  -0.808
  755    HG2  ARG  35           HG2      ARG  35 -11.432  -0.598  -0.281
  756    HG3  ARG  35           HG3      ARG  35 -10.678  -0.892  -1.851
  757    HD2  ARG  35           HD2      ARG  35  -9.623  -2.910  -1.030
  758    HD3  ARG  35           HD3      ARG  35 -10.124  -2.560   0.628
  759    HE   ARG  35           HE       ARG  35 -12.428  -2.708  -0.935
  760   HH11  ARG  35          HH11      ARG  35  -9.960  -4.889   0.144
  761   HH12  ARG  35          HH12      ARG  35 -11.016  -6.252   0.101
  762   HH21  ARG  35          HH21      ARG  35 -13.739  -4.464  -0.942
  763   HH22  ARG  35          HH22      ARG  35 -13.117  -6.016  -0.496
  764    H    LEU  36           H        LEU  36  -6.813   1.012   1.616
  765    HA   LEU  36           HA       LEU  36  -5.114  -1.232   1.846
  766    HB2  LEU  36           HB2      LEU  36  -4.838   1.522   3.118
  767    HB3  LEU  36           HB3      LEU  36  -3.562   0.313   3.106
  768    HG   LEU  36           HG       LEU  36  -4.729   1.719   0.674
  769   HD11  LEU  36          HD11      LEU  36  -1.980   1.935   1.937
  770   HD12  LEU  36          HD12      LEU  36  -3.248   3.161   1.964
  771   HD13  LEU  36          HD13      LEU  36  -2.494   2.714   0.437
  772   HD21  LEU  36          HD21      LEU  36  -2.554  -0.408   0.760
  773   HD22  LEU  36          HD22      LEU  36  -3.016   0.536  -0.660
  774   HD23  LEU  36          HD23      LEU  36  -4.166  -0.586   0.060
  775    H    ARG  37           H        ARG  37  -6.835   0.636   4.342
  776    HA   ARG  37           HA       ARG  37  -6.117  -0.763   6.655
  777    HB2  ARG  37           HB2      ARG  37  -8.638   0.755   5.938
  778    HB3  ARG  37           HB3      ARG  37  -8.322   0.133   7.560
  779    HG2  ARG  37           HG2      ARG  37  -6.497   1.595   7.910
  780    HG3  ARG  37           HG3      ARG  37  -6.304   1.920   6.185
  781    HD2  ARG  37           HD2      ARG  37  -7.231   3.838   7.353
  782    HD3  ARG  37           HD3      ARG  37  -8.376   3.208   6.172
  783    HE   ARG  37           HE       ARG  37  -8.811   2.178   8.816
  784   HH11  ARG  37          HH11      ARG  37  -9.556   4.866   6.755
  785   HH12  ARG  37          HH12      ARG  37 -10.936   5.315   7.691
  786   HH21  ARG  37          HH21      ARG  37 -10.579   2.777   9.965
  787   HH22  ARG  37          HH22      ARG  37 -11.500   4.165   9.489
  788    H    GLU  38           H        GLU  38  -8.301  -1.712   4.105
  789    HA   GLU  38           HA       GLU  38  -9.646  -3.797   5.678
  790    HB2  GLU  38           HB2      GLU  38  -9.955  -2.924   2.774
  791    HB3  GLU  38           HB3      GLU  38 -10.928  -4.184   3.538
  792    HG2  GLU  38           HG2      GLU  38 -11.919  -2.582   5.064
  793    HG3  GLU  38           HG3      GLU  38 -10.835  -1.309   4.503
  794    H    LEU  39           H        LEU  39  -7.130  -3.462   3.259
  795    HA   LEU  39           HA       LEU  39  -7.044  -6.296   2.562
  796    HB2  LEU  39           HB2      LEU  39  -5.458  -3.900   1.603
  797    HB3  LEU  39           HB3      LEU  39  -5.162  -5.535   1.031
  798    HG   LEU  39           HG       LEU  39  -7.790  -4.030   0.684
  799   HD11  LEU  39          HD11      LEU  39  -5.619  -4.580  -1.357
  800   HD12  LEU  39          HD12      LEU  39  -6.051  -3.008  -0.681
  801   HD13  LEU  39          HD13      LEU  39  -7.201  -3.871  -1.699
  802   HD21  LEU  39          HD21      LEU  39  -8.128  -6.460   0.825
  803   HD22  LEU  39          HD22      LEU  39  -6.930  -6.718  -0.446
  804   HD23  LEU  39          HD23      LEU  39  -8.435  -5.869  -0.805
  805    H    VAL  40           H        VAL  40  -5.460  -4.268   4.859
  806    HA   VAL  40           HA       VAL  40  -3.229  -6.180   5.224
  807    HB   VAL  40           HB       VAL  40  -3.637  -3.554   6.739
  808   HG11  VAL  40          HG11      VAL  40  -2.104  -5.128   7.848
  809   HG12  VAL  40          HG12      VAL  40  -1.211  -3.738   7.235
  810   HG13  VAL  40          HG13      VAL  40  -1.146  -5.277   6.372
  811   HG21  VAL  40          HG21      VAL  40  -2.018  -3.994   4.197
  812   HG22  VAL  40          HG22      VAL  40  -2.018  -2.521   5.174
  813   HG23  VAL  40          HG23      VAL  40  -3.495  -3.033   4.356
  814    HA   PRO  41           HA       PRO  41  -5.800  -7.780   8.746
  815    HB2  PRO  41           HB2      PRO  41  -4.846 -10.319   8.746
  816    HB3  PRO  41           HB3      PRO  41  -6.019  -9.779   7.536
  817    HG2  PRO  41           HG2      PRO  41  -3.021 -10.025   7.285
  818    HG3  PRO  41           HG3      PRO  41  -4.283 -10.577   6.159
  819    HD2  PRO  41           HD2      PRO  41  -2.919  -8.219   5.831
  820    HD3  PRO  41           HD3      PRO  41  -4.582  -8.451   5.260
  821    H    GLY  42           H        GLY  42  -2.418  -7.321   8.272
  822    HA2  GLY  42           HA2      GLY  42  -1.546  -8.178  10.933
  823    HA3  GLY  42           HA3      GLY  42  -0.549  -7.485   9.664
  824    H    VAL  43           H        VAL  43  -3.532  -6.146  11.036
  825    HA   VAL  43           HA       VAL  43  -2.050  -3.829  12.141
  826    HB   VAL  43           HB       VAL  43  -4.983  -3.951  11.261
  827   HG11  VAL  43          HG11      VAL  43  -4.663  -2.375  13.110
  828   HG12  VAL  43          HG12      VAL  43  -4.993  -1.500  11.617
  829   HG13  VAL  43          HG13      VAL  43  -3.344  -1.581  12.246
  830   HG21  VAL  43          HG21      VAL  43  -2.621  -2.586   9.894
  831   HG22  VAL  43          HG22      VAL  43  -4.311  -2.447   9.401
  832   HG23  VAL  43          HG23      VAL  43  -3.494  -4.006   9.309
  833    HA   PRO  44           HA       PRO  44  -3.295  -5.907  16.071
  834    HB2  PRO  44           HB2      PRO  44  -2.026  -3.426  17.214
  835    HB3  PRO  44           HB3      PRO  44  -1.746  -5.126  17.627
  836    HG2  PRO  44           HG2      PRO  44   0.053  -3.797  16.176
  837    HG3  PRO  44           HG3      PRO  44  -0.353  -5.479  15.760
  838    HD2  PRO  44           HD2      PRO  44  -1.306  -2.920  14.457
  839    HD3  PRO  44           HD3      PRO  44  -0.758  -4.429  13.693
  840    H    ARG  45           H        ARG  45  -4.802  -5.512  17.768
  841    HA   ARG  45           HA       ARG  45  -7.014  -3.817  17.201
  842    HB2  ARG  45           HB2      ARG  45  -7.235  -5.944  18.425
  843    HB3  ARG  45           HB3      ARG  45  -6.316  -5.280  19.771
  844    HG2  ARG  45           HG2      ARG  45  -8.095  -3.585  20.139
  845    HG3  ARG  45           HG3      ARG  45  -9.018  -4.282  18.806
  846    HD2  ARG  45           HD2      ARG  45  -8.254  -5.714  21.362
  847    HD3  ARG  45           HD3      ARG  45  -9.842  -5.031  21.005
  848    HE   ARG  45           HE       ARG  45  -8.655  -7.192  19.370
  849   HH11  ARG  45          HH11      ARG  45 -11.372  -5.957  21.120
  850   HH12  ARG  45          HH12      ARG  45 -12.373  -7.293  20.682
  851   HH21  ARG  45          HH21      ARG  45  -9.959  -8.877  18.849
  852   HH22  ARG  45          HH22      ARG  45 -11.587  -8.923  19.435
  853    H    GLY  46           H        GLY  46  -7.317  -1.713  17.659
  854    HA2  GLY  46           HA2      GLY  46  -7.130   0.402  18.508
  855    HA3  GLY  46           HA3      GLY  46  -6.797  -0.373  20.047
  856    H    THR  47           H        THR  47  -4.717  -0.642  17.190
  857    HA   THR  47           HA       THR  47  -2.371   0.055  18.674
  858    HB   THR  47           HB       THR  47  -2.230  -1.606  16.889
  859    HG1  THR  47           HG1      THR  47  -0.664   0.734  16.399
  860   HG21  THR  47          HG21      THR  47  -2.771   0.651  14.937
  861   HG22  THR  47          HG22      THR  47  -3.867  -0.686  15.295
  862   HG23  THR  47          HG23      THR  47  -2.314  -0.990  14.507
  863    H    GLN  48           H        GLN  48  -4.573   1.973  16.795
  864    HA   GLN  48           HA       GLN  48  -4.790   4.193  16.378
  865    HB2  GLN  48           HB2      GLN  48  -2.473   4.514  18.335
  866    HB3  GLN  48           HB3      GLN  48  -3.540   5.813  17.814
  867    HG2  GLN  48           HG2      GLN  48  -5.406   4.879  19.006
  868    HG3  GLN  48           HG3      GLN  48  -4.557   3.357  19.283
  869   HE21  GLN  48          HE21      GLN  48  -4.807   6.708  20.282
  870   HE22  GLN  48          HE22      GLN  48  -3.929   6.529  21.759
  871    H    LEU  49           H        LEU  49  -4.275   4.685  14.269
  872    HA   LEU  49           HA       LEU  49  -1.423   4.823  13.452
  873    HB2  LEU  49           HB2      LEU  49  -3.737   3.713  11.812
  874    HB3  LEU  49           HB3      LEU  49  -2.094   3.916  11.223
  875    HG   LEU  49           HG       LEU  49  -2.994   1.986  13.402
  876   HD11  LEU  49          HD11      LEU  49  -3.642   1.252  11.162
  877   HD12  LEU  49          HD12      LEU  49  -2.371   0.217  11.812
  878   HD13  LEU  49          HD13      LEU  49  -1.979   1.437  10.596
  879   HD21  LEU  49          HD21      LEU  49  -0.741   2.812  13.948
  880   HD22  LEU  49          HD22      LEU  49  -0.176   2.412  12.325
  881   HD23  LEU  49          HD23      LEU  49  -0.676   1.130  13.430
  882    H    SER  50           H        SER  50  -0.929   6.069  11.637
  883    HA   SER  50           HA       SER  50  -2.736   8.270  10.823
  884    HB2  SER  50           HB2      SER  50  -0.790   9.200  11.956
  885    HB3  SER  50           HB3      SER  50   0.309   8.154  11.060
  886    HG   SER  50           HG       SER  50  -0.700  10.587  10.395
  887    H    GLN  51           H        GLN  51  -2.105   9.048   8.466
  888    HA   GLN  51           HA       GLN  51  -2.418   7.081   6.514
  889    HB2  GLN  51           HB2      GLN  51  -1.086   9.806   6.243
  890    HB3  GLN  51           HB3      GLN  51  -1.536   8.797   4.873
  891    HG2  GLN  51           HG2      GLN  51  -3.916   8.965   5.556
  892    HG3  GLN  51           HG3      GLN  51  -3.444  10.021   6.887
  893   HE21  GLN  51          HE21      GLN  51  -2.045  10.136   3.623
  894   HE22  GLN  51          HE22      GLN  51  -2.672  11.691   3.229
  895    H    VAL  52           H        VAL  52   0.596   8.471   7.774
  896    HA   VAL  52           HA       VAL  52   2.419   7.176   5.999
  897    HB   VAL  52           HB       VAL  52   3.067   8.103   8.845
  898   HG11  VAL  52          HG11      VAL  52   4.836   7.863   6.372
  899   HG12  VAL  52          HG12      VAL  52   4.866   6.799   7.781
  900   HG13  VAL  52          HG13      VAL  52   5.349   8.486   7.946
  901   HG21  VAL  52          HG21      VAL  52   3.604  10.321   7.907
  902   HG22  VAL  52          HG22      VAL  52   1.903   9.923   7.655
  903   HG23  VAL  52          HG23      VAL  52   3.047   9.789   6.316
  904    H    GLU  53           H        GLU  53   1.281   6.411   9.274
  905    HA   GLU  53           HA       GLU  53   2.695   4.026   9.773
  906    HB2  GLU  53           HB2      GLU  53  -0.011   4.976  10.789
  907    HB3  GLU  53           HB3      GLU  53   0.845   3.591  11.448
  908    HG2  GLU  53           HG2      GLU  53   2.039   6.372  11.419
  909    HG3  GLU  53           HG3      GLU  53   1.020   5.784  12.732
  910    H    ILE  54           H        ILE  54  -0.384   4.579   8.083
  911    HA   ILE  54           HA       ILE  54  -1.192   1.903   7.685
  912    HB   ILE  54           HB       ILE  54  -1.669   4.378   5.953
  913   HG12  ILE  54          HG12      ILE  54  -3.566   2.954   7.896
  914   HG13  ILE  54          HG13      ILE  54  -2.682   4.431   8.254
  915   HG21  ILE  54          HG21      ILE  54  -3.004   1.654   5.674
  916   HG22  ILE  54          HG22      ILE  54  -1.906   2.407   4.518
  917   HG23  ILE  54          HG23      ILE  54  -3.486   3.123   4.814
  918   HD11  ILE  54          HD11      ILE  54  -4.804   4.123   6.131
  919   HD12  ILE  54          HD12      ILE  54  -3.919   5.607   6.503
  920   HD13  ILE  54          HD13      ILE  54  -4.994   4.896   7.705
  921    H    LEU  55           H        LEU  55   0.711   4.092   5.552
  922    HA   LEU  55           HA       LEU  55   1.381   2.333   3.501
  923    HB2  LEU  55           HB2      LEU  55   3.074   4.586   4.644
  924    HB3  LEU  55           HB3      LEU  55   3.370   3.802   3.099
  925    HG   LEU  55           HG       LEU  55   0.928   5.478   3.799
  926   HD11  LEU  55          HD11      LEU  55   1.827   7.108   2.190
  927   HD12  LEU  55          HD12      LEU  55   3.258   6.104   1.954
  928   HD13  LEU  55          HD13      LEU  55   2.945   6.844   3.526
  929   HD21  LEU  55          HD21      LEU  55   0.284   5.242   1.428
  930   HD22  LEU  55          HD22      LEU  55   0.313   3.680   2.238
  931   HD23  LEU  55          HD23      LEU  55   1.636   4.135   1.161
  932    H    GLN  56           H        GLN  56   3.035   2.849   6.595
  933    HA   GLN  56           HA       GLN  56   5.264   1.160   6.216
  934    HB2  GLN  56           HB2      GLN  56   3.836   1.973   8.774
  935    HB3  GLN  56           HB3      GLN  56   5.396   1.159   8.729
  936    HG2  GLN  56           HG2      GLN  56   6.409   3.080   7.611
  937    HG3  GLN  56           HG3      GLN  56   4.841   3.885   7.524
  938   HE21  GLN  56          HE21      GLN  56   5.539   5.663   8.719
  939   HE22  GLN  56          HE22      GLN  56   5.849   5.585  10.415
  940    H    ARG  57           H        ARG  57   2.131   0.471   7.905
  941    HA   ARG  57           HA       ARG  57   2.584  -2.271   8.457
  942    HB2  ARG  57           HB2      ARG  57   0.151  -0.513   8.408
  943    HB3  ARG  57           HB3      ARG  57  -0.149  -2.236   8.287
  944    HG2  ARG  57           HG2      ARG  57  -0.378  -1.718  10.570
  945    HG3  ARG  57           HG3      ARG  57   1.180  -2.523  10.431
  946    HD2  ARG  57           HD2      ARG  57   0.871   0.492  10.537
  947    HD3  ARG  57           HD3      ARG  57   1.076  -0.505  11.977
  948    HE   ARG  57           HE       ARG  57   3.185  -1.046  10.192
  949   HH11  ARG  57          HH11      ARG  57   2.092   1.596  12.160
  950   HH12  ARG  57          HH12      ARG  57   3.691   2.175  12.442
  951   HH21  ARG  57          HH21      ARG  57   5.220  -0.251  10.589
  952   HH22  ARG  57          HH22      ARG  57   5.414   1.164  11.566
  953    H    VAL  58           H        VAL  58   1.391  -0.679   5.564
  954    HA   VAL  58           HA       VAL  58   0.592  -2.965   4.088
  955    HB   VAL  58           HB       VAL  58   1.532  -0.207   3.166
  956   HG11  VAL  58          HG11      VAL  58   0.391  -2.429   1.433
  957   HG12  VAL  58          HG12      VAL  58   2.035  -1.793   1.371
  958   HG13  VAL  58          HG13      VAL  58   0.680  -0.765   0.910
  959   HG21  VAL  58          HG21      VAL  58  -0.862   0.180   2.648
  960   HG22  VAL  58          HG22      VAL  58  -0.637  -0.223   4.349
  961   HG23  VAL  58          HG23      VAL  58  -1.258  -1.438   3.236
  962    H    ILE  59           H        ILE  59   3.730  -1.175   4.181
  963    HA   ILE  59           HA       ILE  59   5.200  -2.782   2.399
  964    HB   ILE  59           HB       ILE  59   6.221  -1.248   4.843
  965   HG12  ILE  59          HG12      ILE  59   6.209  -0.409   1.899
  966   HG13  ILE  59          HG13      ILE  59   5.060   0.155   3.101
  967   HG21  ILE  59          HG21      ILE  59   8.468  -1.295   3.785
  968   HG22  ILE  59          HG22      ILE  59   7.844  -2.331   2.500
  969   HG23  ILE  59          HG23      ILE  59   7.903  -2.922   4.162
  970   HD11  ILE  59          HD11      ILE  59   6.753   1.817   2.671
  971   HD12  ILE  59          HD12      ILE  59   8.030   0.680   3.103
  972   HD13  ILE  59          HD13      ILE  59   6.886   1.234   4.331
  973    H    ASP  60           H        ASP  60   4.859  -3.058   5.955
  974    HA   ASP  60           HA       ASP  60   6.403  -5.324   6.470
  975    HB2  ASP  60           HB2      ASP  60   3.837  -4.451   7.870
  976    HB3  ASP  60           HB3      ASP  60   5.000  -5.598   8.527
  977    H    TYR  61           H        TYR  61   2.965  -5.123   5.616
  978    HA   TYR  61           HA       TYR  61   2.250  -7.834   5.670
  979    HB2  TYR  61           HB2      TYR  61   0.549  -6.117   5.548
  980    HB3  TYR  61           HB3      TYR  61   1.205  -5.479   4.047
  981    HD1  TYR  61           HD1      TYR  61  -0.313  -8.641   5.427
  982    HD2  TYR  61           HD2      TYR  61   0.154  -6.100   2.012
  983    HE1  TYR  61           HE1      TYR  61  -1.903 -10.029   4.170
  984    HE2  TYR  61           HE2      TYR  61  -1.454  -7.489   0.776
  985    HH   TYR  61           HH       TYR  61  -2.308  -9.800   0.817
  986    H    ILE  62           H        ILE  62   3.471  -5.866   2.950
  987    HA   ILE  62           HA       ILE  62   3.360  -7.941   0.987
  988    HB   ILE  62           HB       ILE  62   4.957  -5.332   0.911
  989   HG12  ILE  62          HG12      ILE  62   2.170  -5.931  -0.221
  990   HG13  ILE  62          HG13      ILE  62   2.490  -4.963   1.211
  991   HG21  ILE  62          HG21      ILE  62   4.136  -7.174  -1.368
  992   HG22  ILE  62          HG22      ILE  62   5.777  -6.938  -0.766
  993   HG23  ILE  62          HG23      ILE  62   4.932  -5.609  -1.554
  994   HD11  ILE  62          HD11      ILE  62   3.653  -3.303  -0.178
  995   HD12  ILE  62          HD12      ILE  62   1.985  -3.558  -0.689
  996   HD13  ILE  62          HD13      ILE  62   3.305  -4.274  -1.612
  997    H    LEU  63           H        LEU  63   5.839  -6.949   3.307
  998    HA   LEU  63           HA       LEU  63   8.072  -8.291   2.200
  999    HB2  LEU  63           HB2      LEU  63   7.412  -7.481   5.047
 1000    HB3  LEU  63           HB3      LEU  63   8.939  -8.240   4.624
 1001    HG   LEU  63           HG       LEU  63   7.950  -5.567   3.547
 1002   HD11  LEU  63          HD11      LEU  63  10.128  -6.135   5.579
 1003   HD12  LEU  63          HD12      LEU  63   8.561  -5.393   5.905
 1004   HD13  LEU  63          HD13      LEU  63   9.735  -4.550   4.898
 1005   HD21  LEU  63          HD21      LEU  63  10.584  -6.999   3.065
 1006   HD22  LEU  63          HD22      LEU  63  10.205  -5.353   2.555
 1007   HD23  LEU  63          HD23      LEU  63   9.312  -6.710   1.876
 1008    H    ASP  64           H        ASP  64   5.440  -9.506   4.237
 1009    HA   ASP  64           HA       ASP  64   6.525 -12.141   4.628
 1010    HB2  ASP  64           HB2      ASP  64   3.722 -10.984   4.923
 1011    HB3  ASP  64           HB3      ASP  64   4.080 -12.678   5.243
 1012    H    LEU  65           H        LEU  65   4.534 -10.642   2.137
 1013    HA   LEU  65           HA       LEU  65   3.780 -13.058   0.753
 1014    HB2  LEU  65           HB2      LEU  65   3.871 -10.208  -0.319
 1015    HB3  LEU  65           HB3      LEU  65   2.981 -11.554  -1.016
 1016    HG   LEU  65           HG       LEU  65   2.387 -10.234   1.660
 1017   HD11  LEU  65          HD11      LEU  65   0.852 -10.101  -0.947
 1018   HD12  LEU  65          HD12      LEU  65   1.771  -8.791  -0.206
 1019   HD13  LEU  65          HD13      LEU  65   0.332  -9.416   0.593
 1020   HD21  LEU  65          HD21      LEU  65   1.847 -12.621   1.753
 1021   HD22  LEU  65          HD22      LEU  65   0.890 -12.486   0.274
 1022   HD23  LEU  65          HD23      LEU  65   0.376 -11.653   1.744
 1023    H    GLN  66           H        GLN  66   6.387 -10.753   0.499
 1024    HA   GLN  66           HA       GLN  66   7.654 -12.066  -1.824
 1025    HB2  GLN  66           HB2      GLN  66   8.335  -9.436  -0.424
 1026    HB3  GLN  66           HB3      GLN  66   9.075 -10.027  -1.907
 1027    HG2  GLN  66           HG2      GLN  66   6.120  -9.382  -1.689
 1028    HG3  GLN  66           HG3      GLN  66   7.329  -8.187  -2.141
 1029   HE21  GLN  66          HE21      GLN  66   6.348  -7.878  -4.159
 1030   HE22  GLN  66          HE22      GLN  66   6.474  -9.040  -5.424
 1031    H    VAL  67           H        VAL  67  10.237 -11.931  -1.585
 1032    HA   VAL  67           HA       VAL  67  11.088 -13.105   0.962
 1033    HB   VAL  67           HB       VAL  67  12.770 -12.380  -1.491
 1034   HG11  VAL  67          HG11      VAL  67  14.139 -12.509   0.545
 1035   HG12  VAL  67          HG12      VAL  67  14.503 -13.866  -0.518
 1036   HG13  VAL  67          HG13      VAL  67  13.494 -14.112   0.911
 1037   HG21  VAL  67          HG21      VAL  67  12.700 -14.798  -2.052
 1038   HG22  VAL  67          HG22      VAL  67  11.088 -14.082  -2.059
 1039   HG23  VAL  67          HG23      VAL  67  11.601 -15.082  -0.699
 1040    H    VAL  68           H        VAL  68  11.152 -11.608   2.570
 1041    HA   VAL  68           HA       VAL  68  11.613  -8.868   2.367
 1042    HB   VAL  68           HB       VAL  68  10.416  -9.686   4.270
 1043   HG11  VAL  68          HG11      VAL  68  12.884 -11.225   5.157
 1044   HG12  VAL  68          HG12      VAL  68  11.397 -11.924   4.513
 1045   HG13  VAL  68          HG13      VAL  68  11.372 -11.083   6.061
 1046   HG21  VAL  68          HG21      VAL  68  11.703  -7.624   4.671
 1047   HG22  VAL  68          HG22      VAL  68  13.071  -8.571   5.259
 1048   HG23  VAL  68          HG23      VAL  68  11.553  -8.569   6.158
  Start of MODEL    9
    1    H1   MET   1           H1       MET   1 -12.120  -6.194  16.734
    2    H2   MET   1           H2       MET   1 -10.871  -7.233  16.272
    3    H3   MET   1           H3       MET   1 -11.219  -7.015  17.910
    4    HA   MET   1           HA       MET   1 -13.016  -8.245  15.907
    5    HB2  MET   1           HB2      MET   1 -11.485  -9.555  18.201
    6    HB3  MET   1           HB3      MET   1 -12.623 -10.375  17.138
    7    HG2  MET   1           HG2      MET   1 -10.452 -10.957  16.379
    8    HG3  MET   1           HG3      MET   1 -11.087  -9.794  15.215
    9    HE1  MET   1           HE1      MET   1  -7.792  -8.904  18.340
   10    HE2  MET   1           HE2      MET   1  -8.460 -10.504  18.026
   11    HE3  MET   1           HE3      MET   1  -9.449  -9.277  18.823
   12    H    GLY   2           H        GLY   2 -15.066  -8.874  16.657
   13    HA2  GLY   2           HA2      GLY   2 -16.855  -9.149  18.102
   14    HA3  GLY   2           HA3      GLY   2 -15.869  -8.588  19.440
   15    H    HIS   3           H        HIS   3 -15.571  -6.295  17.037
   16    HA   HIS   3           HA       HIS   3 -17.448  -4.463  18.360
   17    HB2  HIS   3           HB2      HIS   3 -15.352  -3.854  16.228
   18    HB3  HIS   3           HB3      HIS   3 -16.230  -2.674  17.197
   19    HD2  HIS   3           HD2      HIS   3 -15.487  -2.655  19.988
   20    HE1  HIS   3           HE1      HIS   3 -11.808  -4.609  19.238
   21    HE2  HIS   3           HE2      HIS   3 -13.242  -3.473  20.984
   22    H    HIS   4           H        HIS   4 -19.240  -3.616  17.406
   23    HA   HIS   4           HA       HIS   4 -20.360  -4.927  15.096
   24    HB2  HIS   4           HB2      HIS   4 -21.472  -2.636  16.768
   25    HB3  HIS   4           HB3      HIS   4 -22.386  -3.611  15.620
   26    HD2  HIS   4           HD2      HIS   4 -23.392  -5.959  16.624
   27    HE1  HIS   4           HE1      HIS   4 -21.450  -5.736  20.372
   28    HE2  HIS   4           HE2      HIS   4 -22.962  -7.121  18.893
   29    H    HIS   5           H        HIS   5 -19.125  -1.673  15.769
   30    HA   HIS   5           HA       HIS   5 -18.564   0.126  14.522
   31    HB2  HIS   5           HB2      HIS   5 -18.408  -1.918  12.266
   32    HB3  HIS   5           HB3      HIS   5 -17.779  -0.277  12.161
   33    HD2  HIS   5           HD2      HIS   5 -16.457  -3.676  12.906
   34    HE1  HIS   5           HE1      HIS   5 -13.963  -0.989  15.013
   35    HE2  HIS   5           HE2      HIS   5 -14.124  -3.271  13.943
   36    H    HIS   6           H        HIS   6 -21.361  -0.254  14.895
   37    HA   HIS   6           HA       HIS   6 -22.797   0.374  12.441
   38    HB2  HIS   6           HB2      HIS   6 -23.685   0.161  15.342
   39    HB3  HIS   6           HB3      HIS   6 -24.787   0.523  14.021
   40    HD2  HIS   6           HD2      HIS   6 -23.204  -1.926  12.104
   41    HE1  HIS   6           HE1      HIS   6 -25.275  -4.280  14.932
   42    HE2  HIS   6           HE2      HIS   6 -24.286  -4.220  12.613
   43    H    HIS   7           H        HIS   7 -20.804   2.361  13.132
   44    HA   HIS   7           HA       HIS   7 -22.272   4.736  14.034
   45    HB2  HIS   7           HB2      HIS   7 -19.337   4.336  13.319
   46    HB3  HIS   7           HB3      HIS   7 -20.025   5.859  13.878
   47    HD2  HIS   7           HD2      HIS   7 -19.453   2.214  15.316
   48    HE1  HIS   7           HE1      HIS   7 -19.709   5.008  18.481
   49    HE2  HIS   7           HE2      HIS   7 -19.549   2.560  17.879
   50    H    HIS   8           H        HIS   8 -22.793   6.438  12.732
   51    HA   HIS   8           HA       HIS   8 -22.094   6.483   9.883
   52    HB2  HIS   8           HB2      HIS   8 -24.500   6.708   9.216
   53    HB3  HIS   8           HB3      HIS   8 -24.125   5.130   9.888
   54    HD2  HIS   8           HD2      HIS   8 -24.939   4.994  12.788
   55    HE1  HIS   8           HE1      HIS   8 -28.185   7.573  11.983
   56    HE2  HIS   8           HE2      HIS   8 -27.309   5.752  13.493
   57    H    SER   9           H        SER   9 -21.663   8.514   9.264
   58    HA   SER   9           HA       SER   9 -22.968  10.853  10.498
   59    HB2  SER   9           HB2      SER   9 -19.933  10.479  10.422
   60    HB3  SER   9           HB3      SER   9 -20.757  11.970  10.892
   61    HG   SER   9           HG       SER   9 -21.818  10.126  12.391
   62    H    HIS  10           H        HIS  10 -22.087  12.920   9.328
   63    HA   HIS  10           HA       HIS  10 -21.620  12.360   6.454
   64    HB2  HIS  10           HB2      HIS  10 -22.691  14.603   6.009
   65    HB3  HIS  10           HB3      HIS  10 -23.775  13.389   6.662
   66    HD1  HIS  10           HD1      HIS  10 -24.943  13.916   8.861
   67    HD2  HIS  10           HD2      HIS  10 -22.117  16.780   7.824
   68    HE1  HIS  10           HE1      HIS  10 -25.364  15.860  10.376
   69    HE2  HIS  10           HE2      HIS  10 -23.693  17.604   9.691
   70    H    MET  11           H        MET  11 -19.601  12.776   5.831
   71    HA   MET  11           HA       MET  11 -17.896  14.691   7.231
   72    HB2  MET  11           HB2      MET  11 -16.105  13.938   5.716
   73    HB3  MET  11           HB3      MET  11 -16.873  12.584   6.522
   74    HG2  MET  11           HG2      MET  11 -17.860  11.805   4.538
   75    HG3  MET  11           HG3      MET  11 -17.695  13.365   3.730
   76    HE1  MET  11           HE1      MET  11 -13.992  10.694   4.600
   77    HE2  MET  11           HE2      MET  11 -15.609  10.240   5.128
   78    HE3  MET  11           HE3      MET  11 -14.803  11.632   5.852
   79    H    GLY  12           H        GLY  12 -16.508  16.176   5.727
   80    HA2  GLY  12           HA2      GLY  12 -17.776  17.259   3.368
   81    HA3  GLY  12           HA3      GLY  12 -18.016  18.277   4.784
   82    H    GLY  13           H        GLY  13 -16.691  19.244   2.564
   83    HA2  GLY  13           HA2      GLY  13 -14.775  20.713   2.587
   84    HA3  GLY  13           HA3      GLY  13 -13.877  19.506   3.491
   85    H    GLY  14           H        GLY  14 -13.808  20.942   0.648
   86    HA2  GLY  14           HA2      GLY  14 -13.323  18.545  -1.052
   87    HA3  GLY  14           HA3      GLY  14 -13.687  20.161  -1.633
   88    H    LYS  15           H        LYS  15 -11.192  18.046  -0.404
   89    HA   LYS  15           HA       LYS  15  -9.148  20.089  -0.251
   90    HB2  LYS  15           HB2      LYS  15  -8.989  17.056  -0.040
   91    HB3  LYS  15           HB3      LYS  15  -7.600  18.124   0.168
   92    HG2  LYS  15           HG2      LYS  15  -8.745  19.219   2.088
   93    HG3  LYS  15           HG3      LYS  15 -10.104  18.111   1.887
   94    HD2  LYS  15           HD2      LYS  15  -8.653  17.349   3.703
   95    HD3  LYS  15           HD3      LYS  15  -8.626  16.192   2.372
   96    HE2  LYS  15           HE2      LYS  15  -6.454  17.256   1.614
   97    HE3  LYS  15           HE3      LYS  15  -6.476  18.204   3.103
   98    HZ1  LYS  15           HZ1      LYS  15  -6.474  15.241   2.948
   99    HZ2  LYS  15           HZ2      LYS  15  -6.440  16.157   4.368
  100    HZ3  LYS  15           HZ3      LYS  15  -5.130  16.205   3.303
  101    H    GLY  16           H        GLY  16  -7.629  20.630  -1.703
  102    HA2  GLY  16           HA2      GLY  16  -7.317  19.114  -4.249
  103    HA3  GLY  16           HA3      GLY  16  -6.922  20.813  -4.015
  104    HA   PRO  17           HA       PRO  17  -3.615  18.007  -1.632
  105    HB2  PRO  17           HB2      PRO  17  -3.002  15.636  -2.905
  106    HB3  PRO  17           HB3      PRO  17  -4.237  15.778  -1.649
  107    HG2  PRO  17           HG2      PRO  17  -4.582  15.765  -4.646
  108    HG3  PRO  17           HG3      PRO  17  -5.511  14.890  -3.407
  109    HD2  PRO  17           HD2      PRO  17  -6.433  17.179  -4.527
  110    HD3  PRO  17           HD3      PRO  17  -6.757  16.783  -2.825
  111    H    ALA  18           H        ALA  18  -1.342  17.772  -2.027
  112    HA   ALA  18           HA       ALA  18  -0.318  19.431  -4.114
  113    HB1  ALA  18           HB1      ALA  18   1.877  18.977  -3.101
  114    HB2  ALA  18           HB2      ALA  18   1.168  17.705  -2.104
  115    HB3  ALA  18           HB3      ALA  18   0.682  19.386  -1.870
  116    H    ALA  19           H        ALA  19   0.137  18.826  -6.153
  117    HA   ALA  19           HA       ALA  19   0.132  16.117  -7.067
  118    HB1  ALA  19           HB1      ALA  19  -0.646  17.969  -8.483
  119    HB2  ALA  19           HB2      ALA  19   0.653  17.081  -9.277
  120    HB3  ALA  19           HB3      ALA  19   0.982  18.646  -8.528
  121    H    GLU  20           H        GLU  20   1.729  14.865  -6.268
  122    HA   GLU  20           HA       GLU  20   3.705  13.856  -5.905
  123    HB2  GLU  20           HB2      GLU  20   4.988  15.901  -7.761
  124    HB3  GLU  20           HB3      GLU  20   5.694  14.370  -7.266
  125    HG2  GLU  20           HG2      GLU  20   3.201  14.682  -8.982
  126    HG3  GLU  20           HG3      GLU  20   4.813  14.315  -9.590
  127    H    GLU  21           H        GLU  21   3.932  14.254  -3.730
  128    HA   GLU  21           HA       GLU  21   4.400  16.755  -2.527
  129    HB2  GLU  21           HB2      GLU  21   4.814  15.486  -0.424
  130    HB3  GLU  21           HB3      GLU  21   3.355  14.972  -1.256
  131    HG2  GLU  21           HG2      GLU  21   4.518  12.972  -2.102
  132    HG3  GLU  21           HG3      GLU  21   6.008  13.490  -1.313
  133    HA   PRO  22           HA       PRO  22   8.722  17.350  -3.229
  134    HB2  PRO  22           HB2      PRO  22   9.219  19.521  -1.714
  135    HB3  PRO  22           HB3      PRO  22   8.035  19.581  -3.028
  136    HG2  PRO  22           HG2      PRO  22   7.564  19.293  -0.067
  137    HG3  PRO  22           HG3      PRO  22   6.699  20.301  -1.246
  138    HD2  PRO  22           HD2      PRO  22   5.830  17.803  -0.358
  139    HD3  PRO  22           HD3      PRO  22   5.317  18.564  -1.878
  140    H    LEU  23           H        LEU  23  10.889  17.741  -2.144
  141    HA   LEU  23           HA       LEU  23  11.280  15.873   0.118
  142    HB2  LEU  23           HB2      LEU  23  13.268  16.921  -1.937
  143    HB3  LEU  23           HB3      LEU  23  13.641  15.766  -0.666
  144    HG   LEU  23           HG       LEU  23  11.718  15.272  -2.977
  145   HD11  LEU  23          HD11      LEU  23  13.401  13.693  -3.830
  146   HD12  LEU  23          HD12      LEU  23  14.503  14.152  -2.531
  147   HD13  LEU  23          HD13      LEU  23  14.040  15.335  -3.757
  148   HD21  LEU  23          HD21      LEU  23  11.004  14.038  -0.977
  149   HD22  LEU  23          HD22      LEU  23  12.625  13.367  -0.783
  150   HD23  LEU  23          HD23      LEU  23  11.647  12.926  -2.184
  151    H    SER  24           H        SER  24  12.701  16.401   1.819
  152    HA   SER  24           HA       SER  24  13.520  19.174   2.284
  153    HB2  SER  24           HB2      SER  24  12.289  19.273   4.477
  154    HB3  SER  24           HB3      SER  24  11.200  19.188   3.093
  155    HG   SER  24           HG       SER  24  10.942  16.960   3.506
  156    H    LEU  25           H        LEU  25  13.069  16.105   4.112
  157    HA   LEU  25           HA       LEU  25  15.981  16.074   4.751
  158    HB2  LEU  25           HB2      LEU  25  14.577  16.373   6.778
  159    HB3  LEU  25           HB3      LEU  25  13.678  14.919   6.381
  160    HG   LEU  25           HG       LEU  25  15.778  13.567   6.697
  161   HD11  LEU  25          HD11      LEU  25  17.454  15.293   6.234
  162   HD12  LEU  25          HD12      LEU  25  17.733  14.549   7.804
  163   HD13  LEU  25          HD13      LEU  25  17.004  16.155   7.710
  164   HD21  LEU  25          HD21      LEU  25  14.970  15.206   9.128
  165   HD22  LEU  25          HD22      LEU  25  15.805  13.652   9.156
  166   HD23  LEU  25          HD23      LEU  25  14.160  13.752   8.539
  167    H    LEU  26           H        LEU  26  13.545  13.491   5.105
  168    HA   LEU  26           HA       LEU  26  14.524  12.120   2.664
  169    HB2  LEU  26           HB2      LEU  26  13.931  10.856   5.371
  170    HB3  LEU  26           HB3      LEU  26  14.036   9.921   3.888
  171    HG   LEU  26           HG       LEU  26  16.313  11.504   5.149
  172   HD11  LEU  26          HD11      LEU  26  17.340   9.305   5.566
  173   HD12  LEU  26          HD12      LEU  26  15.901   8.505   4.929
  174   HD13  LEU  26          HD13      LEU  26  15.798   9.467   6.405
  175   HD21  LEU  26          HD21      LEU  26  16.519  11.547   2.703
  176   HD22  LEU  26          HD22      LEU  26  16.332   9.793   2.630
  177   HD23  LEU  26          HD23      LEU  26  17.750  10.502   3.405
  178    H    ASP  27           H        ASP  27  11.943  12.977   4.818
  179    HA   ASP  27           HA       ASP  27   9.713  13.008   4.775
  180    HB2  ASP  27           HB2      ASP  27  10.090  12.737   1.757
  181    HB3  ASP  27           HB3      ASP  27   8.576  13.177   2.552
  182    H    ASP  28           H        ASP  28   9.219  11.243   5.928
  183    HA   ASP  28           HA       ASP  28   9.833   8.587   5.346
  184    HB2  ASP  28           HB2      ASP  28   7.680   9.622   7.237
  185    HB3  ASP  28           HB3      ASP  28   8.437   8.031   7.309
  186    H    MET  29           H        MET  29   6.782  10.313   4.827
  187    HA   MET  29           HA       MET  29   5.224   8.140   3.890
  188    HB2  MET  29           HB2      MET  29   4.084  10.116   4.590
  189    HB3  MET  29           HB3      MET  29   5.002  11.141   3.498
  190    HG2  MET  29           HG2      MET  29   3.617  10.713   1.726
  191    HG3  MET  29           HG3      MET  29   3.356   9.033   2.182
  192    HE1  MET  29           HE1      MET  29   2.175   8.832   4.869
  193    HE2  MET  29           HE2      MET  29   1.364   8.168   3.448
  194    HE3  MET  29           HE3      MET  29   0.448   9.117   4.619
  195    H    ASN  30           H        ASN  30   7.143  10.571   2.081
  196    HA   ASN  30           HA       ASN  30   6.705   9.574  -0.533
  197    HB2  ASN  30           HB2      ASN  30   7.611  11.854   0.139
  198    HB3  ASN  30           HB3      ASN  30   9.151  11.090   0.487
  199   HD21  ASN  30          HD21      ASN  30   8.324  13.181  -1.486
  200   HD22  ASN  30          HD22      ASN  30   8.899  12.604  -3.008
  201    H    HIS  31           H        HIS  31   9.072   8.714   1.940
  202    HA   HIS  31           HA       HIS  31  10.722   6.955   0.417
  203    HB2  HIS  31           HB2      HIS  31  11.450   7.996   2.556
  204    HB3  HIS  31           HB3      HIS  31  10.236   7.064   3.429
  205    HD2  HIS  31           HD2      HIS  31  13.757   6.607   1.828
  206    HE1  HIS  31           HE1      HIS  31  12.695   3.041   3.825
  207    HE2  HIS  31           HE2      HIS  31  14.598   4.393   2.866
  208    H    CYS  32           H        CYS  32   7.813   6.493   2.396
  209    HA   CYS  32           HA       CYS  32   7.645   3.657   2.203
  210    HB2  CYS  32           HB2      CYS  32   5.507   5.742   2.767
  211    HB3  CYS  32           HB3      CYS  32   5.244   4.001   2.892
  212    HG   CYS  32           HG       CYS  32   7.770   5.399   4.660
  213    H    TYR  33           H        TYR  33   6.298   6.298   0.246
  214    HA   TYR  33           HA       TYR  33   4.845   4.772  -1.637
  215    HB2  TYR  33           HB2      TYR  33   6.000   7.563  -1.622
  216    HB3  TYR  33           HB3      TYR  33   5.418   6.915  -3.152
  217    HD1  TYR  33           HD1      TYR  33   3.020   5.777  -3.005
  218    HD2  TYR  33           HD2      TYR  33   4.384   8.801  -0.315
  219    HE1  TYR  33           HE1      TYR  33   0.710   6.382  -2.522
  220    HE2  TYR  33           HE2      TYR  33   2.059   9.404   0.174
  221    HH   TYR  33           HH       TYR  33  -0.110   9.207  -0.689
  222    H    SER  34           H        SER  34   8.253   5.712  -1.518
  223    HA   SER  34           HA       SER  34   9.128   4.735  -4.004
  224    HB2  SER  34           HB2      SER  34  10.569   6.117  -2.554
  225    HB3  SER  34           HB3      SER  34  10.629   4.838  -1.350
  226    HG   SER  34           HG       SER  34  11.419   3.922  -3.789
  227    H    ARG  35           H        ARG  35   8.912   3.077  -0.837
  228    HA   ARG  35           HA       ARG  35   9.779   0.507  -1.621
  229    HB2  ARG  35           HB2      ARG  35   8.049   1.415   0.670
  230    HB3  ARG  35           HB3      ARG  35   8.487  -0.279   0.431
  231    HG2  ARG  35           HG2      ARG  35  10.899   0.387   0.486
  232    HG3  ARG  35           HG3      ARG  35  10.391   2.029   0.908
  233    HD2  ARG  35           HD2      ARG  35   9.231   1.138   2.885
  234    HD3  ARG  35           HD3      ARG  35   9.783  -0.483   2.482
  235    HE   ARG  35           HE       ARG  35  12.091   0.923   2.661
  236   HH11  ARG  35          HH11      ARG  35   9.439   0.516   4.867
  237   HH12  ARG  35          HH12      ARG  35  10.443   0.705   6.255
  238   HH21  ARG  35          HH21      ARG  35  13.327   1.146   4.467
  239   HH22  ARG  35          HH22      ARG  35  12.602   1.057   6.031
  240    H    LEU  36           H        LEU  36   6.509   1.920  -1.597
  241    HA   LEU  36           HA       LEU  36   5.035  -0.367  -2.305
  242    HB2  LEU  36           HB2      LEU  36   4.511   2.529  -3.079
  243    HB3  LEU  36           HB3      LEU  36   3.352   1.225  -3.254
  244    HG   LEU  36           HG       LEU  36   4.426   2.310  -0.624
  245   HD11  LEU  36          HD11      LEU  36   2.834   3.838  -1.666
  246   HD12  LEU  36          HD12      LEU  36   2.150   3.110  -0.217
  247   HD13  LEU  36          HD13      LEU  36   1.647   2.535  -1.808
  248   HD21  LEU  36          HD21      LEU  36   4.035  -0.104  -0.409
  249   HD22  LEU  36          HD22      LEU  36   2.404   0.081  -1.060
  250   HD23  LEU  36          HD23      LEU  36   2.823   0.799   0.498
  251    H    ARG  37           H        ARG  37   6.551   2.120  -4.395
  252    HA   ARG  37           HA       ARG  37   5.940   0.970  -6.899
  253    HB2  ARG  37           HB2      ARG  37   8.156   2.860  -6.100
  254    HB3  ARG  37           HB3      ARG  37   7.801   2.411  -7.770
  255    HG2  ARG  37           HG2      ARG  37   5.468   3.296  -7.463
  256    HG3  ARG  37           HG3      ARG  37   5.930   3.837  -5.846
  257    HD2  ARG  37           HD2      ARG  37   6.053   5.697  -7.328
  258    HD3  ARG  37           HD3      ARG  37   7.701   5.253  -6.894
  259    HE   ARG  37           HE       ARG  37   6.540   4.314  -9.433
  260   HH11  ARG  37          HH11      ARG  37   8.955   6.190  -7.831
  261   HH12  ARG  37          HH12      ARG  37   9.803   6.527  -9.295
  262   HH21  ARG  37          HH21      ARG  37   7.623   4.796 -11.296
  263   HH22  ARG  37          HH22      ARG  37   9.059   5.751 -11.233
  264    H    GLU  38           H        GLU  38   8.314  -0.012  -4.562
  265    HA   GLU  38           HA       GLU  38  10.026  -1.420  -6.473
  266    HB2  GLU  38           HB2      GLU  38  10.029  -1.395  -3.421
  267    HB3  GLU  38           HB3      GLU  38  11.208  -2.262  -4.396
  268    HG2  GLU  38           HG2      GLU  38  10.815   0.742  -4.322
  269    HG3  GLU  38           HG3      GLU  38  12.118  -0.155  -3.552
  270    H    LEU  39           H        LEU  39   7.595  -2.184  -4.017
  271    HA   LEU  39           HA       LEU  39   7.830  -5.044  -4.207
  272    HB2  LEU  39           HB2      LEU  39   5.892  -3.199  -2.788
  273    HB3  LEU  39           HB3      LEU  39   5.728  -4.949  -2.720
  274    HG   LEU  39           HG       LEU  39   8.196  -3.428  -1.775
  275   HD11  LEU  39          HD11      LEU  39   7.461  -3.910   0.520
  276   HD12  LEU  39          HD12      LEU  39   5.966  -4.614  -0.097
  277   HD13  LEU  39          HD13      LEU  39   6.292  -2.895  -0.324
  278   HD21  LEU  39          HD21      LEU  39   7.440  -6.358  -1.422
  279   HD22  LEU  39          HD22      LEU  39   8.887  -5.570  -0.793
  280   HD23  LEU  39          HD23      LEU  39   8.675  -5.741  -2.530
  281    H    VAL  40           H        VAL  40   5.905  -2.641  -5.801
  282    HA   VAL  40           HA       VAL  40   4.083  -4.604  -7.005
  283    HB   VAL  40           HB       VAL  40   4.233  -1.585  -7.476
  284   HG11  VAL  40          HG11      VAL  40   1.930  -1.830  -8.370
  285   HG12  VAL  40          HG12      VAL  40   2.039  -3.580  -8.169
  286   HG13  VAL  40          HG13      VAL  40   3.101  -2.753  -9.311
  287   HG21  VAL  40          HG21      VAL  40   2.440  -3.128  -5.556
  288   HG22  VAL  40          HG22      VAL  40   2.303  -1.405  -5.922
  289   HG23  VAL  40          HG23      VAL  40   3.751  -2.021  -5.119
  290    HA   PRO  41           HA       PRO  41   7.135  -4.644 -10.491
  291    HB2  PRO  41           HB2      PRO  41   6.717  -7.149 -11.365
  292    HB3  PRO  41           HB3      PRO  41   7.539  -6.866  -9.822
  293    HG2  PRO  41           HG2      PRO  41   4.659  -7.609 -10.321
  294    HG3  PRO  41           HG3      PRO  41   5.792  -8.272  -9.122
  295    HD2  PRO  41           HD2      PRO  41   3.911  -6.298  -8.573
  296    HD3  PRO  41           HD3      PRO  41   5.390  -6.554  -7.628
  297    H    GLY  42           H        GLY  42   3.804  -4.380 -10.463
  298    HA2  GLY  42           HA2      GLY  42   3.284  -4.680 -13.325
  299    HA3  GLY  42           HA3      GLY  42   2.141  -4.194 -12.085
  300    H    VAL  43           H        VAL  43   5.255  -2.608 -12.501
  301    HA   VAL  43           HA       VAL  43   4.018  -0.050 -13.126
  302    HB   VAL  43           HB       VAL  43   6.984  -0.746 -12.815
  303   HG11  VAL  43          HG11      VAL  43   7.318   1.689 -12.486
  304   HG12  VAL  43          HG12      VAL  43   5.607   1.970 -12.831
  305   HG13  VAL  43          HG13      VAL  43   6.667   1.327 -14.086
  306   HG21  VAL  43          HG21      VAL  43   5.749  -1.216 -10.734
  307   HG22  VAL  43          HG22      VAL  43   5.055   0.405 -10.748
  308   HG23  VAL  43          HG23      VAL  43   6.793   0.191 -10.523
  309    HA   PRO  44           HA       PRO  44   4.322  -1.353 -17.447
  310    HB2  PRO  44           HB2      PRO  44   2.907   0.651 -18.631
  311    HB3  PRO  44           HB3      PRO  44   2.145  -0.586 -17.621
  312    HG2  PRO  44           HG2      PRO  44   2.947   2.224 -16.881
  313    HG3  PRO  44           HG3      PRO  44   1.439   1.360 -16.509
  314    HD2  PRO  44           HD2      PRO  44   3.499   1.615 -14.718
  315    HD3  PRO  44           HD3      PRO  44   2.384   0.233 -14.713
  316    H    ARG  45           H        ARG  45   6.708  -0.998 -17.333
  317    HA   ARG  45           HA       ARG  45   8.683  -0.344 -18.176
  318    HB2  ARG  45           HB2      ARG  45   6.959   0.557 -20.518
  319    HB3  ARG  45           HB3      ARG  45   8.714   0.488 -20.566
  320    HG2  ARG  45           HG2      ARG  45   7.992  -1.488 -21.643
  321    HG3  ARG  45           HG3      ARG  45   8.514  -2.009 -20.040
  322    HD2  ARG  45           HD2      ARG  45   6.164  -2.065 -19.294
  323    HD3  ARG  45           HD3      ARG  45   5.642  -1.511 -20.888
  324    HE   ARG  45           HE       ARG  45   7.163  -3.866 -21.176
  325   HH11  ARG  45          HH11      ARG  45   4.042  -2.879 -20.031
  326   HH12  ARG  45          HH12      ARG  45   3.339  -4.425 -20.338
  327   HH21  ARG  45          HH21      ARG  45   6.215  -5.825 -21.547
  328   HH22  ARG  45          HH22      ARG  45   4.542  -6.061 -21.181
  329    H    GLY  46           H        GLY  46   9.594   1.180 -16.889
  330    HA2  GLY  46           HA2      GLY  46  10.325   3.224 -16.125
  331    HA3  GLY  46           HA3      GLY  46   9.702   3.948 -17.603
  332    H    THR  47           H        THR  47   7.940   5.228 -17.421
  333    HA   THR  47           HA       THR  47   6.053   6.249 -16.742
  334    HB   THR  47           HB       THR  47   5.524   3.787 -15.015
  335    HG1  THR  47           HG1      THR  47   5.741   3.256 -17.219
  336   HG21  THR  47          HG21      THR  47   3.138   4.420 -15.176
  337   HG22  THR  47          HG22      THR  47   3.568   5.876 -16.075
  338   HG23  THR  47          HG23      THR  47   4.063   5.702 -14.389
  339    H    GLN  48           H        GLN  48   5.744   7.957 -15.378
  340    HA   GLN  48           HA       GLN  48   7.306   8.399 -13.056
  341    HB2  GLN  48           HB2      GLN  48   6.402  10.273 -14.374
  342    HB3  GLN  48           HB3      GLN  48   4.758   9.807 -13.959
  343    HG2  GLN  48           HG2      GLN  48   5.218  10.322 -11.578
  344    HG3  GLN  48           HG3      GLN  48   6.861  10.793 -12.005
  345   HE21  GLN  48          HE21      GLN  48   6.575  12.889 -11.221
  346   HE22  GLN  48          HE22      GLN  48   5.588  14.057 -12.015
  347    H    LEU  49           H        LEU  49   3.958   7.318 -13.481
  348    HA   LEU  49           HA       LEU  49   2.281   6.624 -12.159
  349    HB2  LEU  49           HB2      LEU  49   4.500   5.934 -10.200
  350    HB3  LEU  49           HB3      LEU  49   2.815   5.541  -9.918
  351    HG   LEU  49           HG       LEU  49   4.501   4.445 -12.206
  352   HD11  LEU  49          HD11      LEU  49   5.241   3.563 -10.040
  353   HD12  LEU  49          HD12      LEU  49   4.454   2.309 -10.995
  354   HD13  LEU  49          HD13      LEU  49   3.589   3.070  -9.658
  355   HD21  LEU  49          HD21      LEU  49   1.662   3.733 -11.361
  356   HD22  LEU  49          HD22      LEU  49   2.607   2.895 -12.594
  357   HD23  LEU  49          HD23      LEU  49   2.134   4.572 -12.844
  358    H    SER  50           H        SER  50   0.923   8.239 -11.543
  359    HA   SER  50           HA       SER  50   1.582  10.470  -9.925
  360    HB2  SER  50           HB2      SER  50  -0.424  10.557 -11.310
  361    HB3  SER  50           HB3      SER  50  -1.127   9.184 -10.463
  362    HG   SER  50           HG       SER  50  -1.652  11.579  -9.898
  363    H    GLN  51           H        GLN  51   1.075  10.911  -7.745
  364    HA   GLN  51           HA       GLN  51   1.805   9.024  -5.843
  365    HB2  GLN  51           HB2      GLN  51   1.955  11.506  -5.654
  366    HB3  GLN  51           HB3      GLN  51   0.212  11.582  -5.433
  367    HG2  GLN  51           HG2      GLN  51   0.408  10.360  -3.314
  368    HG3  GLN  51           HG3      GLN  51   2.152  10.203  -3.548
  369   HE21  GLN  51          HE21      GLN  51   0.600  11.553  -1.423
  370   HE22  GLN  51          HE22      GLN  51   1.204  13.162  -1.379
  371    H    VAL  52           H        VAL  52  -1.467   9.975  -6.876
  372    HA   VAL  52           HA       VAL  52  -2.903   8.263  -5.053
  373    HB   VAL  52           HB       VAL  52  -3.936   9.287  -7.750
  374   HG11  VAL  52          HG11      VAL  52  -5.348   7.554  -6.709
  375   HG12  VAL  52          HG12      VAL  52  -6.168   9.114  -6.666
  376   HG13  VAL  52          HG13      VAL  52  -5.411   8.477  -5.203
  377   HG21  VAL  52          HG21      VAL  52  -3.057  11.190  -6.438
  378   HG22  VAL  52          HG22      VAL  52  -4.054  10.709  -5.064
  379   HG23  VAL  52          HG23      VAL  52  -4.817  11.257  -6.557
  380    H    GLU  53           H        GLU  53  -1.943   7.987  -8.492
  381    HA   GLU  53           HA       GLU  53  -2.999   5.499  -9.179
  382    HB2  GLU  53           HB2      GLU  53  -0.663   7.117 -10.195
  383    HB3  GLU  53           HB3      GLU  53  -0.824   5.471 -10.781
  384    HG2  GLU  53           HG2      GLU  53  -3.106   7.448 -10.980
  385    HG3  GLU  53           HG3      GLU  53  -1.838   7.362 -12.201
  386    H    ILE  54           H        ILE  54  -0.052   6.177  -7.348
  387    HA   ILE  54           HA       ILE  54   1.085   3.600  -7.323
  388    HB   ILE  54           HB       ILE  54   1.156   5.732  -5.136
  389   HG12  ILE  54          HG12      ILE  54   3.215   5.088  -7.311
  390   HG13  ILE  54          HG13      ILE  54   2.151   6.490  -7.290
  391   HG21  ILE  54          HG21      ILE  54   2.928   3.265  -5.422
  392   HG22  ILE  54          HG22      ILE  54   1.708   3.536  -4.175
  393   HG23  ILE  54          HG23      ILE  54   3.141   4.555  -4.230
  394   HD11  ILE  54          HD11      ILE  54   4.330   5.896  -5.289
  395   HD12  ILE  54          HD12      ILE  54   3.260   7.303  -5.265
  396   HD13  ILE  54          HD13      ILE  54   4.391   7.077  -6.598
  397    H    LEU  55           H        LEU  55  -1.113   5.139  -4.920
  398    HA   LEU  55           HA       LEU  55  -1.534   2.962  -3.219
  399    HB2  LEU  55           HB2      LEU  55  -3.456   5.208  -3.923
  400    HB3  LEU  55           HB3      LEU  55  -3.649   4.127  -2.553
  401    HG   LEU  55           HG       LEU  55  -1.390   6.129  -2.923
  402   HD11  LEU  55          HD11      LEU  55  -2.417   7.344  -1.051
  403   HD12  LEU  55          HD12      LEU  55  -3.740   6.175  -1.000
  404   HD13  LEU  55          HD13      LEU  55  -3.533   7.217  -2.411
  405   HD21  LEU  55          HD21      LEU  55  -1.949   4.256  -0.594
  406   HD22  LEU  55          HD22      LEU  55  -0.717   5.520  -0.628
  407   HD23  LEU  55          HD23      LEU  55  -0.592   4.145  -1.721
  408    H    GLN  56           H        GLN  56  -3.418   3.959  -6.058
  409    HA   GLN  56           HA       GLN  56  -5.414   1.945  -5.966
  410    HB2  GLN  56           HB2      GLN  56  -4.394   3.592  -8.321
  411    HB3  GLN  56           HB3      GLN  56  -5.891   2.659  -8.314
  412    HG2  GLN  56           HG2      GLN  56  -6.831   4.086  -6.578
  413    HG3  GLN  56           HG3      GLN  56  -5.310   4.965  -6.429
  414   HE21  GLN  56          HE21      GLN  56  -7.986   5.978  -7.072
  415   HE22  GLN  56          HE22      GLN  56  -7.832   6.786  -8.589
  416    H    ARG  57           H        ARG  57  -2.219   2.070  -7.517
  417    HA   ARG  57           HA       ARG  57  -2.428  -0.414  -8.960
  418    HB2  ARG  57           HB2      ARG  57  -0.818   1.530  -9.455
  419    HB3  ARG  57           HB3      ARG  57   0.150   0.965  -8.104
  420    HG2  ARG  57           HG2      ARG  57   1.237  -0.443  -9.516
  421    HG3  ARG  57           HG3      ARG  57  -0.265  -1.331  -9.748
  422    HD2  ARG  57           HD2      ARG  57   0.819   0.947 -11.423
  423    HD3  ARG  57           HD3      ARG  57   0.582  -0.736 -11.911
  424    HE   ARG  57           HE       ARG  57  -1.919   0.172 -11.183
  425   HH11  ARG  57          HH11      ARG  57   0.400   1.045 -13.595
  426   HH12  ARG  57          HH12      ARG  57  -0.789   1.755 -14.619
  427   HH21  ARG  57          HH21      ARG  57  -3.399   1.113 -12.485
  428   HH22  ARG  57          HH22      ARG  57  -2.920   1.796 -13.999
  429    H    VAL  58           H        VAL  58  -1.362   0.506  -5.730
  430    HA   VAL  58           HA       VAL  58  -0.183  -1.987  -4.987
  431    HB   VAL  58           HB       VAL  58  -1.231   0.301  -3.251
  432   HG11  VAL  58          HG11      VAL  58  -1.293  -1.772  -1.930
  433   HG12  VAL  58          HG12      VAL  58   0.010  -0.730  -1.360
  434   HG13  VAL  58          HG13      VAL  58   0.379  -2.132  -2.371
  435   HG21  VAL  58          HG21      VAL  58   0.740   0.868  -4.643
  436   HG22  VAL  58          HG22      VAL  58   1.627  -0.496  -3.964
  437   HG23  VAL  58          HG23      VAL  58   1.152   0.856  -2.930
  438    H    ILE  59           H        ILE  59  -3.453  -0.572  -4.451
  439    HA   ILE  59           HA       ILE  59  -4.646  -2.744  -3.109
  440    HB   ILE  59           HB       ILE  59  -5.935  -0.772  -5.058
  441   HG12  ILE  59          HG12      ILE  59  -5.858  -0.727  -1.995
  442   HG13  ILE  59          HG13      ILE  59  -4.868   0.281  -3.046
  443   HG21  ILE  59          HG21      ILE  59  -8.117  -1.372  -4.016
  444   HG22  ILE  59          HG22      ILE  59  -7.318  -2.628  -3.069
  445   HG23  ILE  59          HG23      ILE  59  -7.383  -2.755  -4.827
  446   HD11  ILE  59          HD11      ILE  59  -6.876   1.380  -3.891
  447   HD12  ILE  59          HD12      ILE  59  -6.743   1.509  -2.138
  448   HD13  ILE  59          HD13      ILE  59  -7.874   0.362  -2.849
  449    H    ASP  60           H        ASP  60  -4.586  -1.999  -6.609
  450    HA   ASP  60           HA       ASP  60  -5.701  -4.221  -7.801
  451    HB2  ASP  60           HB2      ASP  60  -4.989  -2.250  -9.058
  452    HB3  ASP  60           HB3      ASP  60  -3.310  -2.510  -8.620
  453    H    TYR  61           H        TYR  61  -2.336  -3.807  -6.780
  454    HA   TYR  61           HA       TYR  61  -1.301  -6.315  -7.526
  455    HB2  TYR  61           HB2      TYR  61   0.192  -4.461  -7.163
  456    HB3  TYR  61           HB3      TYR  61  -0.393  -4.221  -5.521
  457    HD1  TYR  61           HD1      TYR  61   1.517  -6.612  -7.678
  458    HD2  TYR  61           HD2      TYR  61   0.669  -5.328  -3.683
  459    HE1  TYR  61           HE1      TYR  61   3.313  -8.050  -6.827
  460    HE2  TYR  61           HE2      TYR  61   2.470  -6.751  -2.861
  461    HH   TYR  61           HH       TYR  61   4.807  -8.102  -4.828
  462    H    ILE  62           H        ILE  62  -2.699  -5.220  -4.405
  463    HA   ILE  62           HA       ILE  62  -2.131  -7.659  -2.994
  464    HB   ILE  62           HB       ILE  62  -4.124  -5.464  -2.235
  465   HG12  ILE  62          HG12      ILE  62  -1.236  -5.863  -1.273
  466   HG13  ILE  62          HG13      ILE  62  -1.743  -4.649  -2.440
  467   HG21  ILE  62          HG21      ILE  62  -2.893  -7.649  -0.495
  468   HG22  ILE  62          HG22      ILE  62  -4.576  -7.583  -1.024
  469   HG23  ILE  62          HG23      ILE  62  -3.956  -6.355   0.076
  470   HD11  ILE  62          HD11      ILE  62  -2.606  -4.791   0.448
  471   HD12  ILE  62          HD12      ILE  62  -3.116  -3.569  -0.723
  472   HD13  ILE  62          HD13      ILE  62  -1.423  -3.683  -0.246
  473    H    LEU  63           H        LEU  63  -4.817  -6.541  -4.981
  474    HA   LEU  63           HA       LEU  63  -6.668  -8.643  -4.430
  475    HB2  LEU  63           HB2      LEU  63  -6.299  -6.972  -6.951
  476    HB3  LEU  63           HB3      LEU  63  -7.669  -8.029  -6.650
  477    HG   LEU  63           HG       LEU  63  -6.974  -5.539  -5.049
  478   HD11  LEU  63          HD11      LEU  63  -8.981  -4.542  -6.043
  479   HD12  LEU  63          HD12      LEU  63  -9.230  -5.992  -7.020
  480   HD13  LEU  63          HD13      LEU  63  -7.804  -4.984  -7.280
  481   HD21  LEU  63          HD21      LEU  63  -8.027  -7.200  -3.596
  482   HD22  LEU  63          HD22      LEU  63  -9.353  -7.401  -4.743
  483   HD23  LEU  63          HD23      LEU  63  -9.134  -5.864  -3.903
  484    H    ASP  64           H        ASP  64  -3.925  -8.330  -6.648
  485    HA   ASP  64           HA       ASP  64  -4.166 -10.834  -7.983
  486    HB2  ASP  64           HB2      ASP  64  -2.773  -9.007  -8.873
  487    HB3  ASP  64           HB3      ASP  64  -1.724  -9.079  -7.463
  488    H    LEU  65           H        LEU  65  -2.505  -9.845  -4.979
  489    HA   LEU  65           HA       LEU  65  -1.247 -12.315  -4.344
  490    HB2  LEU  65           HB2      LEU  65  -2.220 -10.174  -2.410
  491    HB3  LEU  65           HB3      LEU  65  -1.059 -11.439  -2.042
  492    HG   LEU  65           HG       LEU  65  -0.633  -9.113  -3.951
  493   HD11  LEU  65          HD11      LEU  65  -0.567  -8.429  -1.607
  494   HD12  LEU  65          HD12      LEU  65   1.034  -8.336  -2.330
  495   HD13  LEU  65          HD13      LEU  65   0.634  -9.676  -1.258
  496   HD21  LEU  65          HD21      LEU  65   1.298 -11.351  -3.247
  497   HD22  LEU  65          HD22      LEU  65   1.697  -9.906  -4.179
  498   HD23  LEU  65          HD23      LEU  65   0.541 -11.072  -4.819
  499    H    GLN  66           H        GLN  66  -4.369 -10.939  -3.412
  500    HA   GLN  66           HA       GLN  66  -5.222 -13.242  -1.844
  501    HB2  GLN  66           HB2      GLN  66  -6.624 -10.633  -2.558
  502    HB3  GLN  66           HB3      GLN  66  -7.324 -11.865  -1.515
  503    HG2  GLN  66           HG2      GLN  66  -4.707 -10.465  -0.873
  504    HG3  GLN  66           HG3      GLN  66  -6.275  -9.849  -0.363
  505   HE21  GLN  66          HE21      GLN  66  -5.725 -10.055   1.829
  506   HE22  GLN  66          HE22      GLN  66  -5.637 -11.586   2.619
  507    H    VAL  67           H        VAL  67  -7.560 -14.037  -2.229
  508    HA   VAL  67           HA       VAL  67  -8.038 -14.589  -5.100
  509    HB   VAL  67           HB       VAL  67  -9.241 -15.950  -2.638
  510   HG11  VAL  67          HG11      VAL  67  -9.508 -16.719  -5.576
  511   HG12  VAL  67          HG12      VAL  67 -10.781 -16.047  -4.556
  512   HG13  VAL  67          HG13      VAL  67 -10.129 -17.646  -4.207
  513   HG21  VAL  67          HG21      VAL  67  -6.833 -16.445  -2.878
  514   HG22  VAL  67          HG22      VAL  67  -7.089 -16.979  -4.541
  515   HG23  VAL  67          HG23      VAL  67  -7.804 -17.881  -3.203
  516    H    VAL  68           H        VAL  68  -9.101 -12.833  -5.844
  517    HA   VAL  68           HA       VAL  68 -10.714 -11.365  -6.379
  518    HB   VAL  68           HB       VAL  68 -12.618 -13.128  -4.761
  519   HG11  VAL  68          HG11      VAL  68 -13.230 -11.176  -7.020
  520   HG12  VAL  68          HG12      VAL  68 -13.627 -10.949  -5.316
  521   HG13  VAL  68          HG13      VAL  68 -14.400 -12.240  -6.233
  522   HG21  VAL  68          HG21      VAL  68 -11.404 -14.474  -6.429
  523   HG22  VAL  68          HG22      VAL  68 -11.852 -13.339  -7.707
  524   HG23  VAL  68          HG23      VAL  68 -13.096 -14.296  -6.899
  525    H1   MET   1           H1       MET   1   7.598  33.423   0.832
  526    H2   MET   1           H2       MET   1   9.022  34.247   0.454
  527    H3   MET   1           H3       MET   1   9.095  32.774   1.279
  528    HA   MET   1           HA       MET   1   8.125  33.173  -1.489
  529    HB2  MET   1           HB2      MET   1  10.704  31.930  -0.434
  530    HB3  MET   1           HB3      MET   1  10.186  31.838  -2.113
  531    HG2  MET   1           HG2      MET   1  10.317  34.300  -2.282
  532    HG3  MET   1           HG3      MET   1  10.863  34.376  -0.602
  533    HE1  MET   1           HE1      MET   1  14.087  35.213  -2.790
  534    HE2  MET   1           HE2      MET   1  12.977  35.841  -1.574
  535    HE3  MET   1           HE3      MET   1  12.426  35.605  -3.235
  536    H    GLY   2           H        GLY   2   7.467  31.282  -2.596
  537    HA2  GLY   2           HA2      GLY   2   6.269  29.173  -1.000
  538    HA3  GLY   2           HA3      GLY   2   6.199  29.343  -2.747
  539    H    HIS   3           H        HIS   3   7.150  27.223  -0.529
  540    HA   HIS   3           HA       HIS   3   9.825  26.533  -1.219
  541    HB2  HIS   3           HB2      HIS   3   7.636  24.857   0.089
  542    HB3  HIS   3           HB3      HIS   3   9.340  24.407   0.023
  543    HD2  HIS   3           HD2      HIS   3  10.918  25.494   1.996
  544    HE1  HIS   3           HE1      HIS   3   8.014  28.163   3.525
  545    HE2  HIS   3           HE2      HIS   3  10.291  27.135   3.897
  546    H    HIS   4           H        HIS   4   6.814  24.730  -1.963
  547    HA   HIS   4           HA       HIS   4   7.521  24.481  -4.763
  548    HB2  HIS   4           HB2      HIS   4   8.716  22.526  -3.623
  549    HB3  HIS   4           HB3      HIS   4   7.135  21.899  -3.166
  550    HD2  HIS   4           HD2      HIS   4   8.768  22.964  -6.634
  551    HE1  HIS   4           HE1      HIS   4   6.496  19.429  -7.114
  552    HE2  HIS   4           HE2      HIS   4   8.081  21.051  -8.235
  553    H    HIS   5           H        HIS   5   5.738  23.429  -6.019
  554    HA   HIS   5           HA       HIS   5   3.611  23.321  -6.749
  555    HB2  HIS   5           HB2      HIS   5   2.756  23.138  -3.824
  556    HB3  HIS   5           HB3      HIS   5   1.735  22.782  -5.215
  557    HD2  HIS   5           HD2      HIS   5   2.573  20.440  -6.702
  558    HE1  HIS   5           HE1      HIS   5   4.704  18.892  -3.405
  559    HE2  HIS   5           HE2      HIS   5   3.960  18.466  -5.770
  560    H    HIS   6           H        HIS   6   1.636  24.570  -7.039
  561    HA   HIS   6           HA       HIS   6   1.974  27.413  -6.400
  562    HB2  HIS   6           HB2      HIS   6  -0.029  26.008  -8.228
  563    HB3  HIS   6           HB3      HIS   6   0.171  27.754  -8.081
  564    HD2  HIS   6           HD2      HIS   6   2.386  28.829  -9.408
  565    HE1  HIS   6           HE1      HIS   6   3.624  25.168 -11.127
  566    HE2  HIS   6           HE2      HIS   6   3.935  27.676 -11.130
  567    H    HIS   7           H        HIS   7   1.588  26.708  -4.095
  568    HA   HIS   7           HA       HIS   7   0.447  26.695  -2.164
  569    HB2  HIS   7           HB2      HIS   7  -1.762  28.068  -3.761
  570    HB3  HIS   7           HB3      HIS   7  -1.702  27.965  -2.001
  571    HD2  HIS   7           HD2      HIS   7   0.193  29.787  -4.931
  572    HE1  HIS   7           HE1      HIS   7   1.155  31.631  -1.251
  573    HE2  HIS   7           HE2      HIS   7   1.525  31.664  -3.745
  574    H    HIS   8           H        HIS   8  -2.485  26.214  -4.128
  575    HA   HIS   8           HA       HIS   8  -2.752  23.439  -3.107
  576    HB2  HIS   8           HB2      HIS   8  -5.202  23.800  -3.066
  577    HB3  HIS   8           HB3      HIS   8  -4.373  24.948  -2.024
  578    HD2  HIS   8           HD2      HIS   8  -7.136  25.003  -4.491
  579    HE1  HIS   8           HE1      HIS   8  -5.389  28.838  -4.741
  580    HE2  HIS   8           HE2      HIS   8  -7.352  27.411  -5.416
  581    H    SER   9           H        SER   9  -2.972  25.630  -5.808
  582    HA   SER   9           HA       SER   9  -2.926  25.414  -8.038
  583    HB2  SER   9           HB2      SER   9  -1.458  23.457  -7.879
  584    HB3  SER   9           HB3      SER   9  -2.846  22.398  -7.627
  585    HG   SER   9           HG       SER   9  -1.793  23.320  -9.946
  586    H    HIS  10           H        HIS  10  -5.168  23.016  -6.663
  587    HA   HIS  10           HA       HIS  10  -7.354  22.693  -6.725
  588    HB2  HIS  10           HB2      HIS  10  -8.723  24.519  -6.766
  589    HB3  HIS  10           HB3      HIS  10  -7.267  25.451  -7.057
  590    HD1  HIS  10           HD1      HIS  10  -6.865  26.224  -9.589
  591    HD2  HIS  10           HD2      HIS  10 -10.591  24.545  -8.828
  592    HE1  HIS  10           HE1      HIS  10  -8.299  26.852 -11.539
  593    HE2  HIS  10           HE2      HIS  10 -10.562  25.895 -11.022
  594    H    MET  11           H        MET  11  -8.819  21.568  -7.905
  595    HA   MET  11           HA       MET  11  -8.394  21.204 -10.827
  596    HB2  MET  11           HB2      MET  11  -9.038  18.799 -10.498
  597    HB3  MET  11           HB3      MET  11  -7.536  19.217  -9.690
  598    HG2  MET  11           HG2      MET  11  -8.720  19.329  -7.531
  599    HG3  MET  11           HG3      MET  11 -10.235  18.934  -8.342
  600    HE1  MET  11           HE1      MET  11  -6.651  17.333  -9.106
  601    HE2  MET  11           HE2      MET  11  -6.688  15.961  -8.001
  602    HE3  MET  11           HE3      MET  11  -6.636  17.605  -7.363
  603    H    GLY  12           H        GLY  12 -10.637  19.657 -11.408
  604    HA2  GLY  12           HA2      GLY  12 -12.873  21.494 -11.097
  605    HA3  GLY  12           HA3      GLY  12 -12.861  19.987 -11.997
  606    H    GLY  13           H        GLY  13 -12.256  20.704  -8.536
  607    HA2  GLY  13           HA2      GLY  13 -13.210  19.952  -6.598
  608    HA3  GLY  13           HA3      GLY  13 -14.629  19.492  -7.525
  609    H    GLY  14           H        GLY  14 -14.468  17.801  -5.760
  610    HA2  GLY  14           HA2      GLY  14 -13.297  15.339  -6.913
  611    HA3  GLY  14           HA3      GLY  14 -12.945  15.738  -5.233
  612    H    LYS  15           H        LYS  15 -15.820  15.711  -7.354
  613    HA   LYS  15           HA       LYS  15 -17.647  14.980  -5.267
  614    HB2  LYS  15           HB2      LYS  15 -18.389  16.352  -7.158
  615    HB3  LYS  15           HB3      LYS  15 -17.977  15.075  -8.295
  616    HG2  LYS  15           HG2      LYS  15 -20.378  15.127  -8.012
  617    HG3  LYS  15           HG3      LYS  15 -19.760  13.640  -7.296
  618    HD2  LYS  15           HD2      LYS  15 -19.907  14.722  -5.031
  619    HD3  LYS  15           HD3      LYS  15 -20.610  16.151  -5.794
  620    HE2  LYS  15           HE2      LYS  15 -22.491  14.707  -6.634
  621    HE3  LYS  15           HE3      LYS  15 -21.808  13.355  -5.732
  622    HZ1  LYS  15           HZ1      LYS  15 -22.866  15.886  -4.595
  623    HZ2  LYS  15           HZ2      LYS  15 -22.103  14.682  -3.694
  624    HZ3  LYS  15           HZ3      LYS  15 -23.563  14.352  -4.473
  625    H    GLY  16           H        GLY  16 -17.055  13.037  -4.359
  626    HA2  GLY  16           HA2      GLY  16 -18.254  10.719  -5.378
  627    HA3  GLY  16           HA3      GLY  16 -16.529  10.600  -5.709
  628    HA   PRO  17           HA       PRO  17 -16.927  10.103  -0.928
  629    HB2  PRO  17           HB2      PRO  17 -19.215  10.631   0.397
  630    HB3  PRO  17           HB3      PRO  17 -18.138  11.945  -0.104
  631    HG2  PRO  17           HG2      PRO  17 -20.682  10.982  -1.410
  632    HG3  PRO  17           HG3      PRO  17 -20.143  12.648  -1.102
  633    HD2  PRO  17           HD2      PRO  17 -19.855  11.338  -3.538
  634    HD3  PRO  17           HD3      PRO  17 -18.844  12.706  -3.022
  635    H    ALA  18           H        ALA  18 -17.477   8.202   0.291
  636    HA   ALA  18           HA       ALA  18 -19.083   6.154  -1.041
  637    HB1  ALA  18           HB1      ALA  18 -18.252   4.636   0.694
  638    HB2  ALA  18           HB2      ALA  18 -17.548   5.996   1.576
  639    HB3  ALA  18           HB3      ALA  18 -16.917   5.553  -0.009
  640    H    ALA  19           H        ALA  19 -19.500   8.504   1.454
  641    HA   ALA  19           HA       ALA  19 -21.281   9.266   2.598
  642    HB1  ALA  19           HB1      ALA  19 -22.960   7.134   1.241
  643    HB2  ALA  19           HB2      ALA  19 -22.654   8.753   0.612
  644    HB3  ALA  19           HB3      ALA  19 -23.564   8.548   2.110
  645    H    GLU  20           H        GLU  20 -22.638   8.846   4.463
  646    HA   GLU  20           HA       GLU  20 -22.798   8.225   6.623
  647    HB2  GLU  20           HB2      GLU  20 -22.553   5.384   5.560
  648    HB3  GLU  20           HB3      GLU  20 -23.179   5.842   7.140
  649    HG2  GLU  20           HG2      GLU  20 -25.007   7.114   5.984
  650    HG3  GLU  20           HG3      GLU  20 -24.423   6.478   4.447
  651    H    GLU  21           H        GLU  21 -20.164   8.733   5.493
  652    HA   GLU  21           HA       GLU  21 -18.220   7.005   6.773
  653    HB2  GLU  21           HB2      GLU  21 -17.889   9.580   5.178
  654    HB3  GLU  21           HB3      GLU  21 -16.568   8.534   5.681
  655    HG2  GLU  21           HG2      GLU  21 -17.386   6.736   4.260
  656    HG3  GLU  21           HG3      GLU  21 -18.812   7.678   3.827
  657    HA   PRO  22           HA       PRO  22 -17.579   9.427  10.530
  658    HB2  PRO  22           HB2      PRO  22 -14.854   9.162  10.931
  659    HB3  PRO  22           HB3      PRO  22 -16.023   7.878  11.260
  660    HG2  PRO  22           HG2      PRO  22 -14.280   8.272   8.836
  661    HG3  PRO  22           HG3      PRO  22 -14.611   6.782   9.744
  662    HD2  PRO  22           HD2      PRO  22 -15.868   7.345   7.406
  663    HD3  PRO  22           HD3      PRO  22 -16.693   6.476   8.717
  664    H    LEU  23           H        LEU  23 -16.451  11.358  11.410
  665    HA   LEU  23           HA       LEU  23 -16.734  13.509   9.587
  666    HB2  LEU  23           HB2      LEU  23 -15.571  13.526  12.398
  667    HB3  LEU  23           HB3      LEU  23 -16.104  14.945  11.509
  668    HG   LEU  23           HG       LEU  23 -17.895  12.674  12.457
  669   HD11  LEU  23          HD11      LEU  23 -17.128  14.072  14.315
  670   HD12  LEU  23          HD12      LEU  23 -18.849  14.309  14.020
  671   HD13  LEU  23          HD13      LEU  23 -17.689  15.524  13.478
  672   HD21  LEU  23          HD21      LEU  23 -18.655  15.234  11.002
  673   HD22  LEU  23          HD22      LEU  23 -19.788  14.071  11.691
  674   HD23  LEU  23          HD23      LEU  23 -18.749  13.594  10.352
  675    H    SER  24           H        SER  24 -15.308  13.873   8.009
  676    HA   SER  24           HA       SER  24 -12.583  14.693   8.556
  677    HB2  SER  24           HB2      SER  24 -12.388  12.173   8.347
  678    HB3  SER  24           HB3      SER  24 -13.026  12.292   6.710
  679    HG   SER  24           HG       SER  24 -10.503  12.790   7.656
  680    H    LEU  25           H        LEU  25 -11.516  15.001   6.128
  681    HA   LEU  25           HA       LEU  25 -13.526  16.378   4.441
  682    HB2  LEU  25           HB2      LEU  25 -10.504  16.722   4.550
  683    HB3  LEU  25           HB3      LEU  25 -11.555  17.526   3.398
  684    HG   LEU  25           HG       LEU  25 -12.725  18.586   5.468
  685   HD11  LEU  25          HD11      LEU  25 -11.776  17.147   7.208
  686   HD12  LEU  25          HD12      LEU  25 -11.386  18.838   7.501
  687   HD13  LEU  25          HD13      LEU  25 -10.155  17.752   6.851
  688   HD21  LEU  25          HD21      LEU  25 -11.336  19.874   3.912
  689   HD22  LEU  25          HD22      LEU  25  -9.878  19.420   4.799
  690   HD23  LEU  25          HD23      LEU  25 -11.107  20.431   5.568
  691    H    LEU  26           H        LEU  26 -13.434  16.080   2.134
  692    HA   LEU  26           HA       LEU  26 -12.960  13.350   1.362
  693    HB2  LEU  26           HB2      LEU  26 -14.138  15.745  -0.046
  694    HB3  LEU  26           HB3      LEU  26 -13.734  14.309  -0.972
  695    HG   LEU  26           HG       LEU  26 -15.659  14.353   1.388
  696   HD11  LEU  26          HD11      LEU  26 -16.609  15.564  -0.505
  697   HD12  LEU  26          HD12      LEU  26 -17.445  14.030  -0.275
  698   HD13  LEU  26          HD13      LEU  26 -16.267  14.204  -1.580
  699   HD21  LEU  26          HD21      LEU  26 -16.243  12.046   0.677
  700   HD22  LEU  26          HD22      LEU  26 -14.558  12.168   1.166
  701   HD23  LEU  26          HD23      LEU  26 -14.970  12.100  -0.549
  702    H    ASP  27           H        ASP  27 -10.840  12.810   1.215
  703    HA   ASP  27           HA       ASP  27  -9.299  13.938  -1.035
  704    HB2  ASP  27           HB2      ASP  27  -8.544  11.845   1.061
  705    HB3  ASP  27           HB3      ASP  27  -7.515  12.291  -0.296
  706    H    ASP  28           H        ASP  28  -9.513  12.915  -2.932
  707    HA   ASP  28           HA       ASP  28 -10.778  10.509  -3.560
  708    HB2  ASP  28           HB2      ASP  28  -9.965  12.269  -5.200
  709    HB3  ASP  28           HB3      ASP  28  -8.324  11.684  -4.969
  710    H    MET  29           H        MET  29  -7.524  11.146  -2.416
  711    HA   MET  29           HA       MET  29  -6.342   8.582  -2.690
  712    HB2  MET  29           HB2      MET  29  -5.621  10.733  -0.651
  713    HB3  MET  29           HB3      MET  29  -4.577   9.448  -1.252
  714    HG2  MET  29           HG2      MET  29  -4.804  10.503  -3.555
  715    HG3  MET  29           HG3      MET  29  -5.578  11.869  -2.755
  716    HE1  MET  29           HE1      MET  29  -2.308   9.787  -3.213
  717    HE2  MET  29           HE2      MET  29  -2.561   9.627  -1.472
  718    HE3  MET  29           HE3      MET  29  -1.201  10.572  -2.085
  719    H    ASN  30           H        ASN  30  -8.386  10.011  -0.183
  720    HA   ASN  30           HA       ASN  30  -7.818   8.283   1.993
  721    HB2  ASN  30           HB2      ASN  30  -8.940  10.456   2.313
  722    HB3  ASN  30           HB3      ASN  30 -10.336   9.901   1.401
  723   HD21  ASN  30          HD21      ASN  30 -11.832   8.522   2.421
  724   HD22  ASN  30          HD22      ASN  30 -11.802   8.223   4.119
  725    H    HIS  31           H        HIS  31 -10.155   8.053  -0.663
  726    HA   HIS  31           HA       HIS  31 -11.547   5.727   0.171
  727    HB2  HIS  31           HB2      HIS  31 -11.051   6.846  -2.624
  728    HB3  HIS  31           HB3      HIS  31 -12.165   5.523  -2.281
  729    HD2  HIS  31           HD2      HIS  31 -12.048   9.376  -2.153
  730    HE1  HIS  31           HE1      HIS  31 -15.722   8.109  -0.477
  731    HE2  HIS  31           HE2      HIS  31 -14.477  10.037  -1.531
  732    H    CYS  32           H        CYS  32  -8.480   6.141  -1.540
  733    HA   CYS  32           HA       CYS  32  -7.992   3.355  -2.076
  734    HB2  CYS  32           HB2      CYS  32  -6.006   5.657  -1.871
  735    HB3  CYS  32           HB3      CYS  32  -5.687   4.077  -2.584
  736    HG   CYS  32           HG       CYS  32  -8.268   5.111  -4.165
  737    H    TYR  33           H        TYR  33  -6.877   5.619   0.460
  738    HA   TYR  33           HA       TYR  33  -5.326   3.898   2.039
  739    HB2  TYR  33           HB2      TYR  33  -6.831   6.457   2.656
  740    HB3  TYR  33           HB3      TYR  33  -6.011   5.589   3.949
  741    HD1  TYR  33           HD1      TYR  33  -3.494   4.870   3.287
  742    HD2  TYR  33           HD2      TYR  33  -5.563   8.242   1.685
  743    HE1  TYR  33           HE1      TYR  33  -1.357   5.953   2.826
  744    HE2  TYR  33           HE2      TYR  33  -3.416   9.334   1.204
  745    HH   TYR  33           HH       TYR  33  -0.482   7.737   1.228
  746    H    SER  34           H        SER  34  -8.796   4.338   1.918
  747    HA   SER  34           HA       SER  34  -9.614   3.091   4.284
  748    HB2  SER  34           HB2      SER  34 -11.153   4.368   2.803
  749    HB3  SER  34           HB3      SER  34 -11.056   3.084   1.596
  750    HG   SER  34           HG       SER  34 -12.112   1.708   2.988
  751    H    ARG  35           H        ARG  35  -9.273   1.646   1.009
  752    HA   ARG  35           HA       ARG  35  -9.729  -1.025   1.917
  753    HB2  ARG  35           HB2      ARG  35  -9.131   0.229  -0.724
  754    HB3  ARG  35           HB3      ARG  35  -8.611  -1.444  -0.565
  755    HG2  ARG  35           HG2      ARG  35 -11.431  -0.481   0.009
  756    HG3  ARG  35           HG3      ARG  35 -10.912  -1.198  -1.521
  757    HD2  ARG  35           HD2      ARG  35 -10.437  -3.311  -0.445
  758    HD3  ARG  35           HD3      ARG  35 -10.667  -2.612   1.161
  759    HE   ARG  35           HE       ARG  35 -13.023  -2.371  -0.420
  760   HH11  ARG  35          HH11      ARG  35 -11.259  -4.723   1.428
  761   HH12  ARG  35          HH12      ARG  35 -12.669  -5.639   1.795
  762   HH21  ARG  35          HH21      ARG  35 -14.801  -3.558   0.083
  763   HH22  ARG  35          HH22      ARG  35 -14.653  -4.975   1.062
  764    H    LEU  36           H        LEU  36  -6.763   0.854   1.608
  765    HA   LEU  36           HA       LEU  36  -4.924  -1.266   1.966
  766    HB2  LEU  36           HB2      LEU  36  -4.770   1.551   3.099
  767    HB3  LEU  36           HB3      LEU  36  -3.434   0.419   3.037
  768    HG   LEU  36           HG       LEU  36  -4.814   1.702   0.650
  769   HD11  LEU  36          HD11      LEU  36  -1.996   2.067   1.709
  770   HD12  LEU  36          HD12      LEU  36  -3.316   3.233   1.822
  771   HD13  LEU  36          HD13      LEU  36  -2.661   2.802   0.246
  772   HD21  LEU  36          HD21      LEU  36  -4.193  -0.589   0.046
  773   HD22  LEU  36          HD22      LEU  36  -2.547  -0.328   0.627
  774   HD23  LEU  36          HD23      LEU  36  -3.144   0.563  -0.775
  775    H    ARG  37           H        ARG  37  -6.550   0.783   4.431
  776    HA   ARG  37           HA       ARG  37  -5.784  -0.618   6.745
  777    HB2  ARG  37           HB2      ARG  37  -8.207   1.108   6.201
  778    HB3  ARG  37           HB3      ARG  37  -7.810   0.467   7.798
  779    HG2  ARG  37           HG2      ARG  37  -5.612   1.636   7.700
  780    HG3  ARG  37           HG3      ARG  37  -6.075   2.324   6.138
  781    HD2  ARG  37           HD2      ARG  37  -6.427   3.915   7.939
  782    HD3  ARG  37           HD3      ARG  37  -7.962   3.468   7.198
  783    HE   ARG  37           HE       ARG  37  -7.049   2.228   9.727
  784   HH11  ARG  37          HH11      ARG  37  -9.516   3.947   8.008
  785   HH12  ARG  37          HH12      ARG  37 -10.620   3.886   9.334
  786   HH21  ARG  37          HH21      ARG  37  -8.505   2.172  11.395
  787   HH22  ARG  37          HH22      ARG  37 -10.071   2.887  11.200
  788    H    GLU  38           H        GLU  38  -8.213  -1.440   4.358
  789    HA   GLU  38           HA       GLU  38  -9.669  -3.295   6.100
  790    HB2  GLU  38           HB2      GLU  38 -10.004  -2.592   3.152
  791    HB3  GLU  38           HB3      GLU  38 -11.022  -3.758   3.995
  792    HG2  GLU  38           HG2      GLU  38 -11.859  -2.013   5.490
  793    HG3  GLU  38           HG3      GLU  38 -10.769  -0.832   4.768
  794    H    LEU  39           H        LEU  39  -7.006  -3.446   3.863
  795    HA   LEU  39           HA       LEU  39  -7.211  -6.398   3.585
  796    HB2  LEU  39           HB2      LEU  39  -5.701  -4.345   1.932
  797    HB3  LEU  39           HB3      LEU  39  -5.555  -6.077   1.695
  798    HG   LEU  39           HG       LEU  39  -8.137  -4.492   1.345
  799   HD11  LEU  39          HD11      LEU  39  -6.293  -5.613  -0.787
  800   HD12  LEU  39          HD12      LEU  39  -6.524  -3.907  -0.402
  801   HD13  LEU  39          HD13      LEU  39  -7.857  -4.844  -1.072
  802   HD21  LEU  39          HD21      LEU  39  -7.556  -7.417   0.729
  803   HD22  LEU  39          HD22      LEU  39  -9.051  -6.563   0.346
  804   HD23  LEU  39          HD23      LEU  39  -8.591  -6.812   2.028
  805    H    VAL  40           H        VAL  40  -5.741  -4.408   5.716
  806    HA   VAL  40           HA       VAL  40  -3.324  -6.133   5.924
  807    HB   VAL  40           HB       VAL  40  -3.660  -3.398   7.233
  808   HG11  VAL  40          HG11      VAL  40  -1.211  -5.195   6.961
  809   HG12  VAL  40          HG12      VAL  40  -2.120  -4.894   8.443
  810   HG13  VAL  40          HG13      VAL  40  -1.226  -3.583   7.681
  811   HG21  VAL  40          HG21      VAL  40  -2.096  -4.113   4.713
  812   HG22  VAL  40          HG22      VAL  40  -2.071  -2.547   5.529
  813   HG23  VAL  40          HG23      VAL  40  -3.562  -3.126   4.790
  814    HA   PRO  41           HA       PRO  41  -5.377  -7.517   9.824
  815    HB2  PRO  41           HB2      PRO  41  -4.228  -9.954   9.988
  816    HB3  PRO  41           HB3      PRO  41  -5.488  -9.622   8.789
  817    HG2  PRO  41           HG2      PRO  41  -2.492  -9.674   8.421
  818    HG3  PRO  41           HG3      PRO  41  -3.751 -10.402   7.400
  819    HD2  PRO  41           HD2      PRO  41  -2.558  -7.967   6.861
  820    HD3  PRO  41           HD3      PRO  41  -4.186  -8.403   6.308
  821    H    GLY  42           H        GLY  42  -2.060  -6.831   9.120
  822    HA2  GLY  42           HA2      GLY  42  -0.973  -7.462  11.770
  823    HA3  GLY  42           HA3      GLY  42  -0.100  -6.801  10.397
  824    H    VAL  43           H        VAL  43  -2.903  -5.756  12.350
  825    HA   VAL  43           HA       VAL  43  -1.588  -3.186  13.013
  826    HB   VAL  43           HB       VAL  43  -4.477  -3.453  11.995
  827   HG11  VAL  43          HG11      VAL  43  -4.299  -1.679  13.700
  828   HG12  VAL  43          HG12      VAL  43  -4.607  -0.989  12.107
  829   HG13  VAL  43          HG13      VAL  43  -2.984  -0.919  12.797
  830   HG21  VAL  43          HG21      VAL  43  -2.889  -3.635  10.131
  831   HG22  VAL  43          HG22      VAL  43  -2.105  -2.130  10.613
  832   HG23  VAL  43          HG23      VAL  43  -3.774  -2.113  10.036
  833    HA   PRO  44           HA       PRO  44  -3.324  -4.079  17.223
  834    HB2  PRO  44           HB2      PRO  44  -3.308  -1.060  17.337
  835    HB3  PRO  44           HB3      PRO  44  -2.736  -2.230  18.536
  836    HG2  PRO  44           HG2      PRO  44  -0.984  -0.915  17.007
  837    HG3  PRO  44           HG3      PRO  44  -0.732  -2.637  17.377
  838    HD2  PRO  44           HD2      PRO  44  -1.734  -1.364  14.834
  839    HD3  PRO  44           HD3      PRO  44  -0.664  -2.769  15.043
  840    H    ARG  45           H        ARG  45  -5.397  -3.845  18.220
  841    HA   ARG  45           HA       ARG  45  -7.544  -3.352  16.290
  842    HB2  ARG  45           HB2      ARG  45  -7.555  -4.726  19.012
  843    HB3  ARG  45           HB3      ARG  45  -8.993  -4.515  18.018
  844    HG2  ARG  45           HG2      ARG  45  -8.253  -6.739  17.618
  845    HG3  ARG  45           HG3      ARG  45  -7.802  -5.821  16.184
  846    HD2  ARG  45           HD2      ARG  45  -5.471  -5.591  17.273
  847    HD3  ARG  45           HD3      ARG  45  -6.004  -6.842  18.401
  848    HE   ARG  45           HE       ARG  45  -6.481  -7.779  15.817
  849   HH11  ARG  45          HH11      ARG  45  -3.705  -6.959  17.733
  850   HH12  ARG  45          HH12      ARG  45  -2.676  -8.033  16.862
  851   HH21  ARG  45          HH21      ARG  45  -5.107  -9.091  14.699
  852   HH22  ARG  45          HH22      ARG  45  -3.450  -9.224  15.177
  853    H    GLY  46           H        GLY  46  -6.440  -2.124  19.419
  854    HA2  GLY  46           HA2      GLY  46  -8.508  -0.016  19.453
  855    HA3  GLY  46           HA3      GLY  46  -7.333  -0.364  20.717
  856    H    THR  47           H        THR  47  -7.307   0.622  17.257
  857    HA   THR  47           HA       THR  47  -5.719   3.001  17.864
  858    HB   THR  47           HB       THR  47  -4.005   1.110  17.484
  859    HG1  THR  47           HG1      THR  47  -2.667   2.516  16.473
  860   HG21  THR  47          HG21      THR  47  -3.519   0.421  15.199
  861   HG22  THR  47          HG22      THR  47  -4.875   1.369  14.583
  862   HG23  THR  47          HG23      THR  47  -5.172  -0.038  15.607
  863    H    GLN  48           H        GLN  48  -5.463   4.437  16.043
  864    HA   GLN  48           HA       GLN  48  -7.257   3.979  13.713
  865    HB2  GLN  48           HB2      GLN  48  -7.821   5.966  15.104
  866    HB3  GLN  48           HB3      GLN  48  -6.195   6.598  14.881
  867    HG2  GLN  48           HG2      GLN  48  -6.635   6.776  12.436
  868    HG3  GLN  48           HG3      GLN  48  -8.285   6.221  12.713
  869   HE21  GLN  48          HE21      GLN  48  -7.270   8.754  11.615
  870   HE22  GLN  48          HE22      GLN  48  -7.983   9.995  12.573
  871    H    LEU  49           H        LEU  49  -4.010   4.183  14.758
  872    HA   LEU  49           HA       LEU  49  -1.950   4.297  13.866
  873    HB2  LEU  49           HB2      LEU  49  -3.315   3.966  11.171
  874    HB3  LEU  49           HB3      LEU  49  -1.578   3.948  11.403
  875    HG   LEU  49           HG       LEU  49  -3.514   1.890  12.536
  876   HD11  LEU  49          HD11      LEU  49  -3.345   1.725  10.099
  877   HD12  LEU  49          HD12      LEU  49  -2.561   0.351  10.872
  878   HD13  LEU  49          HD13      LEU  49  -1.583   1.659  10.205
  879   HD21  LEU  49          HD21      LEU  49  -1.555   2.143  13.993
  880   HD22  LEU  49          HD22      LEU  49  -0.470   1.953  12.612
  881   HD23  LEU  49          HD23      LEU  49  -1.484   0.605  13.135
  882    H    SER  50           H        SER  50  -0.509   5.647  12.403
  883    HA   SER  50           HA       SER  50  -1.600   8.342  11.832
  884    HB2  SER  50           HB2      SER  50   0.423   8.311  13.243
  885    HB3  SER  50           HB3      SER  50   1.292   7.380  12.022
  886    HG   SER  50           HG       SER  50   1.822   9.553  11.809
  887    H    GLN  51           H        GLN  51  -0.582   9.358   9.778
  888    HA   GLN  51           HA       GLN  51  -1.616   8.049   7.538
  889    HB2  GLN  51           HB2      GLN  51  -0.215  10.575   8.068
  890    HB3  GLN  51           HB3      GLN  51   0.250   9.941   6.503
  891    HG2  GLN  51           HG2      GLN  51  -2.625  10.404   7.357
  892    HG3  GLN  51           HG3      GLN  51  -1.654  11.561   6.449
  893   HE21  GLN  51          HE21      GLN  51  -3.007  11.534   4.655
  894   HE22  GLN  51          HE22      GLN  51  -3.150  10.180   3.599
  895    H    VAL  52           H        VAL  52   1.834   8.372   8.452
  896    HA   VAL  52           HA       VAL  52   2.830   6.927   6.178
  897    HB   VAL  52           HB       VAL  52   4.279   7.536   8.797
  898   HG11  VAL  52          HG11      VAL  52   5.393   6.867   6.044
  899   HG12  VAL  52          HG12      VAL  52   5.438   5.824   7.469
  900   HG13  VAL  52          HG13      VAL  52   6.354   7.332   7.454
  901   HG21  VAL  52          HG21      VAL  52   3.407   9.609   7.798
  902   HG22  VAL  52          HG22      VAL  52   4.157   9.207   6.251
  903   HG23  VAL  52          HG23      VAL  52   5.166   9.551   7.659
  904    H    GLU  53           H        GLU  53   1.983   6.043   9.512
  905    HA   GLU  53           HA       GLU  53   2.890   3.398   9.597
  906    HB2  GLU  53           HB2      GLU  53   0.691   4.887  11.026
  907    HB3  GLU  53           HB3      GLU  53   0.703   3.134  11.163
  908    HG2  GLU  53           HG2      GLU  53   2.981   4.977  11.956
  909    HG3  GLU  53           HG3      GLU  53   1.842   4.197  13.057
  910    H    ILE  54           H        ILE  54  -0.166   4.669   8.230
  911    HA   ILE  54           HA       ILE  54  -1.451   2.261   7.610
  912    HB   ILE  54           HB       ILE  54  -1.501   4.903   6.082
  913   HG12  ILE  54          HG12      ILE  54  -3.474   3.736   8.117
  914   HG13  ILE  54          HG13      ILE  54  -2.340   5.045   8.425
  915   HG21  ILE  54          HG21      ILE  54  -3.338   2.497   5.721
  916   HG22  ILE  54          HG22      ILE  54  -2.220   3.171   4.530
  917   HG23  ILE  54          HG23      ILE  54  -3.630   4.098   5.031
  918   HD11  ILE  54          HD11      ILE  54  -4.671   5.136   6.509
  919   HD12  ILE  54          HD12      ILE  54  -3.530   6.453   6.810
  920   HD13  ILE  54          HD13      ILE  54  -4.586   5.884   8.103
  921    H    LEU  55           H        LEU  55   0.778   4.160   5.528
  922    HA   LEU  55           HA       LEU  55   0.921   2.379   3.356
  923    HB2  LEU  55           HB2      LEU  55   2.998   4.358   4.361
  924    HB3  LEU  55           HB3      LEU  55   3.113   3.511   2.828
  925    HG   LEU  55           HG       LEU  55   1.029   5.587   3.595
  926   HD11  LEU  55          HD11      LEU  55   2.026   6.917   1.779
  927   HD12  LEU  55          HD12      LEU  55   3.216   5.647   1.486
  928   HD13  LEU  55          HD13      LEU  55   3.223   6.529   3.015
  929   HD21  LEU  55          HD21      LEU  55   0.134   5.328   1.300
  930   HD22  LEU  55          HD22      LEU  55  -0.069   3.862   2.253
  931   HD23  LEU  55          HD23      LEU  55   1.210   3.950   1.039
  932    H    GLN  56           H        GLN  56   3.011   2.611   6.245
  933    HA   GLN  56           HA       GLN  56   4.837   0.587   5.450
  934    HB2  GLN  56           HB2      GLN  56   4.310   1.838   8.163
  935    HB3  GLN  56           HB3      GLN  56   5.559   0.621   7.900
  936    HG2  GLN  56           HG2      GLN  56   6.540   2.140   6.118
  937    HG3  GLN  56           HG3      GLN  56   5.393   3.373   6.644
  938   HE21  GLN  56          HE21      GLN  56   7.136   4.741   7.193
  939   HE22  GLN  56          HE22      GLN  56   8.079   4.487   8.616
  940    H    ARG  57           H        ARG  57   1.802   0.374   7.310
  941    HA   ARG  57           HA       ARG  57   2.141  -2.326   8.174
  942    HB2  ARG  57           HB2      ARG  57  -0.439  -0.794   7.622
  943    HB3  ARG  57           HB3      ARG  57  -0.374  -2.382   8.366
  944    HG2  ARG  57           HG2      ARG  57   0.454   0.270   9.523
  945    HG3  ARG  57           HG3      ARG  57  -0.698  -0.898  10.144
  946    HD2  ARG  57           HD2      ARG  57   0.956  -1.523  11.564
  947    HD3  ARG  57           HD3      ARG  57   1.684  -2.346  10.184
  948    HE   ARG  57           HE       ARG  57   2.359   0.414  11.034
  949   HH11  ARG  57          HH11      ARG  57   3.409  -2.579   9.645
  950   HH12  ARG  57          HH12      ARG  57   5.061  -2.088   9.603
  951   HH21  ARG  57          HH21      ARG  57   4.466   0.997  11.002
  952   HH22  ARG  57          HH22      ARG  57   5.657  -0.101  10.394
  953    H    VAL  58           H        VAL  58   0.890  -0.880   5.198
  954    HA   VAL  58           HA       VAL  58   0.154  -3.275   3.843
  955    HB   VAL  58           HB       VAL  58   1.026  -0.579   2.698
  956   HG11  VAL  58          HG11      VAL  58  -0.183  -1.242   0.644
  957   HG12  VAL  58          HG12      VAL  58  -0.470  -2.845   1.331
  958   HG13  VAL  58          HG13      VAL  58   1.176  -2.314   0.983
  959   HG21  VAL  58          HG21      VAL  58  -1.386  -0.076   2.514
  960   HG22  VAL  58          HG22      VAL  58  -0.922  -0.375   4.190
  961   HG23  VAL  58          HG23      VAL  58  -1.776  -1.620   3.278
  962    H    ILE  59           H        ILE  59   3.182  -1.377   3.931
  963    HA   ILE  59           HA       ILE  59   4.668  -2.760   1.983
  964    HB   ILE  59           HB       ILE  59   5.617  -1.186   4.418
  965   HG12  ILE  59          HG12      ILE  59   5.551  -0.365   1.471
  966   HG13  ILE  59          HG13      ILE  59   4.316   0.070   2.644
  967   HG21  ILE  59          HG21      ILE  59   7.854  -1.042   3.336
  968   HG22  ILE  59          HG22      ILE  59   7.313  -2.158   2.080
  969   HG23  ILE  59          HG23      ILE  59   7.435  -2.704   3.753
  970   HD11  ILE  59          HD11      ILE  59   5.851   1.890   2.249
  971   HD12  ILE  59          HD12      ILE  59   7.212   0.890   2.751
  972   HD13  ILE  59          HD13      ILE  59   5.964   1.336   3.920
  973    H    ASP  60           H        ASP  60   4.849  -3.136   5.561
  974    HA   ASP  60           HA       ASP  60   6.587  -5.366   5.576
  975    HB2  ASP  60           HB2      ASP  60   4.644  -4.350   7.692
  976    HB3  ASP  60           HB3      ASP  60   5.842  -5.612   7.991
  977    H    TYR  61           H        TYR  61   3.056  -5.211   5.455
  978    HA   TYR  61           HA       TYR  61   2.391  -7.929   5.729
  979    HB2  TYR  61           HB2      TYR  61   0.647  -6.236   5.660
  980    HB3  TYR  61           HB3      TYR  61   1.133  -5.712   4.056
  981    HD1  TYR  61           HD1      TYR  61  -0.304  -8.668   5.883
  982    HD2  TYR  61           HD2      TYR  61   0.028  -6.620   2.134
  983    HE1  TYR  61           HE1      TYR  61  -1.983 -10.172   4.909
  984    HE2  TYR  61           HE2      TYR  61  -1.665  -8.127   1.172
  985    HH   TYR  61           HH       TYR  61  -3.636 -10.117   3.037
  986    H    ILE  62           H        ILE  62   3.085  -6.091   2.747
  987    HA   ILE  62           HA       ILE  62   2.985  -8.272   0.944
  988    HB   ILE  62           HB       ILE  62   4.270  -5.517   0.665
  989   HG12  ILE  62          HG12      ILE  62   1.596  -6.560  -0.423
  990   HG13  ILE  62          HG13      ILE  62   1.765  -5.550   1.010
  991   HG21  ILE  62          HG21      ILE  62   3.727  -7.565  -1.520
  992   HG22  ILE  62          HG22      ILE  62   5.314  -7.044  -0.949
  993   HG23  ILE  62          HG23      ILE  62   4.265  -5.902  -1.784
  994   HD11  ILE  62          HD11      ILE  62   2.654  -3.736  -0.380
  995   HD12  ILE  62          HD12      ILE  62   1.049  -4.250  -0.899
  996   HD13  ILE  62          HD13      ILE  62   2.470  -4.751  -1.814
  997    H    LEU  63           H        LEU  63   5.774  -6.684   2.556
  998    HA   LEU  63           HA       LEU  63   7.927  -8.010   1.414
  999    HB2  LEU  63           HB2      LEU  63   7.515  -6.965   4.235
 1000    HB3  LEU  63           HB3      LEU  63   9.048  -7.652   3.726
 1001    HG   LEU  63           HG       LEU  63   7.754  -5.196   2.481
 1002   HD11  LEU  63          HD11      LEU  63  10.103  -5.364   4.398
 1003   HD12  LEU  63          HD12      LEU  63   8.494  -4.740   4.774
 1004   HD13  LEU  63          HD13      LEU  63   9.510  -3.898   3.605
 1005   HD21  LEU  63          HD21      LEU  63   9.896  -4.909   1.309
 1006   HD22  LEU  63          HD22      LEU  63   9.144  -6.441   0.880
 1007   HD23  LEU  63          HD23      LEU  63  10.499  -6.415   2.009
 1008    H    ASP  64           H        ASP  64   5.993  -8.993   4.227
 1009    HA   ASP  64           HA       ASP  64   7.397 -11.360   4.868
 1010    HB2  ASP  64           HB2      ASP  64   5.844 -10.111   6.384
 1011    HB3  ASP  64           HB3      ASP  64   4.480 -10.662   5.417
 1012    H    LEU  65           H        LEU  65   4.765 -10.740   2.592
 1013    HA   LEU  65           HA       LEU  65   4.271 -13.494   1.883
 1014    HB2  LEU  65           HB2      LEU  65   3.577 -10.922   0.416
 1015    HB3  LEU  65           HB3      LEU  65   2.959 -12.514   0.005
 1016    HG   LEU  65           HG       LEU  65   2.377 -10.968   2.560
 1017   HD11  LEU  65          HD11      LEU  65   1.165 -10.085   0.638
 1018   HD12  LEU  65          HD12      LEU  65   0.058 -10.893   1.743
 1019   HD13  LEU  65          HD13      LEU  65   0.553 -11.695   0.250
 1020   HD21  LEU  65          HD21      LEU  65   0.845 -12.813   3.151
 1021   HD22  LEU  65          HD22      LEU  65   2.522 -13.345   3.085
 1022   HD23  LEU  65          HD23      LEU  65   1.423 -13.738   1.760
 1023    H    GLN  66           H        GLN  66   6.340 -10.934   0.678
 1024    HA   GLN  66           HA       GLN  66   7.102 -12.265  -1.790
 1025    HB2  GLN  66           HB2      GLN  66   8.024  -9.660  -0.512
 1026    HB3  GLN  66           HB3      GLN  66   8.630 -10.241  -2.056
 1027    HG2  GLN  66           HG2      GLN  66   5.708  -9.656  -1.513
 1028    HG3  GLN  66           HG3      GLN  66   6.835  -8.484  -2.190
 1029   HE21  GLN  66          HE21      GLN  66   7.525  -8.734  -4.314
 1030   HE22  GLN  66          HE22      GLN  66   6.768  -9.825  -5.419
 1031    H    VAL  67           H        VAL  67   9.298 -10.792   0.639
 1032    HA   VAL  67           HA       VAL  67  11.138 -13.100   0.338
 1033    HB   VAL  67           HB       VAL  67  13.057 -11.430   0.490
 1034   HG11  VAL  67          HG11      VAL  67  12.434 -12.431  -1.662
 1035   HG12  VAL  67          HG12      VAL  67  12.967 -10.767  -1.889
 1036   HG13  VAL  67          HG13      VAL  67  11.244 -11.156  -1.942
 1037   HG21  VAL  67          HG21      VAL  67  12.624  -9.055  -0.072
 1038   HG22  VAL  67          HG22      VAL  67  11.827  -9.498   1.436
 1039   HG23  VAL  67          HG23      VAL  67  10.881  -9.352  -0.046
 1040    H    VAL  68           H        VAL  68  11.897 -13.968   2.159
 1041    HA   VAL  68           HA       VAL  68  11.410 -12.607   4.750
 1042    HB   VAL  68           HB       VAL  68  11.498 -14.963   5.762
 1043   HG11  VAL  68          HG11      VAL  68   9.149 -15.475   5.162
 1044   HG12  VAL  68          HG12      VAL  68   9.244 -14.355   3.802
 1045   HG13  VAL  68          HG13      VAL  68   9.381 -13.750   5.454
 1046   HG21  VAL  68          HG21      VAL  68  11.203 -15.853   2.854
 1047   HG22  VAL  68          HG22      VAL  68  11.009 -16.890   4.272
 1048   HG23  VAL  68          HG23      VAL  68  12.582 -16.182   3.905
  Start of MODEL   10
    1    H1   MET   1           H1       MET   1  21.083 -22.133  -0.475
    2    H2   MET   1           H2       MET   1  22.271 -21.249  -1.277
    3    H3   MET   1           H3       MET   1  20.784 -21.533  -2.030
    4    HA   MET   1           HA       MET   1  21.229 -19.913   0.411
    5    HB2  MET   1           HB2      MET   1  20.430 -19.032  -2.411
    6    HB3  MET   1           HB3      MET   1  20.563 -17.968  -1.014
    7    HG2  MET   1           HG2      MET   1  22.509 -17.699  -2.417
    8    HG3  MET   1           HG3      MET   1  22.995 -18.468  -0.904
    9    HE1  MET   1           HE1      MET   1  25.335 -19.170  -2.086
   10    HE2  MET   1           HE2      MET   1  24.805 -18.422  -3.595
   11    HE3  MET   1           HE3      MET   1  25.415 -20.074  -3.600
   12    H    GLY   2           H        GLY   2  19.398 -19.464   1.602
   13    HA2  GLY   2           HA2      GLY   2  16.761 -19.316   0.568
   14    HA3  GLY   2           HA3      GLY   2  17.006 -20.895   1.297
   15    H    HIS   3           H        HIS   3  15.268 -18.560   2.042
   16    HA   HIS   3           HA       HIS   3  16.155 -17.907   4.766
   17    HB2  HIS   3           HB2      HIS   3  14.142 -16.488   4.862
   18    HB3  HIS   3           HB3      HIS   3  15.052 -16.145   3.396
   19    HD2  HIS   3           HD2      HIS   3  13.773 -16.846   0.981
   20    HE1  HIS   3           HE1      HIS   3  10.106 -17.876   2.823
   21    HE2  HIS   3           HE2      HIS   3  11.344 -17.674   0.630
   22    H    HIS   4           H        HIS   4  14.323 -18.157   6.523
   23    HA   HIS   4           HA       HIS   4  12.634 -20.521   6.198
   24    HB2  HIS   4           HB2      HIS   4  13.572 -21.638   8.248
   25    HB3  HIS   4           HB3      HIS   4  14.696 -21.580   6.900
   26    HD2  HIS   4           HD2      HIS   4  14.813 -21.012  10.578
   27    HE1  HIS   4           HE1      HIS   4  17.838 -18.542   8.955
   28    HE2  HIS   4           HE2      HIS   4  16.824 -19.454  11.080
   29    H    HIS   5           H        HIS   5  10.720 -19.702   6.752
   30    HA   HIS   5           HA       HIS   5  10.143 -19.102   9.500
   31    HB2  HIS   5           HB2      HIS   5   9.208 -16.861   9.257
   32    HB3  HIS   5           HB3      HIS   5  10.860 -16.820   8.665
   33    HD2  HIS   5           HD2      HIS   5  11.146 -16.364   5.888
   34    HE1  HIS   5           HE1      HIS   5   7.057 -15.445   5.294
   35    HE2  HIS   5           HE2      HIS   5   9.387 -15.252   4.338
   36    H    HIS   6           H        HIS   6   7.754 -18.810   9.842
   37    HA   HIS   6           HA       HIS   6   5.945 -19.529   7.665
   38    HB2  HIS   6           HB2      HIS   6   6.705 -21.745   8.534
   39    HB3  HIS   6           HB3      HIS   6   6.209 -21.288  10.160
   40    HD2  HIS   6           HD2      HIS   6   3.503 -21.626  10.712
   41    HE1  HIS   6           HE1      HIS   6   2.476 -23.088   6.881
   42    HE2  HIS   6           HE2      HIS   6   1.650 -22.657   9.229
   43    H    HIS   7           H        HIS   7   4.826 -17.625   7.923
   44    HA   HIS   7           HA       HIS   7   3.539 -17.065  10.543
   45    HB2  HIS   7           HB2      HIS   7   4.633 -15.031   8.546
   46    HB3  HIS   7           HB3      HIS   7   3.697 -14.622   9.981
   47    HD2  HIS   7           HD2      HIS   7   7.303 -15.570   8.974
   48    HE1  HIS   7           HE1      HIS   7   7.197 -15.023  13.165
   49    HE2  HIS   7           HE2      HIS   7   8.674 -15.153  11.121
   50    H    HIS   8           H        HIS   8   1.398 -16.824  10.527
   51    HA   HIS   8           HA       HIS   8  -0.044 -15.969   8.120
   52    HB2  HIS   8           HB2      HIS   8  -1.841 -17.745   8.608
   53    HB3  HIS   8           HB3      HIS   8  -0.346 -18.319   7.891
   54    HD2  HIS   8           HD2      HIS   8  -2.252 -18.538  11.329
   55    HE1  HIS   8           HE1      HIS   8   0.786 -21.480  11.197
   56    HE2  HIS   8           HE2      HIS   8  -1.092 -20.491  12.572
   57    H    SER   9           H        SER   9  -1.331 -14.332   8.604
   58    HA   SER   9           HA       SER   9  -2.782 -14.193  11.161
   59    HB2  SER   9           HB2      SER   9  -0.776 -12.785  11.521
   60    HB3  SER   9           HB3      SER   9  -1.123 -11.876  10.049
   61    HG   SER   9           HG       SER   9  -2.158 -10.639  11.432
   62    H    HIS  10           H        HIS  10  -4.851 -14.068  10.613
   63    HA   HIS  10           HA       HIS  10  -5.716 -12.532   8.213
   64    HB2  HIS  10           HB2      HIS  10  -5.994 -15.059   8.122
   65    HB3  HIS  10           HB3      HIS  10  -7.097 -14.939   9.488
   66    HD1  HIS  10           HD1      HIS  10  -9.492 -14.313   8.979
   67    HD2  HIS  10           HD2      HIS  10  -7.011 -13.877   5.675
   68    HE1  HIS  10           HE1      HIS  10 -11.020 -13.920   7.042
   69    HE2  HIS  10           HE2      HIS  10  -9.511 -13.826   5.037
   70    H    MET  11           H        MET  11  -5.488 -12.165  11.399
   71    HA   MET  11           HA       MET  11  -8.191 -11.442  12.179
   72    HB2  MET  11           HB2      MET  11  -5.538 -11.157  13.647
   73    HB3  MET  11           HB3      MET  11  -7.112 -10.818  14.357
   74    HG2  MET  11           HG2      MET  11  -7.756 -13.185  14.032
   75    HG3  MET  11           HG3      MET  11  -6.159 -13.518  13.359
   76    HE1  MET  11           HE1      MET  11  -7.530 -15.080  15.885
   77    HE2  MET  11           HE2      MET  11  -6.107 -15.262  16.911
   78    HE3  MET  11           HE3      MET  11  -5.974 -15.519  15.172
   79    H    GLY  12           H        GLY  12  -8.495  -9.289  13.349
   80    HA2  GLY  12           HA2      GLY  12  -7.034  -6.951  12.723
   81    HA3  GLY  12           HA3      GLY  12  -8.353  -7.124  11.567
   82    H    GLY  13           H        GLY  13 -10.550  -7.076  12.332
   83    HA2  GLY  13           HA2      GLY  13 -12.333  -6.559  13.682
   84    HA3  GLY  13           HA3      GLY  13 -11.323  -6.958  15.058
   85    H    GLY  14           H        GLY  14 -10.112  -4.436  13.038
   86    HA2  GLY  14           HA2      GLY  14 -10.594  -2.448  15.175
   87    HA3  GLY  14           HA3      GLY  14  -9.348  -2.384  13.938
   88    H    LYS  15           H        LYS  15  -9.791  -0.330  13.228
   89    HA   LYS  15           HA       LYS  15 -12.433   0.181  11.952
   90    HB2  LYS  15           HB2      LYS  15 -10.711   2.259  13.379
   91    HB3  LYS  15           HB3      LYS  15 -12.318   2.508  12.697
   92    HG2  LYS  15           HG2      LYS  15 -13.262   0.951  14.384
   93    HG3  LYS  15           HG3      LYS  15 -11.649   0.734  15.068
   94    HD2  LYS  15           HD2      LYS  15 -11.595   3.205  15.568
   95    HD3  LYS  15           HD3      LYS  15 -13.266   3.310  15.004
   96    HE2  LYS  15           HE2      LYS  15 -12.243   1.729  17.383
   97    HE3  LYS  15           HE3      LYS  15 -13.254   3.173  17.426
   98    HZ1  LYS  15           HZ1      LYS  15 -14.588   1.247  17.783
   99    HZ2  LYS  15           HZ2      LYS  15 -14.021   0.504  16.376
  100    HZ3  LYS  15           HZ3      LYS  15 -14.985   1.886  16.271
  101    H    GLY  16           H        GLY  16 -12.374   1.842  10.236
  102    HA2  GLY  16           HA2      GLY  16  -9.731   2.153   8.896
  103    HA3  GLY  16           HA3      GLY  16 -11.205   1.794   8.012
  104    HA   PRO  17           HA       PRO  17 -11.796   6.383   9.203
  105    HB2  PRO  17           HB2      PRO  17 -10.616   7.556  11.272
  106    HB3  PRO  17           HB3      PRO  17 -11.770   6.246  11.567
  107    HG2  PRO  17           HG2      PRO  17  -8.759   6.161  11.605
  108    HG3  PRO  17           HG3      PRO  17  -9.911   5.406  12.727
  109    HD2  PRO  17           HD2      PRO  17  -8.691   4.124  10.522
  110    HD3  PRO  17           HD3      PRO  17 -10.119   3.534  11.397
  111    H    ALA  18           H        ALA  18 -10.578   8.677   9.431
  112    HA   ALA  18           HA       ALA  18  -8.461   8.810   7.451
  113    HB1  ALA  18           HB1      ALA  18 -10.245  10.503   7.478
  114    HB2  ALA  18           HB2      ALA  18  -8.666  11.253   7.713
  115    HB3  ALA  18           HB3      ALA  18  -9.752  11.028   9.090
  116    H    ALA  19           H        ALA  19  -8.802   9.699  10.885
  117    HA   ALA  19           HA       ALA  19  -7.410  10.074  12.607
  118    HB1  ALA  19           HB1      ALA  19  -5.333   8.788  12.815
  119    HB2  ALA  19           HB2      ALA  19  -5.380   8.400  11.093
  120    HB3  ALA  19           HB3      ALA  19  -6.624   7.772  12.173
  121    H    GLU  20           H        GLU  20  -5.069  10.942  13.192
  122    HA   GLU  20           HA       GLU  20  -4.132  12.916  11.198
  123    HB2  GLU  20           HB2      GLU  20  -4.014  14.683  12.855
  124    HB3  GLU  20           HB3      GLU  20  -5.656  14.048  12.837
  125    HG2  GLU  20           HG2      GLU  20  -5.122  12.708  14.881
  126    HG3  GLU  20           HG3      GLU  20  -3.523  13.449  14.918
  127    H    GLU  21           H        GLU  21  -2.040  13.994  12.144
  128    HA   GLU  21           HA       GLU  21  -0.178  12.315  13.550
  129    HB2  GLU  21           HB2      GLU  21   1.252  11.789  11.529
  130    HB3  GLU  21           HB3      GLU  21  -0.297  10.955  11.530
  131    HG2  GLU  21           HG2      GLU  21  -1.195  12.630   9.938
  132    HG3  GLU  21           HG3      GLU  21   0.380  13.432   9.913
  133    HA   PRO  22           HA       PRO  22   2.199  16.232  13.373
  134    HB2  PRO  22           HB2      PRO  22   4.760  14.704  13.327
  135    HB3  PRO  22           HB3      PRO  22   4.143  15.817  14.551
  136    HG2  PRO  22           HG2      PRO  22   4.238  13.166  15.024
  137    HG3  PRO  22           HG3      PRO  22   2.894  14.155  15.637
  138    HD2  PRO  22           HD2      PRO  22   2.980  12.396  13.174
  139    HD3  PRO  22           HD3      PRO  22   1.733  12.486  14.445
  140    H    LEU  23           H        LEU  23   1.746  14.483  10.771
  141    HA   LEU  23           HA       LEU  23   1.917  14.748   8.563
  142    HB2  LEU  23           HB2      LEU  23   3.349  17.350   9.234
  143    HB3  LEU  23           HB3      LEU  23   2.824  16.895   7.623
  144    HG   LEU  23           HG       LEU  23   0.994  17.451   9.996
  145   HD11  LEU  23          HD11      LEU  23   2.000  19.493   9.098
  146   HD12  LEU  23          HD12      LEU  23   0.281  19.433   8.713
  147   HD13  LEU  23          HD13      LEU  23   1.475  19.060   7.467
  148   HD21  LEU  23          HD21      LEU  23  -0.878  17.225   8.384
  149   HD22  LEU  23          HD22      LEU  23  -0.002  15.711   8.586
  150   HD23  LEU  23          HD23      LEU  23   0.259  16.689   7.140
  151    H    SER  24           H        SER  24   3.788  15.469   6.789
  152    HA   SER  24           HA       SER  24   5.962  13.597   7.087
  153    HB2  SER  24           HB2      SER  24   5.308  15.616   4.904
  154    HB3  SER  24           HB3      SER  24   6.575  14.394   4.794
  155    HG   SER  24           HG       SER  24   4.334  13.960   3.904
  156    H    LEU  25           H        LEU  25   7.725  14.090   8.272
  157    HA   LEU  25           HA       LEU  25   8.616  16.777   8.859
  158    HB2  LEU  25           HB2      LEU  25   9.920  14.079   9.437
  159    HB3  LEU  25           HB3      LEU  25  10.555  15.616   9.995
  160    HG   LEU  25           HG       LEU  25   8.375  15.925  11.314
  161   HD11  LEU  25          HD11      LEU  25   7.962  12.981  10.697
  162   HD12  LEU  25          HD12      LEU  25   6.944  14.314  10.150
  163   HD13  LEU  25          HD13      LEU  25   7.044  13.936  11.866
  164   HD21  LEU  25          HD21      LEU  25  10.142  13.574  12.092
  165   HD22  LEU  25          HD22      LEU  25   9.112  14.503  13.183
  166   HD23  LEU  25          HD23      LEU  25  10.484  15.278  12.403
  167    H    LEU  26           H        LEU  26  10.075  14.031   7.115
  168    HA   LEU  26           HA       LEU  26  11.587  15.896   5.348
  169    HB2  LEU  26           HB2      LEU  26  12.766  14.220   7.188
  170    HB3  LEU  26           HB3      LEU  26  12.665  13.124   5.827
  171    HG   LEU  26           HG       LEU  26  14.136  15.794   5.849
  172   HD11  LEU  26          HD11      LEU  26  15.252  14.119   7.243
  173   HD12  LEU  26          HD12      LEU  26  16.201  14.465   5.800
  174   HD13  LEU  26          HD13      LEU  26  15.260  12.974   5.896
  175   HD21  LEU  26          HD21      LEU  26  15.089  15.119   3.658
  176   HD22  LEU  26          HD22      LEU  26  13.341  15.320   3.578
  177   HD23  LEU  26          HD23      LEU  26  14.034  13.698   3.642
  178    H    ASP  27           H        ASP  27   8.963  15.071   4.833
  179    HA   ASP  27           HA       ASP  27   7.493  13.924   3.555
  180    HB2  ASP  27           HB2      ASP  27   9.858  13.904   1.640
  181    HB3  ASP  27           HB3      ASP  27   8.199  13.535   1.171
  182    H    ASP  28           H        ASP  28   8.225  12.341   5.446
  183    HA   ASP  28           HA       ASP  28   9.697  10.017   5.025
  184    HB2  ASP  28           HB2      ASP  28   7.336  10.425   6.914
  185    HB3  ASP  28           HB3      ASP  28   8.564   9.169   7.064
  186    H    MET  29           H        MET  29   6.207  10.531   4.556
  187    HA   MET  29           HA       MET  29   5.527   7.890   3.785
  188    HB2  MET  29           HB2      MET  29   3.482   8.892   2.788
  189    HB3  MET  29           HB3      MET  29   3.769   9.378   4.448
  190    HG2  MET  29           HG2      MET  29   4.353  11.585   3.819
  191    HG3  MET  29           HG3      MET  29   4.571  11.136   2.128
  192    HE1  MET  29           HE1      MET  29   0.312  10.603   3.748
  193    HE2  MET  29           HE2      MET  29   1.727  10.481   4.797
  194    HE3  MET  29           HE3      MET  29   1.497   9.327   3.480
  195    H    ASN  30           H        ASN  30   6.769  10.630   1.896
  196    HA   ASN  30           HA       ASN  30   6.393   9.543  -0.706
  197    HB2  ASN  30           HB2      ASN  30   6.785  11.907  -0.525
  198    HB3  ASN  30           HB3      ASN  30   8.277  11.670   0.368
  199   HD21  ASN  30          HD21      ASN  30  10.174  11.218  -0.773
  200   HD22  ASN  30          HD22      ASN  30  10.285  11.378  -2.485
  201    H    HIS  31           H        HIS  31   9.058   9.259   1.643
  202    HA   HIS  31           HA       HIS  31  10.798   7.676   0.041
  203    HB2  HIS  31           HB2      HIS  31  10.526   7.800   3.072
  204    HB3  HIS  31           HB3      HIS  31  11.854   7.014   2.218
  205    HD2  HIS  31           HD2      HIS  31  10.904  10.444   3.540
  206    HE1  HIS  31           HE1      HIS  31  14.202  10.998   0.981
  207    HE2  HIS  31           HE2      HIS  31  12.585  12.127   2.556
  208    H    CYS  32           H        CYS  32   8.146   6.826   2.256
  209    HA   CYS  32           HA       CYS  32   8.271   3.997   1.987
  210    HB2  CYS  32           HB2      CYS  32   5.874   5.741   2.690
  211    HB3  CYS  32           HB3      CYS  32   5.987   3.998   2.949
  212    HG   CYS  32           HG       CYS  32   8.475   5.737   4.343
  213    H    TYR  33           H        TYR  33   6.741   6.495   0.021
  214    HA   TYR  33           HA       TYR  33   5.054   4.853  -1.569
  215    HB2  TYR  33           HB2      TYR  33   6.003   7.686  -1.695
  216    HB3  TYR  33           HB3      TYR  33   5.509   7.002  -3.236
  217    HD1  TYR  33           HD1      TYR  33   3.197   5.718  -3.197
  218    HD2  TYR  33           HD2      TYR  33   4.274   8.748  -0.368
  219    HE1  TYR  33           HE1      TYR  33   0.829   6.142  -2.737
  220    HE2  TYR  33           HE2      TYR  33   1.903   9.155   0.085
  221    HH   TYR  33           HH       TYR  33  -0.216   8.843  -0.884
  222    H    SER  34           H        SER  34   8.385   5.998  -2.040
  223    HA   SER  34           HA       SER  34   8.960   4.781  -4.514
  224    HB2  SER  34           HB2      SER  34  10.522   6.367  -3.454
  225    HB3  SER  34           HB3      SER  34  10.812   5.240  -2.131
  226    HG   SER  34           HG       SER  34  11.893   3.886  -3.517
  227    H    ARG  35           H        ARG  35   9.225   3.541  -1.196
  228    HA   ARG  35           HA       ARG  35  10.278   0.988  -1.712
  229    HB2  ARG  35           HB2      ARG  35  10.078   2.397   0.466
  230    HB3  ARG  35           HB3      ARG  35   8.521   1.592   0.657
  231    HG2  ARG  35           HG2      ARG  35   9.577  -0.577   0.760
  232    HG3  ARG  35           HG3      ARG  35  11.140   0.100   0.284
  233    HD2  ARG  35           HD2      ARG  35  11.117   1.472   2.358
  234    HD3  ARG  35           HD3      ARG  35   9.639   0.645   2.833
  235    HE   ARG  35           HE       ARG  35  11.067  -1.463   2.713
  236   HH11  ARG  35          HH11      ARG  35  12.480   1.601   3.460
  237   HH12  ARG  35          HH12      ARG  35  13.691   0.908   4.479
  238   HH21  ARG  35          HH21      ARG  35  12.641  -2.307   4.045
  239   HH22  ARG  35          HH22      ARG  35  13.773  -1.249   4.810
  240    H    LEU  36           H        LEU  36   6.894   2.119  -1.560
  241    HA   LEU  36           HA       LEU  36   5.534  -0.333  -1.820
  242    HB2  LEU  36           HB2      LEU  36   4.788   2.390  -2.977
  243    HB3  LEU  36           HB3      LEU  36   3.708   1.007  -2.943
  244    HG   LEU  36           HG       LEU  36   4.759   2.520  -0.527
  245   HD11  LEU  36          HD11      LEU  36   1.973   2.380  -1.711
  246   HD12  LEU  36          HD12      LEU  36   3.064   3.766  -1.763
  247   HD13  LEU  36          HD13      LEU  36   2.426   3.211  -0.220
  248   HD21  LEU  36          HD21      LEU  36   4.521   0.136   0.037
  249   HD22  LEU  36          HD22      LEU  36   2.872   0.133  -0.592
  250   HD23  LEU  36          HD23      LEU  36   3.273   1.091   0.835
  251    H    ARG  37           H        ARG  37   6.546   1.963  -4.370
  252    HA   ARG  37           HA       ARG  37   5.719   0.550  -6.632
  253    HB2  ARG  37           HB2      ARG  37   7.947   2.573  -6.313
  254    HB3  ARG  37           HB3      ARG  37   7.317   2.016  -7.870
  255    HG2  ARG  37           HG2      ARG  37   5.083   2.871  -7.311
  256    HG3  ARG  37           HG3      ARG  37   5.644   3.351  -5.708
  257    HD2  ARG  37           HD2      ARG  37   5.562   5.299  -7.031
  258    HD3  ARG  37           HD3      ARG  37   7.266   4.898  -6.840
  259    HE   ARG  37           HE       ARG  37   6.771   3.755  -9.188
  260   HH11  ARG  37          HH11      ARG  37   5.893   6.905  -8.086
  261   HH12  ARG  37          HH12      ARG  37   5.843   7.559  -9.678
  262   HH21  ARG  37          HH21      ARG  37   6.711   4.624 -11.217
  263   HH22  ARG  37          HH22      ARG  37   6.289   6.284 -11.441
  264    H    GLU  38           H        GLU  38   8.467  -0.007  -4.634
  265    HA   GLU  38           HA       GLU  38  10.061  -1.476  -6.574
  266    HB2  GLU  38           HB2      GLU  38  10.387  -0.971  -3.589
  267    HB3  GLU  38           HB3      GLU  38  11.518  -1.960  -4.511
  268    HG2  GLU  38           HG2      GLU  38  12.173  -0.066  -5.878
  269    HG3  GLU  38           HG3      GLU  38  10.907   0.937  -5.172
  270    H    LEU  39           H        LEU  39   7.790  -2.207  -3.998
  271    HA   LEU  39           HA       LEU  39   8.047  -5.125  -4.388
  272    HB2  LEU  39           HB2      LEU  39   6.608  -3.435  -2.321
  273    HB3  LEU  39           HB3      LEU  39   6.331  -5.164  -2.455
  274    HG   LEU  39           HG       LEU  39   9.057  -3.923  -1.884
  275   HD11  LEU  39          HD11      LEU  39   7.521  -3.507  -0.007
  276   HD12  LEU  39          HD12      LEU  39   8.770  -4.669   0.434
  277   HD13  LEU  39          HD13      LEU  39   7.135  -5.230   0.070
  278   HD21  LEU  39          HD21      LEU  39   8.151  -6.839  -1.782
  279   HD22  LEU  39          HD22      LEU  39   9.745  -6.235  -1.329
  280   HD23  LEU  39          HD23      LEU  39   9.214  -6.126  -3.003
  281    H    VAL  40           H        VAL  40   6.219  -2.590  -5.658
  282    HA   VAL  40           HA       VAL  40   3.949  -4.363  -6.377
  283    HB   VAL  40           HB       VAL  40   3.957  -1.306  -6.292
  284   HG11  VAL  40          HG11      VAL  40   2.427  -2.150  -8.012
  285   HG12  VAL  40          HG12      VAL  40   1.509  -1.488  -6.664
  286   HG13  VAL  40          HG13      VAL  40   1.666  -3.237  -6.848
  287   HG21  VAL  40          HG21      VAL  40   2.674  -3.298  -4.370
  288   HG22  VAL  40          HG22      VAL  40   2.444  -1.546  -4.333
  289   HG23  VAL  40          HG23      VAL  40   4.043  -2.227  -4.030
  290    HA   PRO  41           HA       PRO  41   5.667  -3.706 -10.616
  291    HB2  PRO  41           HB2      PRO  41   4.703  -6.022 -11.679
  292    HB3  PRO  41           HB3      PRO  41   6.186  -5.977 -10.716
  293    HG2  PRO  41           HG2      PRO  41   3.400  -6.747  -9.864
  294    HG3  PRO  41           HG3      PRO  41   4.939  -7.574  -9.531
  295    HD2  PRO  41           HD2      PRO  41   3.734  -5.918  -7.722
  296    HD3  PRO  41           HD3      PRO  41   5.495  -6.107  -7.804
  297    H    GLY  42           H        GLY  42   4.276  -4.128 -12.805
  298    HA2  GLY  42           HA2      GLY  42   2.414  -3.538 -14.064
  299    HA3  GLY  42           HA3      GLY  42   1.473  -3.369 -12.589
  300    H    VAL  43           H        VAL  43   4.179  -1.598 -12.047
  301    HA   VAL  43           HA       VAL  43   3.049   0.972 -12.774
  302    HB   VAL  43           HB       VAL  43   5.731   0.256 -11.488
  303   HG11  VAL  43          HG11      VAL  43   5.883   2.654 -10.830
  304   HG12  VAL  43          HG12      VAL  43   4.447   2.993 -11.796
  305   HG13  VAL  43          HG13      VAL  43   5.919   2.430 -12.581
  306   HG21  VAL  43          HG21      VAL  43   3.162   1.265 -10.186
  307   HG22  VAL  43          HG22      VAL  43   4.698   0.999  -9.354
  308   HG23  VAL  43          HG23      VAL  43   3.829  -0.366 -10.054
  309    HA   PRO  44           HA       PRO  44   4.953   0.553 -16.896
  310    HB2  PRO  44           HB2      PRO  44   4.138   3.408 -17.264
  311    HB3  PRO  44           HB3      PRO  44   3.707   1.984 -18.221
  312    HG2  PRO  44           HG2      PRO  44   1.910   3.136 -16.592
  313    HG3  PRO  44           HG3      PRO  44   1.977   1.369 -16.762
  314    HD2  PRO  44           HD2      PRO  44   3.108   3.103 -14.549
  315    HD3  PRO  44           HD3      PRO  44   2.180   1.589 -14.429
  316    H    ARG  45           H        ARG  45   6.956   0.967 -17.707
  317    HA   ARG  45           HA       ARG  45   8.919   2.077 -15.976
  318    HB2  ARG  45           HB2      ARG  45   9.172   1.070 -18.833
  319    HB3  ARG  45           HB3      ARG  45  10.533   1.432 -17.771
  320    HG2  ARG  45           HG2      ARG  45   9.768  -0.320 -16.195
  321    HG3  ARG  45           HG3      ARG  45   8.413  -0.687 -17.263
  322    HD2  ARG  45           HD2      ARG  45  10.233  -2.311 -17.540
  323    HD3  ARG  45           HD3      ARG  45   9.976  -1.383 -19.020
  324    HE   ARG  45           HE       ARG  45  11.925   0.014 -18.252
  325   HH11  ARG  45          HH11      ARG  45  11.743  -3.296 -17.223
  326   HH12  ARG  45          HH12      ARG  45  13.462  -3.440 -17.131
  327   HH21  ARG  45          HH21      ARG  45  14.075  -0.231 -18.119
  328   HH22  ARG  45          HH22      ARG  45  14.749  -1.747 -17.634
  329    H    GLY  46           H        GLY  46   9.348   4.181 -15.738
  330    HA2  GLY  46           HA2      GLY  46  10.231   6.259 -16.370
  331    HA3  GLY  46           HA3      GLY  46   9.750   5.972 -18.034
  332    H    THR  47           H        THR  47   7.150   5.235 -16.048
  333    HA   THR  47           HA       THR  47   5.806   7.795 -16.594
  334    HB   THR  47           HB       THR  47   4.633   5.170 -15.554
  335    HG1  THR  47           HG1      THR  47   4.385   6.217 -18.186
  336   HG21  THR  47          HG21      THR  47   2.445   6.104 -16.211
  337   HG22  THR  47          HG22      THR  47   3.218   7.611 -16.705
  338   HG23  THR  47          HG23      THR  47   3.212   7.141 -15.004
  339    H    GLN  48           H        GLN  48   5.190   9.212 -15.032
  340    HA   GLN  48           HA       GLN  48   6.513   9.123 -12.495
  341    HB2  GLN  48           HB2      GLN  48   4.521  11.120 -13.658
  342    HB3  GLN  48           HB3      GLN  48   5.254  11.318 -12.071
  343    HG2  GLN  48           HG2      GLN  48   6.439  12.713 -13.627
  344    HG3  GLN  48           HG3      GLN  48   7.503  11.408 -13.135
  345   HE21  GLN  48          HE21      GLN  48   8.101   9.849 -14.687
  346   HE22  GLN  48          HE22      GLN  48   7.838  10.073 -16.376
  347    H    LEU  49           H        LEU  49   3.089   8.894 -13.464
  348    HA   LEU  49           HA       LEU  49   1.171   8.276 -12.474
  349    HB2  LEU  49           HB2      LEU  49   2.979   6.734 -10.585
  350    HB3  LEU  49           HB3      LEU  49   1.229   6.609 -10.566
  351    HG   LEU  49           HG       LEU  49   3.089   5.730 -12.802
  352   HD11  LEU  49          HD11      LEU  49   1.253   4.124 -10.997
  353   HD12  LEU  49          HD12      LEU  49   3.015   4.185 -10.905
  354   HD13  LEU  49          HD13      LEU  49   2.236   3.477 -12.317
  355   HD21  LEU  49          HD21      LEU  49   1.072   4.922 -13.989
  356   HD22  LEU  49          HD22      LEU  49   1.080   6.675 -13.835
  357   HD23  LEU  49          HD23      LEU  49   0.045   5.704 -12.784
  358    H    SER  50           H        SER  50  -0.262   9.355 -11.268
  359    HA   SER  50           HA       SER  50   0.423  11.251  -9.263
  360    HB2  SER  50           HB2      SER  50  -2.289  10.005  -9.896
  361    HB3  SER  50           HB3      SER  50  -2.032  11.452  -8.919
  362    HG   SER  50           HG       SER  50  -0.827  11.570 -11.382
  363    H    GLN  51           H        GLN  51  -0.116  11.190  -6.968
  364    HA   GLN  51           HA       GLN  51   1.018   8.991  -5.658
  365    HB2  GLN  51           HB2      GLN  51  -0.733  11.175  -4.459
  366    HB3  GLN  51           HB3      GLN  51   0.316  10.100  -3.539
  367    HG2  GLN  51           HG2      GLN  51   2.287  11.061  -4.688
  368    HG3  GLN  51           HG3      GLN  51   1.224  12.153  -5.575
  369   HE21  GLN  51          HE21      GLN  51  -0.525  12.676  -3.235
  370   HE22  GLN  51          HE22      GLN  51   0.398  13.685  -2.188
  371    H    VAL  52           H        VAL  52  -2.438   9.783  -6.097
  372    HA   VAL  52           HA       VAL  52  -3.466   7.693  -4.427
  373    HB   VAL  52           HB       VAL  52  -4.945   9.003  -6.767
  374   HG11  VAL  52          HG11      VAL  52  -6.042   6.970  -5.888
  375   HG12  VAL  52          HG12      VAL  52  -6.989   8.402  -5.486
  376   HG13  VAL  52          HG13      VAL  52  -5.991   7.631  -4.248
  377   HG21  VAL  52          HG21      VAL  52  -5.838  10.627  -5.134
  378   HG22  VAL  52          HG22      VAL  52  -4.082  10.743  -5.255
  379   HG23  VAL  52          HG23      VAL  52  -4.814   9.932  -3.873
  380    H    GLU  53           H        GLU  53  -2.743   7.918  -7.927
  381    HA   GLU  53           HA       GLU  53  -3.794   5.448  -8.763
  382    HB2  GLU  53           HB2      GLU  53  -2.644   7.538 -10.084
  383    HB3  GLU  53           HB3      GLU  53  -1.282   6.432 -10.114
  384    HG2  GLU  53           HG2      GLU  53  -4.051   5.926 -11.257
  385    HG3  GLU  53           HG3      GLU  53  -2.592   6.288 -12.168
  386    H    ILE  54           H        ILE  54  -0.645   6.261  -7.318
  387    HA   ILE  54           HA       ILE  54   0.589   3.720  -7.518
  388    HB   ILE  54           HB       ILE  54   0.999   5.885  -5.408
  389   HG12  ILE  54          HG12      ILE  54   2.478   5.376  -8.045
  390   HG13  ILE  54          HG13      ILE  54   1.392   6.721  -7.710
  391   HG21  ILE  54          HG21      ILE  54   1.913   3.743  -4.611
  392   HG22  ILE  54          HG22      ILE  54   3.225   4.852  -4.997
  393   HG23  ILE  54          HG23      ILE  54   2.824   3.540  -6.110
  394   HD11  ILE  54          HD11      ILE  54   4.067   6.208  -6.422
  395   HD12  ILE  54          HD12      ILE  54   2.975   7.536  -6.007
  396   HD13  ILE  54          HD13      ILE  54   3.680   7.443  -7.623
  397    H    LEU  55           H        LEU  55  -1.483   5.132  -4.935
  398    HA   LEU  55           HA       LEU  55  -1.527   2.930  -3.162
  399    HB2  LEU  55           HB2      LEU  55  -3.732   4.945  -3.741
  400    HB3  LEU  55           HB3      LEU  55  -3.731   3.835  -2.378
  401    HG   LEU  55           HG       LEU  55  -1.741   6.091  -2.827
  402   HD11  LEU  55          HD11      LEU  55  -2.803   7.133  -0.863
  403   HD12  LEU  55          HD12      LEU  55  -3.980   5.820  -0.791
  404   HD13  LEU  55          HD13      LEU  55  -3.956   6.914  -2.177
  405   HD21  LEU  55          HD21      LEU  55  -1.939   4.129  -0.510
  406   HD22  LEU  55          HD22      LEU  55  -0.866   5.529  -0.586
  407   HD23  LEU  55          HD23      LEU  55  -0.645   4.195  -1.713
  408    H    GLN  56           H        GLN  56  -3.516   3.635  -5.997
  409    HA   GLN  56           HA       GLN  56  -5.291   1.415  -5.825
  410    HB2  GLN  56           HB2      GLN  56  -4.529   3.167  -8.187
  411    HB3  GLN  56           HB3      GLN  56  -5.843   1.991  -8.208
  412    HG2  GLN  56           HG2      GLN  56  -7.019   3.222  -6.447
  413    HG3  GLN  56           HG3      GLN  56  -5.687   4.374  -6.333
  414   HE21  GLN  56          HE21      GLN  56  -5.435   5.912  -7.986
  415   HE22  GLN  56          HE22      GLN  56  -6.685   6.258  -9.123
  416    H    ARG  57           H        ARG  57  -2.165   1.877  -7.436
  417    HA   ARG  57           HA       ARG  57  -1.902  -0.603  -8.753
  418    HB2  ARG  57           HB2      ARG  57   0.207   1.204  -7.495
  419    HB3  ARG  57           HB3      ARG  57   0.620  -0.226  -8.424
  420    HG2  ARG  57           HG2      ARG  57  -0.998   2.048  -9.601
  421    HG3  ARG  57           HG3      ARG  57   0.765   2.033  -9.616
  422    HD2  ARG  57           HD2      ARG  57  -0.007   1.231 -11.741
  423    HD3  ARG  57           HD3      ARG  57   0.683  -0.136 -10.871
  424    HE   ARG  57           HE       ARG  57  -2.234   0.349 -11.079
  425   HH11  ARG  57          HH11      ARG  57   0.415  -1.880 -11.120
  426   HH12  ARG  57          HH12      ARG  57  -0.579  -3.206 -11.602
  427   HH21  ARG  57          HH21      ARG  57  -3.476  -1.378 -11.646
  428   HH22  ARG  57          HH22      ARG  57  -2.753  -2.938 -11.846
  429    H    VAL  58           H        VAL  58  -1.124   0.375  -5.413
  430    HA   VAL  58           HA       VAL  58  -0.083  -2.086  -4.476
  431    HB   VAL  58           HB       VAL  58  -1.459   0.146  -2.904
  432   HG11  VAL  58          HG11      VAL  58  -0.320  -0.763  -0.902
  433   HG12  VAL  58          HG12      VAL  58   0.271  -2.127  -1.857
  434   HG13  VAL  58          HG13      VAL  58  -1.461  -1.918  -1.590
  435   HG21  VAL  58          HG21      VAL  58   1.514  -0.349  -3.368
  436   HG22  VAL  58          HG22      VAL  58   0.819   0.938  -2.376
  437   HG23  VAL  58          HG23      VAL  58   0.544   0.923  -4.115
  438    H    ILE  59           H        ILE  59  -3.400  -0.729  -4.298
  439    HA   ILE  59           HA       ILE  59  -4.735  -2.827  -2.999
  440    HB   ILE  59           HB       ILE  59  -5.749  -0.894  -5.135
  441   HG12  ILE  59          HG12      ILE  59  -6.102  -0.814  -2.097
  442   HG13  ILE  59          HG13      ILE  59  -4.937   0.147  -2.995
  443   HG21  ILE  59          HG21      ILE  59  -8.056  -1.433  -4.401
  444   HG22  ILE  59          HG22      ILE  59  -7.423  -2.696  -3.343
  445   HG23  ILE  59          HG23      ILE  59  -7.247  -2.838  -5.093
  446   HD11  ILE  59          HD11      ILE  59  -6.858   1.462  -2.373
  447   HD12  ILE  59          HD12      ILE  59  -7.939   0.346  -3.207
  448   HD13  ILE  59          HD13      ILE  59  -6.775   1.307  -4.128
  449    H    ASP  60           H        ASP  60  -4.189  -2.283  -6.474
  450    HA   ASP  60           HA       ASP  60  -5.539  -4.522  -7.517
  451    HB2  ASP  60           HB2      ASP  60  -4.789  -2.434  -8.758
  452    HB3  ASP  60           HB3      ASP  60  -3.149  -3.067  -8.734
  453    H    TYR  61           H        TYR  61  -2.194  -4.069  -6.466
  454    HA   TYR  61           HA       TYR  61  -1.065  -6.545  -7.197
  455    HB2  TYR  61           HB2      TYR  61   0.356  -4.675  -6.545
  456    HB3  TYR  61           HB3      TYR  61  -0.374  -4.603  -4.946
  457    HD1  TYR  61           HD1      TYR  61   1.833  -6.666  -7.143
  458    HD2  TYR  61           HD2      TYR  61   0.496  -5.982  -3.130
  459    HE1  TYR  61           HE1      TYR  61   3.583  -8.159  -6.302
  460    HE2  TYR  61           HE2      TYR  61   2.268  -7.476  -2.304
  461    HH   TYR  61           HH       TYR  61   4.852  -8.488  -4.203
  462    H    ILE  62           H        ILE  62  -2.668  -5.517  -4.165
  463    HA   ILE  62           HA       ILE  62  -2.359  -8.006  -2.795
  464    HB   ILE  62           HB       ILE  62  -4.441  -5.831  -2.245
  465   HG12  ILE  62          HG12      ILE  62  -1.679  -6.185  -0.952
  466   HG13  ILE  62          HG13      ILE  62  -2.057  -4.980  -2.174
  467   HG21  ILE  62          HG21      ILE  62  -3.390  -8.040  -0.418
  468   HG22  ILE  62          HG22      ILE  62  -4.998  -7.979  -1.143
  469   HG23  ILE  62          HG23      ILE  62  -4.530  -6.773   0.052
  470   HD11  ILE  62          HD11      ILE  62  -3.642  -3.916  -0.634
  471   HD12  ILE  62          HD12      ILE  62  -2.016  -4.003   0.042
  472   HD13  ILE  62          HD13      ILE  62  -3.258  -5.127   0.592
  473    H    LEU  63           H        LEU  63  -4.949  -6.686  -4.870
  474    HA   LEU  63           HA       LEU  63  -6.849  -8.781  -4.568
  475    HB2  LEU  63           HB2      LEU  63  -6.380  -6.893  -6.909
  476    HB3  LEU  63           HB3      LEU  63  -7.780  -7.942  -6.752
  477    HG   LEU  63           HG       LEU  63  -7.082  -5.640  -4.886
  478   HD11  LEU  63          HD11      LEU  63  -9.046  -4.511  -5.845
  479   HD12  LEU  63          HD12      LEU  63  -9.282  -5.857  -6.963
  480   HD13  LEU  63          HD13      LEU  63  -7.834  -4.855  -7.079
  481   HD21  LEU  63          HD21      LEU  63  -9.504  -7.479  -4.842
  482   HD22  LEU  63          HD22      LEU  63  -9.290  -6.041  -3.842
  483   HD23  LEU  63          HD23      LEU  63  -8.213  -7.420  -3.637
  484    H    ASP  64           H        ASP  64  -4.018  -8.432  -6.626
  485    HA   ASP  64           HA       ASP  64  -4.346 -10.745  -8.258
  486    HB2  ASP  64           HB2      ASP  64  -2.815  -8.897  -8.824
  487    HB3  ASP  64           HB3      ASP  64  -1.843  -9.224  -7.399
  488    H    LEU  65           H        LEU  65  -2.974 -10.237  -5.035
  489    HA   LEU  65           HA       LEU  65  -1.949 -12.901  -4.628
  490    HB2  LEU  65           HB2      LEU  65  -2.697 -10.747  -2.602
  491    HB3  LEU  65           HB3      LEU  65  -1.782 -12.203  -2.234
  492    HG   LEU  65           HG       LEU  65  -0.844  -9.983  -4.095
  493   HD11  LEU  65          HD11      LEU  65   0.039 -10.608  -1.261
  494   HD12  LEU  65          HD12      LEU  65  -0.886  -9.197  -1.782
  495   HD13  LEU  65          HD13      LEU  65   0.775  -9.408  -2.329
  496   HD21  LEU  65          HD21      LEU  65   0.649 -12.438  -3.107
  497   HD22  LEU  65          HD22      LEU  65   1.328 -11.139  -4.090
  498   HD23  LEU  65          HD23      LEU  65   0.060 -12.168  -4.751
  499    H    GLN  66           H        GLN  66  -4.966 -11.249  -3.847
  500    HA   GLN  66           HA       GLN  66  -6.083 -13.334  -2.203
  501    HB2  GLN  66           HB2      GLN  66  -7.422 -10.870  -3.405
  502    HB3  GLN  66           HB3      GLN  66  -8.155 -11.924  -2.204
  503    HG2  GLN  66           HG2      GLN  66  -5.672 -10.233  -1.779
  504    HG3  GLN  66           HG3      GLN  66  -7.292  -9.816  -1.235
  505   HE21  GLN  66          HE21      GLN  66  -8.180 -10.966   0.527
  506   HE22  GLN  66          HE22      GLN  66  -7.195 -11.891   1.598
  507    H    VAL  67           H        VAL  67  -7.315 -11.921  -5.266
  508    HA   VAL  67           HA       VAL  67  -8.986 -14.237  -5.800
  509    HB   VAL  67           HB       VAL  67  -8.579 -11.735  -7.508
  510   HG11  VAL  67          HG11      VAL  67  -9.535 -13.585  -8.809
  511   HG12  VAL  67          HG12      VAL  67 -10.750 -12.334  -8.560
  512   HG13  VAL  67          HG13      VAL  67 -10.803 -13.817  -7.603
  513   HG21  VAL  67          HG21      VAL  67 -10.675 -10.882  -6.489
  514   HG22  VAL  67          HG22      VAL  67  -9.414 -11.115  -5.279
  515   HG23  VAL  67          HG23      VAL  67 -10.726 -12.285  -5.416
  516    H    VAL  68           H        VAL  68  -8.251 -15.984  -6.868
  517    HA   VAL  68           HA       VAL  68  -6.097 -15.738  -8.901
  518    HB   VAL  68           HB       VAL  68  -7.110 -18.264  -7.497
  519   HG11  VAL  68          HG11      VAL  68  -5.097 -19.359  -8.444
  520   HG12  VAL  68          HG12      VAL  68  -4.696 -17.874  -9.312
  521   HG13  VAL  68          HG13      VAL  68  -6.171 -18.756  -9.708
  522   HG21  VAL  68          HG21      VAL  68  -5.990 -16.765  -5.887
  523   HG22  VAL  68          HG22      VAL  68  -4.574 -16.660  -6.935
  524   HG23  VAL  68          HG23      VAL  68  -5.007 -18.200  -6.188
  525    H1   MET   1           H1       MET   1   9.454   2.127  28.400
  526    H2   MET   1           H2       MET   1  10.452   3.413  28.839
  527    H3   MET   1           H3       MET   1   9.729   3.388  27.313
  528    HA   MET   1           HA       MET   1   7.550   3.564  28.290
  529    HB2  MET   1           HB2      MET   1   9.109   3.738  30.907
  530    HB3  MET   1           HB3      MET   1   7.391   4.092  30.759
  531    HG2  MET   1           HG2      MET   1   6.963   1.763  30.081
  532    HG3  MET   1           HG3      MET   1   8.685   1.402  30.215
  533    HE1  MET   1           HE1      MET   1   6.332  -0.258  31.732
  534    HE2  MET   1           HE2      MET   1   7.108  -0.491  33.296
  535    HE3  MET   1           HE3      MET   1   8.051  -0.664  31.818
  536    H    GLY   2           H        GLY   2   6.710   5.604  28.054
  537    HA2  GLY   2           HA2      GLY   2   6.551   7.924  28.082
  538    HA3  GLY   2           HA3      GLY   2   8.140   8.021  28.824
  539    H    HIS   3           H        HIS   3   8.434   9.839  27.321
  540    HA   HIS   3           HA       HIS   3   9.897   9.061  24.954
  541    HB2  HIS   3           HB2      HIS   3   7.586   9.213  24.029
  542    HB3  HIS   3           HB3      HIS   3   7.446  10.856  24.644
  543    HD2  HIS   3           HD2      HIS   3   9.198   8.900  21.738
  544    HE1  HIS   3           HE1      HIS   3   9.647  13.055  21.073
  545    HE2  HIS   3           HE2      HIS   3  10.232  10.743  20.235
  546    H    HIS   4           H        HIS   4  11.726  10.243  25.137
  547    HA   HIS   4           HA       HIS   4  11.813  12.788  26.561
  548    HB2  HIS   4           HB2      HIS   4  13.596  10.970  26.781
  549    HB3  HIS   4           HB3      HIS   4  14.107  11.357  25.140
  550    HD2  HIS   4           HD2      HIS   4  15.939  11.815  27.960
  551    HE1  HIS   4           HE1      HIS   4  15.530  15.879  26.863
  552    HE2  HIS   4           HE2      HIS   4  16.625  14.262  28.465
  553    H    HIS   5           H        HIS   5  11.265  14.609  25.478
  554    HA   HIS   5           HA       HIS   5  11.534  14.814  22.557
  555    HB2  HIS   5           HB2      HIS   5   9.385  15.484  23.645
  556    HB3  HIS   5           HB3      HIS   5  10.233  16.744  24.538
  557    HD2  HIS   5           HD2      HIS   5   8.819  16.046  20.985
  558    HE1  HIS   5           HE1      HIS   5  10.443  19.953  21.023
  559    HE2  HIS   5           HE2      HIS   5   8.932  18.339  19.795
  560    H    HIS   6           H        HIS   6  12.959  16.154  21.529
  561    HA   HIS   6           HA       HIS   6  14.643  18.046  23.091
  562    HB2  HIS   6           HB2      HIS   6  15.494  16.226  20.797
  563    HB3  HIS   6           HB3      HIS   6  16.483  17.555  21.399
  564    HD2  HIS   6           HD2      HIS   6  15.163  14.060  22.669
  565    HE1  HIS   6           HE1      HIS   6  18.511  15.273  24.949
  566    HE2  HIS   6           HE2      HIS   6  16.721  13.511  24.662
  567    H    HIS   7           H        HIS   7  14.062  20.061  22.547
  568    HA   HIS   7           HA       HIS   7  13.212  20.817  19.851
  569    HB2  HIS   7           HB2      HIS   7  12.128  21.787  21.920
  570    HB3  HIS   7           HB3      HIS   7  13.653  22.576  22.310
  571    HD2  HIS   7           HD2      HIS   7  10.671  22.920  19.807
  572    HE1  HIS   7           HE1      HIS   7  13.219  26.263  19.365
  573    HE2  HIS   7           HE2      HIS   7  10.931  25.318  18.870
  574    H    HIS   8           H        HIS   8  14.390  22.490  18.621
  575    HA   HIS   8           HA       HIS   8  17.247  22.808  19.227
  576    HB2  HIS   8           HB2      HIS   8  17.972  21.842  17.072
  577    HB3  HIS   8           HB3      HIS   8  17.133  20.641  18.047
  578    HD2  HIS   8           HD2      HIS   8  14.499  19.973  17.097
  579    HE1  HIS   8           HE1      HIS   8  15.250  21.556  13.248
  580    HE2  HIS   8           HE2      HIS   8  13.826  19.964  14.596
  581    H    SER   9           H        SER   9  18.375  24.116  17.577
  582    HA   SER   9           HA       SER   9  16.691  26.218  16.324
  583    HB2  SER   9           HB2      SER   9  17.915  27.004  18.377
  584    HB3  SER   9           HB3      SER   9  19.441  26.551  17.618
  585    HG   SER   9           HG       SER   9  19.413  28.415  16.664
  586    H    HIS  10           H        HIS  10  17.527  23.818  15.000
  587    HA   HIS  10           HA       HIS  10  19.842  24.442  13.323
  588    HB2  HIS  10           HB2      HIS  10  17.935  22.069  13.257
  589    HB3  HIS  10           HB3      HIS  10  19.373  22.227  12.248
  590    HD1  HIS  10           HD1      HIS  10  18.448  20.368  14.990
  591    HD2  HIS  10           HD2      HIS  10  21.683  22.885  14.310
  592    HE1  HIS  10           HE1      HIS  10  20.232  19.629  16.584
  593    HE2  HIS  10           HE2      HIS  10  22.216  21.069  16.058
  594    H    MET  11           H        MET  11  19.795  24.620  11.047
  595    HA   MET  11           HA       MET  11  17.212  25.224   9.738
  596    HB2  MET  11           HB2      MET  11  18.213  27.153   8.576
  597    HB3  MET  11           HB3      MET  11  18.276  27.375  10.317
  598    HG2  MET  11           HG2      MET  11  20.607  26.532   8.579
  599    HG3  MET  11           HG3      MET  11  20.320  28.163   9.180
  600    HE1  MET  11           HE1      MET  11  23.102  26.604   9.588
  601    HE2  MET  11           HE2      MET  11  23.449  26.977  11.275
  602    HE3  MET  11           HE3      MET  11  22.811  28.231  10.217
  603    H    GLY  12           H        GLY  12  17.123  24.725   7.493
  604    HA2  GLY  12           HA2      GLY  12  17.607  23.587   5.547
  605    HA3  GLY  12           HA3      GLY  12  19.295  23.533   6.027
  606    H    GLY  13           H        GLY  13  16.226  22.146   7.296
  607    HA2  GLY  13           HA2      GLY  13  17.552  19.490   7.610
  608    HA3  GLY  13           HA3      GLY  13  16.226  20.083   8.591
  609    H    GLY  14           H        GLY  14  15.670  20.841   5.357
  610    HA2  GLY  14           HA2      GLY  14  14.716  18.476   4.181
  611    HA3  GLY  14           HA3      GLY  14  13.386  19.172   5.102
  612    H    LYS  15           H        LYS  15  13.311  18.830   2.306
  613    HA   LYS  15           HA       LYS  15  13.846  21.301   0.921
  614    HB2  LYS  15           HB2      LYS  15  12.520  20.276  -0.952
  615    HB3  LYS  15           HB3      LYS  15  13.847  19.273  -0.385
  616    HG2  LYS  15           HG2      LYS  15  12.450  17.643   0.506
  617    HG3  LYS  15           HG3      LYS  15  11.115  18.763   0.775
  618    HD2  LYS  15           HD2      LYS  15  12.016  17.791  -1.970
  619    HD3  LYS  15           HD3      LYS  15  10.682  17.090  -1.048
  620    HE2  LYS  15           HE2      LYS  15   9.528  19.292  -1.079
  621    HE3  LYS  15           HE3      LYS  15  10.836  19.952  -2.064
  622    HZ1  LYS  15           HZ1      LYS  15  10.287  18.367  -3.790
  623    HZ2  LYS  15           HZ2      LYS  15   8.931  19.297  -3.396
  624    HZ3  LYS  15           HZ3      LYS  15   9.058  17.705  -2.840
  625    H    GLY  16           H        GLY  16  10.973  19.882   2.435
  626    HA2  GLY  16           HA2      GLY  16   9.454  21.754   3.358
  627    HA3  GLY  16           HA3      GLY  16   9.285  22.194   1.664
  628    HA   PRO  17           HA       PRO  17   5.965  19.044   2.646
  629    HB2  PRO  17           HB2      PRO  17   3.756  20.514   2.118
  630    HB3  PRO  17           HB3      PRO  17   4.644  20.692   3.636
  631    HG2  PRO  17           HG2      PRO  17   4.697  22.446   1.193
  632    HG3  PRO  17           HG3      PRO  17   4.688  22.909   2.908
  633    HD2  PRO  17           HD2      PRO  17   6.976  22.783   1.305
  634    HD3  PRO  17           HD3      PRO  17   6.985  22.724   3.080
  635    H    ALA  18           H        ALA  18   6.323  17.609   0.945
  636    HA   ALA  18           HA       ALA  18   5.687  18.216  -1.821
  637    HB1  ALA  18           HB1      ALA  18   7.387  16.521  -1.258
  638    HB2  ALA  18           HB2      ALA  18   6.096  15.820  -2.236
  639    HB3  ALA  18           HB3      ALA  18   6.151  15.516  -0.497
  640    H    ALA  19           H        ALA  19   3.804  17.302   0.919
  641    HA   ALA  19           HA       ALA  19   1.535  16.193  -0.541
  642    HB1  ALA  19           HB1      ALA  19   0.445  16.086   1.662
  643    HB2  ALA  19           HB2      ALA  19   1.770  17.006   2.379
  644    HB3  ALA  19           HB3      ALA  19   2.067  15.394   1.731
  645    H    GLU  20           H        GLU  20  -0.617  17.170  -0.461
  646    HA   GLU  20           HA       GLU  20  -0.832  20.078  -0.112
  647    HB2  GLU  20           HB2      GLU  20  -1.689  20.464  -2.385
  648    HB3  GLU  20           HB3      GLU  20  -0.066  19.787  -2.459
  649    HG2  GLU  20           HG2      GLU  20  -1.033  17.549  -2.953
  650    HG3  GLU  20           HG3      GLU  20  -2.648  18.260  -2.933
  651    H    GLU  21           H        GLU  21  -3.329  20.581  -1.111
  652    HA   GLU  21           HA       GLU  21  -5.146  18.720   0.339
  653    HB2  GLU  21           HB2      GLU  21  -6.265  20.629   1.402
  654    HB3  GLU  21           HB3      GLU  21  -4.547  20.655   1.790
  655    HG2  GLU  21           HG2      GLU  21  -4.212  22.378  -0.006
  656    HG3  GLU  21           HG3      GLU  21  -5.956  22.414  -0.252
  657    HA   PRO  22           HA       PRO  22  -7.973  19.499  -3.201
  658    HB2  PRO  22           HB2      PRO  22 -10.351  18.693  -2.150
  659    HB3  PRO  22           HB3      PRO  22  -9.069  17.539  -2.543
  660    HG2  PRO  22           HG2      PRO  22  -9.766  18.750   0.136
  661    HG3  PRO  22           HG3      PRO  22  -9.454  17.046  -0.274
  662    HD2  PRO  22           HD2      PRO  22  -7.541  18.653   0.825
  663    HD3  PRO  22           HD3      PRO  22  -7.138  17.345  -0.311
  664    H    LEU  23           H        LEU  23 -10.329  20.575  -3.466
  665    HA   LEU  23           HA       LEU  23 -10.163  23.310  -2.820
  666    HB2  LEU  23           HB2      LEU  23 -12.590  21.693  -3.675
  667    HB3  LEU  23           HB3      LEU  23 -12.521  23.448  -3.663
  668    HG   LEU  23           HG       LEU  23 -10.878  21.602  -5.443
  669   HD11  LEU  23          HD11      LEU  23 -13.221  21.765  -6.149
  670   HD12  LEU  23          HD12      LEU  23 -12.160  22.566  -7.303
  671   HD13  LEU  23          HD13      LEU  23 -13.110  23.528  -6.168
  672   HD21  LEU  23          HD21      LEU  23 -10.838  24.638  -5.304
  673   HD22  LEU  23          HD22      LEU  23 -10.031  23.660  -6.531
  674   HD23  LEU  23          HD23      LEU  23  -9.525  23.548  -4.849
  675    H    SER  24           H        SER  24 -12.184  20.760  -1.329
  676    HA   SER  24           HA       SER  24 -12.210  22.256   1.199
  677    HB2  SER  24           HB2      SER  24 -14.801  21.186  -0.023
  678    HB3  SER  24           HB3      SER  24 -14.638  21.944   1.559
  679    HG   SER  24           HG       SER  24 -14.613  23.843   0.644
  680    H    LEU  25           H        LEU  25 -14.238  19.443   0.435
  681    HA   LEU  25           HA       LEU  25 -12.347  17.598   1.736
  682    HB2  LEU  25           HB2      LEU  25 -15.274  17.965   2.496
  683    HB3  LEU  25           HB3      LEU  25 -14.380  16.510   2.899
  684    HG   LEU  25           HG       LEU  25 -13.734  19.313   3.899
  685   HD11  LEU  25          HD11      LEU  25 -14.927  16.960   5.396
  686   HD12  LEU  25          HD12      LEU  25 -15.772  18.437   4.930
  687   HD13  LEU  25          HD13      LEU  25 -14.462  18.510   6.105
  688   HD21  LEU  25          HD21      LEU  25 -12.384  16.670   4.587
  689   HD22  LEU  25          HD22      LEU  25 -12.070  18.216   5.378
  690   HD23  LEU  25          HD23      LEU  25 -11.669  18.005   3.677
  691    H    LEU  26           H        LEU  26 -12.160  15.742   0.735
  692    HA   LEU  26           HA       LEU  26 -14.213  14.252  -0.554
  693    HB2  LEU  26           HB2      LEU  26 -13.616  16.028  -2.359
  694    HB3  LEU  26           HB3      LEU  26 -12.053  15.256  -2.483
  695    HG   LEU  26           HG       LEU  26 -14.692  13.834  -3.068
  696   HD11  LEU  26          HD11      LEU  26 -14.425  15.675  -4.645
  697   HD12  LEU  26          HD12      LEU  26 -14.219  14.129  -5.463
  698   HD13  LEU  26          HD13      LEU  26 -12.805  15.112  -5.072
  699   HD21  LEU  26          HD21      LEU  26 -12.910  12.230  -2.562
  700   HD22  LEU  26          HD22      LEU  26 -11.853  12.982  -3.759
  701   HD23  LEU  26          HD23      LEU  26 -13.327  12.153  -4.272
  702    H    ASP  27           H        ASP  27 -10.737  14.891  -0.846
  703    HA   ASP  27           HA       ASP  27  -8.856  13.744  -0.474
  704    HB2  ASP  27           HB2      ASP  27 -10.579  12.555   1.735
  705    HB3  ASP  27           HB3      ASP  27  -8.833  12.329   1.626
  706    H    ASP  28           H        ASP  28  -9.275  12.834  -2.598
  707    HA   ASP  28           HA       ASP  28 -10.158  10.216  -3.104
  708    HB2  ASP  28           HB2      ASP  28  -9.808  12.001  -4.817
  709    HB3  ASP  28           HB3      ASP  28  -8.064  11.863  -4.598
  710    H    MET  29           H        MET  29  -7.097  11.449  -1.915
  711    HA   MET  29           HA       MET  29  -5.478   9.141  -2.005
  712    HB2  MET  29           HB2      MET  29  -5.530  11.346   0.106
  713    HB3  MET  29           HB3      MET  29  -4.212  10.216  -0.144
  714    HG2  MET  29           HG2      MET  29  -4.711  11.571  -2.643
  715    HG3  MET  29           HG3      MET  29  -4.600  12.775  -1.367
  716    HE1  MET  29           HE1      MET  29  -2.843   9.662  -2.992
  717    HE2  MET  29           HE2      MET  29  -2.732   9.292  -1.268
  718    HE3  MET  29           HE3      MET  29  -1.277   9.682  -2.183
  719    H    ASN  30           H        ASN  30  -7.547  10.407   0.648
  720    HA   ASN  30           HA       ASN  30  -7.168   8.256   2.453
  721    HB2  ASN  30           HB2      ASN  30  -7.840  10.482   3.235
  722    HB3  ASN  30           HB3      ASN  30  -9.364  10.364   2.366
  723   HD21  ASN  30          HD21      ASN  30  -7.510   8.990   5.028
  724   HD22  ASN  30          HD22      ASN  30  -8.870   8.374   5.894
  725    H    HIS  31           H        HIS  31  -9.476   8.743  -0.141
  726    HA   HIS  31           HA       HIS  31 -11.394   6.777   0.280
  727    HB2  HIS  31           HB2      HIS  31 -11.438   8.392  -1.604
  728    HB3  HIS  31           HB3      HIS  31 -10.047   7.605  -2.337
  729    HD2  HIS  31           HD2      HIS  31 -13.811   7.522  -2.558
  730    HE1  HIS  31           HE1      HIS  31 -12.456   3.843  -4.143
  731    HE2  HIS  31           HE2      HIS  31 -14.481   5.270  -3.660
  732    H    CYS  32           H        CYS  32  -8.297   6.425  -1.474
  733    HA   CYS  32           HA       CYS  32  -8.431   3.568  -1.706
  734    HB2  CYS  32           HB2      CYS  32  -6.131   5.493  -2.190
  735    HB3  CYS  32           HB3      CYS  32  -6.144   3.787  -2.656
  736    HG   CYS  32           HG       CYS  32  -8.821   5.363  -3.798
  737    H    TYR  33           H        TYR  33  -6.884   5.778   0.582
  738    HA   TYR  33           HA       TYR  33  -5.198   3.988   1.958
  739    HB2  TYR  33           HB2      TYR  33  -6.497   6.607   2.686
  740    HB3  TYR  33           HB3      TYR  33  -5.726   5.681   3.966
  741    HD1  TYR  33           HD1      TYR  33  -3.334   4.625   2.938
  742    HD2  TYR  33           HD2      TYR  33  -5.076   8.406   2.015
  743    HE1  TYR  33           HE1      TYR  33  -1.125   5.522   2.463
  744    HE2  TYR  33           HE2      TYR  33  -2.849   9.310   1.507
  745    HH   TYR  33           HH       TYR  33  -0.129   7.407   1.091
  746    H    SER  34           H        SER  34  -8.622   4.789   2.534
  747    HA   SER  34           HA       SER  34  -9.060   3.162   4.803
  748    HB2  SER  34           HB2      SER  34 -10.702   4.873   4.101
  749    HB3  SER  34           HB3      SER  34 -11.032   3.978   2.624
  750    HG   SER  34           HG       SER  34 -11.364   2.398   4.820
  751    H    ARG  35           H        ARG  35  -9.442   2.521   1.316
  752    HA   ARG  35           HA       ARG  35 -10.371  -0.140   1.458
  753    HB2  ARG  35           HB2      ARG  35 -10.246   1.671  -0.510
  754    HB3  ARG  35           HB3      ARG  35  -8.752   0.843  -0.908
  755    HG2  ARG  35           HG2      ARG  35 -11.387  -0.615  -0.635
  756    HG3  ARG  35           HG3      ARG  35 -10.888   0.143  -2.145
  757    HD2  ARG  35           HD2      ARG  35  -8.733  -1.329  -1.876
  758    HD3  ARG  35           HD3      ARG  35  -9.722  -2.273  -0.756
  759    HE   ARG  35           HE       ARG  35 -10.513  -1.756  -3.565
  760   HH11  ARG  35          HH11      ARG  35 -10.254  -3.987  -0.955
  761   HH12  ARG  35          HH12      ARG  35 -10.820  -5.308  -1.912
  762   HH21  ARG  35          HH21      ARG  35 -11.223  -3.445  -4.741
  763   HH22  ARG  35          HH22      ARG  35 -11.368  -5.007  -4.014
  764    H    LEU  36           H        LEU  36  -7.060   1.165   1.469
  765    HA   LEU  36           HA       LEU  36  -5.630  -1.276   1.321
  766    HB2  LEU  36           HB2      LEU  36  -4.936   1.345   2.704
  767    HB3  LEU  36           HB3      LEU  36  -3.824  -0.011   2.624
  768    HG   LEU  36           HG       LEU  36  -4.889   1.549   0.239
  769   HD11  LEU  36          HD11      LEU  36  -2.115   1.518   1.454
  770   HD12  LEU  36          HD12      LEU  36  -3.267   2.854   1.502
  771   HD13  LEU  36          HD13      LEU  36  -2.580   2.345  -0.038
  772   HD21  LEU  36          HD21      LEU  36  -3.330   0.224  -1.131
  773   HD22  LEU  36          HD22      LEU  36  -4.538  -0.806  -0.374
  774   HD23  LEU  36          HD23      LEU  36  -2.898  -0.750   0.278
  775    H    ARG  37           H        ARG  37  -6.808   0.582   4.155
  776    HA   ARG  37           HA       ARG  37  -6.002  -1.096   6.229
  777    HB2  ARG  37           HB2      ARG  37  -8.519   0.596   6.115
  778    HB3  ARG  37           HB3      ARG  37  -7.835  -0.100   7.580
  779    HG2  ARG  37           HG2      ARG  37  -5.782   1.301   7.241
  780    HG3  ARG  37           HG3      ARG  37  -6.553   2.031   5.829
  781    HD2  ARG  37           HD2      ARG  37  -8.432   2.767   7.308
  782    HD3  ARG  37           HD3      ARG  37  -7.536   2.165   8.698
  783    HE   ARG  37           HE       ARG  37  -6.649   4.394   6.967
  784   HH11  ARG  37          HH11      ARG  37  -6.760   2.921  10.100
  785   HH12  ARG  37          HH12      ARG  37  -6.067   4.298  10.881
  786   HH21  ARG  37          HH21      ARG  37  -5.797   6.158   8.015
  787   HH22  ARG  37          HH22      ARG  37  -5.534   6.098   9.721
  788    H    GLU  38           H        GLU  38  -8.635  -1.557   3.967
  789    HA   GLU  38           HA       GLU  38 -10.119  -3.480   5.540
  790    HB2  GLU  38           HB2      GLU  38 -10.288  -3.091   2.519
  791    HB3  GLU  38           HB3      GLU  38 -11.510  -3.783   3.574
  792    HG2  GLU  38           HG2      GLU  38 -10.687  -0.885   3.346
  793    HG3  GLU  38           HG3      GLU  38 -12.230  -1.601   2.898
  794    H    LEU  39           H        LEU  39  -7.651  -3.582   3.020
  795    HA   LEU  39           HA       LEU  39  -7.758  -6.479   2.663
  796    HB2  LEU  39           HB2      LEU  39  -6.022  -4.344   1.373
  797    HB3  LEU  39           HB3      LEU  39  -5.963  -6.046   0.949
  798    HG   LEU  39           HG       LEU  39  -8.375  -4.223   0.568
  799   HD11  LEU  39          HD11      LEU  39  -6.572  -3.685  -1.002
  800   HD12  LEU  39          HD12      LEU  39  -7.933  -4.425  -1.841
  801   HD13  LEU  39          HD13      LEU  39  -6.483  -5.377  -1.504
  802   HD21  LEU  39          HD21      LEU  39  -8.027  -7.143  -0.232
  803   HD22  LEU  39          HD22      LEU  39  -9.396  -6.114  -0.659
  804   HD23  LEU  39          HD23      LEU  39  -9.106  -6.528   1.027
  805    H    VAL  40           H        VAL  40  -5.978  -4.304   4.652
  806    HA   VAL  40           HA       VAL  40  -3.659  -6.098   4.953
  807    HB   VAL  40           HB       VAL  40  -4.145  -3.365   6.244
  808   HG11  VAL  40          HG11      VAL  40  -2.586  -4.722   7.591
  809   HG12  VAL  40          HG12      VAL  40  -1.726  -3.397   6.810
  810   HG13  VAL  40          HG13      VAL  40  -1.590  -5.035   6.165
  811   HG21  VAL  40          HG21      VAL  40  -2.424  -4.094   3.836
  812   HG22  VAL  40          HG22      VAL  40  -2.516  -2.500   4.591
  813   HG23  VAL  40          HG23      VAL  40  -3.940  -3.182   3.806
  814    HA   PRO  41           HA       PRO  41  -5.727  -7.702   8.765
  815    HB2  PRO  41           HB2      PRO  41  -4.037 -10.085   8.501
  816    HB3  PRO  41           HB3      PRO  41  -5.786  -9.953   8.309
  817    HG2  PRO  41           HG2      PRO  41  -4.086 -10.478   6.216
  818    HG3  PRO  41           HG3      PRO  41  -5.648  -9.655   6.020
  819    HD2  PRO  41           HD2      PRO  41  -2.882  -8.443   6.218
  820    HD3  PRO  41           HD3      PRO  41  -4.194  -8.068   5.073
  821    H    GLY  42           H        GLY  42  -2.744  -6.442   8.212
  822    HA2  GLY  42           HA2      GLY  42  -1.404  -7.230  10.696
  823    HA3  GLY  42           HA3      GLY  42  -0.789  -6.148   9.458
  824    H    VAL  43           H        VAL  43  -3.965  -5.830  10.984
  825    HA   VAL  43           HA       VAL  43  -3.132  -3.268  12.220
  826    HB   VAL  43           HB       VAL  43  -5.968  -4.188  11.521
  827   HG11  VAL  43          HG11      VAL  43  -5.962  -2.611  13.401
  828   HG12  VAL  43          HG12      VAL  43  -6.610  -1.821  11.965
  829   HG13  VAL  43          HG13      VAL  43  -4.959  -1.476  12.492
  830   HG21  VAL  43          HG21      VAL  43  -4.159  -2.218  10.052
  831   HG22  VAL  43          HG22      VAL  43  -5.856  -2.531   9.666
  832   HG23  VAL  43          HG23      VAL  43  -4.657  -3.811   9.477
  833    HA   PRO  44           HA       PRO  44  -3.524  -5.921  15.989
  834    HB2  PRO  44           HB2      PRO  44  -2.226  -3.593  17.334
  835    HB3  PRO  44           HB3      PRO  44  -1.701  -5.280  17.267
  836    HG2  PRO  44           HG2      PRO  44  -0.409  -3.371  15.881
  837    HG3  PRO  44           HG3      PRO  44  -0.629  -4.999  15.197
  838    HD2  PRO  44           HD2      PRO  44  -2.219  -2.479  14.641
  839    HD3  PRO  44           HD3      PRO  44  -1.565  -3.663  13.486
  840    H    ARG  45           H        ARG  45  -4.751  -5.770  17.965
  841    HA   ARG  45           HA       ARG  45  -7.251  -4.582  17.614
  842    HB2  ARG  45           HB2      ARG  45  -5.994  -5.946  20.013
  843    HB3  ARG  45           HB3      ARG  45  -7.663  -5.389  20.034
  844    HG2  ARG  45           HG2      ARG  45  -6.513  -7.419  18.084
  845    HG3  ARG  45           HG3      ARG  45  -7.501  -7.797  19.500
  846    HD2  ARG  45           HD2      ARG  45  -9.362  -6.449  18.503
  847    HD3  ARG  45           HD3      ARG  45  -8.369  -6.191  17.069
  848    HE   ARG  45           HE       ARG  45  -8.387  -8.717  16.884
  849   HH11  ARG  45          HH11      ARG  45 -11.039  -6.992  18.283
  850   HH12  ARG  45          HH12      ARG  45 -12.194  -8.185  17.806
  851   HH21  ARG  45          HH21      ARG  45  -9.899 -10.224  16.291
  852   HH22  ARG  45          HH22      ARG  45 -11.558  -9.985  16.717
  853    H    GLY  46           H        GLY  46  -7.428  -2.420  17.514
  854    HA2  GLY  46           HA2      GLY  46  -8.155  -0.480  18.645
  855    HA3  GLY  46           HA3      GLY  46  -7.160  -0.899  20.028
  856    H    THR  47           H        THR  47  -5.099  -1.346  17.507
  857    HA   THR  47           HA       THR  47  -3.639   1.062  17.972
  858    HB   THR  47           HB       THR  47  -3.183  -1.014  15.778
  859    HG1  THR  47           HG1      THR  47  -1.770  -0.795  18.231
  860   HG21  THR  47          HG21      THR  47  -0.849  -0.185  15.738
  861   HG22  THR  47          HG22      THR  47  -1.267   1.068  16.909
  862   HG23  THR  47          HG23      THR  47  -1.976   1.096  15.293
  863    H    GLN  48           H        GLN  48  -4.570   2.910  17.330
  864    HA   GLN  48           HA       GLN  48  -6.028   3.289  14.874
  865    HB2  GLN  48           HB2      GLN  48  -6.538   4.569  16.929
  866    HB3  GLN  48           HB3      GLN  48  -4.945   5.309  16.887
  867    HG2  GLN  48           HG2      GLN  48  -5.594   6.325  14.642
  868    HG3  GLN  48           HG3      GLN  48  -7.235   5.748  14.944
  869   HE21  GLN  48          HE21      GLN  48  -5.025   7.073  17.390
  870   HE22  GLN  48          HE22      GLN  48  -5.953   8.494  17.717
  871    H    LEU  49           H        LEU  49  -4.723   2.846  13.138
  872    HA   LEU  49           HA       LEU  49  -2.082   3.878  12.732
  873    HB2  LEU  49           HB2      LEU  49  -4.065   2.770  10.705
  874    HB3  LEU  49           HB3      LEU  49  -2.347   3.018  10.420
  875    HG   LEU  49           HG       LEU  49  -3.528   1.049  12.425
  876   HD11  LEU  49          HD11      LEU  49  -2.749  -0.720  10.915
  877   HD12  LEU  49          HD12      LEU  49  -2.206   0.491   9.750
  878   HD13  LEU  49          HD13      LEU  49  -3.925   0.323  10.115
  879   HD21  LEU  49          HD21      LEU  49  -1.225   0.209  12.703
  880   HD22  LEU  49          HD22      LEU  49  -1.351   1.894  13.195
  881   HD23  LEU  49          HD23      LEU  49  -0.620   1.485  11.641
  882    H    SER  50           H        SER  50  -1.444   5.818  11.904
  883    HA   SER  50           HA       SER  50  -3.380   7.733  10.809
  884    HB2  SER  50           HB2      SER  50  -1.616   9.382  10.977
  885    HB3  SER  50           HB3      SER  50  -1.567   8.425  12.455
  886    HG   SER  50           HG       SER  50   0.347   8.782  10.575
  887    H    GLN  51           H        GLN  51  -1.939   9.106   8.901
  888    HA   GLN  51           HA       GLN  51  -2.614   7.546   6.637
  889    HB2  GLN  51           HB2      GLN  51  -2.901  10.019   6.842
  890    HB3  GLN  51           HB3      GLN  51  -1.151  10.214   6.746
  891    HG2  GLN  51           HG2      GLN  51  -1.137   9.320   4.482
  892    HG3  GLN  51           HG3      GLN  51  -2.861   8.975   4.569
  893   HE21  GLN  51          HE21      GLN  51  -1.409  10.628   2.663
  894   HE22  GLN  51          HE22      GLN  51  -2.121  12.198   2.748
  895    H    VAL  52           H        VAL  52   0.602   8.614   7.858
  896    HA   VAL  52           HA       VAL  52   2.139   7.285   5.833
  897    HB   VAL  52           HB       VAL  52   3.122   8.036   8.636
  898   HG11  VAL  52          HG11      VAL  52   4.660   7.651   6.035
  899   HG12  VAL  52          HG12      VAL  52   4.658   6.541   7.408
  900   HG13  VAL  52          HG13      VAL  52   5.360   8.149   7.583
  901   HG21  VAL  52          HG21      VAL  52   3.872  10.178   7.676
  902   HG22  VAL  52          HG22      VAL  52   2.123  10.008   7.546
  903   HG23  VAL  52          HG23      VAL  52   3.138   9.757   6.125
  904    H    GLU  53           H        GLU  53   0.992   6.326   9.060
  905    HA   GLU  53           HA       GLU  53   2.409   3.960   9.491
  906    HB2  GLU  53           HB2      GLU  53  -0.428   4.666  10.351
  907    HB3  GLU  53           HB3      GLU  53   0.459   3.275  10.964
  908    HG2  GLU  53           HG2      GLU  53   1.283   6.170  11.314
  909    HG3  GLU  53           HG3      GLU  53   0.455   5.189  12.521
  910    H    ILE  54           H        ILE  54  -0.584   4.474   7.661
  911    HA   ILE  54           HA       ILE  54  -1.364   1.869   7.057
  912    HB   ILE  54           HB       ILE  54  -1.517   4.373   5.320
  913   HG12  ILE  54          HG12      ILE  54  -3.711   3.122   7.050
  914   HG13  ILE  54          HG13      ILE  54  -2.685   4.453   7.576
  915   HG21  ILE  54          HG21      ILE  54  -3.019   1.749   4.937
  916   HG22  ILE  54          HG22      ILE  54  -1.796   2.433   3.865
  917   HG23  ILE  54          HG23      ILE  54  -3.344   3.247   4.056
  918   HD11  ILE  54          HD11      ILE  54  -4.586   4.516   5.242
  919   HD12  ILE  54          HD12      ILE  54  -3.554   5.848   5.775
  920   HD13  ILE  54          HD13      ILE  54  -4.836   5.249   6.826
  921    H    LEU  55           H        LEU  55   0.793   3.981   5.114
  922    HA   LEU  55           HA       LEU  55   1.448   2.220   3.039
  923    HB2  LEU  55           HB2      LEU  55   3.208   4.391   4.249
  924    HB3  LEU  55           HB3      LEU  55   3.427   3.667   2.661
  925    HG   LEU  55           HG       LEU  55   1.058   5.378   3.511
  926   HD11  LEU  55          HD11      LEU  55   3.350   6.025   1.630
  927   HD12  LEU  55          HD12      LEU  55   3.101   6.703   3.241
  928   HD13  LEU  55          HD13      LEU  55   1.950   7.054   1.954
  929   HD21  LEU  55          HD21      LEU  55   0.364   3.673   1.896
  930   HD22  LEU  55          HD22      LEU  55   1.675   4.138   0.811
  931   HD23  LEU  55          HD23      LEU  55   0.365   5.267   1.149
  932    H    GLN  56           H        GLN  56   3.105   2.795   6.099
  933    HA   GLN  56           HA       GLN  56   5.319   1.077   5.755
  934    HB2  GLN  56           HB2      GLN  56   3.966   2.175   8.246
  935    HB3  GLN  56           HB3      GLN  56   5.512   1.331   8.265
  936    HG2  GLN  56           HG2      GLN  56   6.567   3.064   6.957
  937    HG3  GLN  56           HG3      GLN  56   5.018   3.849   6.649
  938   HE21  GLN  56          HE21      GLN  56   4.041   3.687   9.362
  939   HE22  GLN  56          HE22      GLN  56   4.963   4.801  10.290
  940    H    ARG  57           H        ARG  57   2.124   0.509   7.257
  941    HA   ARG  57           HA       ARG  57   2.555  -2.137   8.222
  942    HB2  ARG  57           HB2      ARG  57   0.020  -0.612   7.516
  943    HB3  ARG  57           HB3      ARG  57  -0.029  -2.241   8.171
  944    HG2  ARG  57           HG2      ARG  57   1.380  -0.009   9.649
  945    HG3  ARG  57           HG3      ARG  57  -0.362  -0.239   9.781
  946    HD2  ARG  57           HD2      ARG  57   0.687  -1.335  11.647
  947    HD3  ARG  57           HD3      ARG  57   0.042  -2.570  10.572
  948    HE   ARG  57           HE       ARG  57   2.852  -1.957  10.178
  949   HH11  ARG  57          HH11      ARG  57   0.587  -4.034  11.786
  950   HH12  ARG  57          HH12      ARG  57   1.786  -5.225  12.143
  951   HH21  ARG  57          HH21      ARG  57   4.341  -3.503  10.664
  952   HH22  ARG  57          HH22      ARG  57   3.874  -4.928  11.518
  953    H    VAL  58           H        VAL  58   1.319  -0.883   5.147
  954    HA   VAL  58           HA       VAL  58   0.650  -3.299   3.869
  955    HB   VAL  58           HB       VAL  58   1.620  -0.648   2.692
  956   HG11  VAL  58          HG11      VAL  58   2.087  -2.434   1.077
  957   HG12  VAL  58          HG12      VAL  58   0.767  -1.419   0.508
  958   HG13  VAL  58          HG13      VAL  58   0.423  -3.009   1.194
  959   HG21  VAL  58          HG21      VAL  58  -0.543  -0.501   3.875
  960   HG22  VAL  58          HG22      VAL  58  -1.194  -1.809   2.889
  961   HG23  VAL  58          HG23      VAL  58  -0.765  -0.270   2.139
  962    H    ILE  59           H        ILE  59   3.723  -1.441   3.849
  963    HA   ILE  59           HA       ILE  59   5.286  -3.106   2.230
  964    HB   ILE  59           HB       ILE  59   6.150  -1.349   4.576
  965   HG12  ILE  59          HG12      ILE  59   6.257  -0.734   1.576
  966   HG13  ILE  59          HG13      ILE  59   4.948  -0.215   2.629
  967   HG21  ILE  59          HG21      ILE  59   8.433  -1.350   3.580
  968   HG22  ILE  59          HG22      ILE  59   7.909  -2.549   2.396
  969   HG23  ILE  59          HG23      ILE  59   7.949  -2.959   4.112
  970   HD11  ILE  59          HD11      ILE  59   7.833   0.616   2.884
  971   HD12  ILE  59          HD12      ILE  59   6.501   1.161   3.904
  972   HD13  ILE  59          HD13      ILE  59   6.527   1.574   2.190
  973    H    ASP  60           H        ASP  60   4.932  -3.185   5.815
  974    HA   ASP  60           HA       ASP  60   6.567  -5.368   6.435
  975    HB2  ASP  60           HB2      ASP  60   3.960  -4.570   7.809
  976    HB3  ASP  60           HB3      ASP  60   5.193  -5.619   8.506
  977    H    TYR  61           H        TYR  61   3.095  -5.363   5.664
  978    HA   TYR  61           HA       TYR  61   2.479  -8.070   5.930
  979    HB2  TYR  61           HB2      TYR  61   0.733  -6.406   5.711
  980    HB3  TYR  61           HB3      TYR  61   1.323  -5.900   4.135
  981    HD1  TYR  61           HD1      TYR  61  -0.105  -8.926   5.872
  982    HD2  TYR  61           HD2      TYR  61   0.258  -6.771   2.184
  983    HE1  TYR  61           HE1      TYR  61  -1.707 -10.457   4.814
  984    HE2  TYR  61           HE2      TYR  61  -1.367  -8.302   1.143
  985    HH   TYR  61           HH       TYR  61  -2.192 -10.639   1.486
  986    H    ILE  62           H        ILE  62   3.601  -6.316   3.044
  987    HA   ILE  62           HA       ILE  62   3.398  -8.510   1.224
  988    HB   ILE  62           HB       ILE  62   4.938  -5.876   0.965
  989   HG12  ILE  62          HG12      ILE  62   2.173  -6.652  -0.120
  990   HG13  ILE  62          HG13      ILE  62   2.465  -5.584   1.246
  991   HG21  ILE  62          HG21      ILE  62   4.202  -7.858  -1.229
  992   HG22  ILE  62          HG22      ILE  62   5.828  -7.543  -0.620
  993   HG23  ILE  62          HG23      ILE  62   4.954  -6.278  -1.478
  994   HD11  ILE  62          HD11      ILE  62   3.554  -3.973  -0.250
  995   HD12  ILE  62          HD12      ILE  62   1.898  -4.330  -0.741
  996   HD13  ILE  62          HD13      ILE  62   3.247  -5.048  -1.620
  997    H    LEU  63           H        LEU  63   6.086  -7.216   3.189
  998    HA   LEU  63           HA       LEU  63   8.252  -8.539   2.010
  999    HB2  LEU  63           HB2      LEU  63   7.802  -7.627   4.862
 1000    HB3  LEU  63           HB3      LEU  63   9.341  -8.279   4.321
 1001    HG   LEU  63           HG       LEU  63   8.037  -5.782   3.161
 1002   HD11  LEU  63          HD11      LEU  63   9.735  -4.495   4.386
 1003   HD12  LEU  63          HD12      LEU  63  10.314  -5.974   5.157
 1004   HD13  LEU  63          HD13      LEU  63   8.682  -5.383   5.485
 1005   HD21  LEU  63          HD21      LEU  63  10.816  -6.928   2.708
 1006   HD22  LEU  63          HD22      LEU  63  10.209  -5.398   2.068
 1007   HD23  LEU  63          HD23      LEU  63   9.489  -6.915   1.542
 1008    H    ASP  64           H        ASP  64   6.122  -9.735   4.641
 1009    HA   ASP  64           HA       ASP  64   7.473 -12.205   5.092
 1010    HB2  ASP  64           HB2      ASP  64   4.615 -11.313   5.670
 1011    HB3  ASP  64           HB3      ASP  64   5.240 -12.884   6.160
 1012    H    LEU  65           H        LEU  65   5.023 -11.242   2.766
 1013    HA   LEU  65           HA       LEU  65   4.429 -13.925   1.838
 1014    HB2  LEU  65           HB2      LEU  65   3.835 -11.252   0.505
 1015    HB3  LEU  65           HB3      LEU  65   3.111 -12.803   0.098
 1016    HG   LEU  65           HG       LEU  65   2.702 -11.246   2.677
 1017   HD11  LEU  65          HD11      LEU  65   1.477 -10.299   0.781
 1018   HD12  LEU  65          HD12      LEU  65   0.374 -11.011   1.952
 1019   HD13  LEU  65          HD13      LEU  65   0.738 -11.868   0.453
 1020   HD21  LEU  65          HD21      LEU  65   1.097 -12.993   3.344
 1021   HD22  LEU  65          HD22      LEU  65   2.727 -13.640   3.192
 1022   HD23  LEU  65          HD23      LEU  65   1.539 -13.952   1.925
 1023    H    GLN  66           H        GLN  66   6.642 -11.379   0.961
 1024    HA   GLN  66           HA       GLN  66   7.576 -12.700  -1.511
 1025    HB2  GLN  66           HB2      GLN  66   8.132  -9.915  -0.388
 1026    HB3  GLN  66           HB3      GLN  66   8.777 -10.521  -1.910
 1027    HG2  GLN  66           HG2      GLN  66   5.830 -10.135  -1.293
 1028    HG3  GLN  66           HG3      GLN  66   6.837  -9.015  -2.216
 1029   HE21  GLN  66          HE21      GLN  66   7.575  -9.653  -4.259
 1030   HE22  GLN  66          HE22      GLN  66   6.811 -10.903  -5.159
 1031    H    VAL  67           H        VAL  67  10.052 -12.328  -1.868
 1032    HA   VAL  67           HA       VAL  67  11.605 -13.088   0.509
 1033    HB   VAL  67           HB       VAL  67  13.511 -13.421  -1.098
 1034   HG11  VAL  67          HG11      VAL  67  12.636 -15.506  -2.094
 1035   HG12  VAL  67          HG12      VAL  67  10.983 -14.982  -1.763
 1036   HG13  VAL  67          HG13      VAL  67  12.092 -15.306  -0.427
 1037   HG21  VAL  67          HG21      VAL  67  13.088 -13.468  -3.543
 1038   HG22  VAL  67          HG22      VAL  67  12.848 -11.847  -2.896
 1039   HG23  VAL  67          HG23      VAL  67  11.452 -12.853  -3.286
 1040    H    VAL  68           H        VAL  68  12.817 -11.685   1.604
 1041    HA   VAL  68           HA       VAL  68  12.723  -8.849   0.896
 1042    HB   VAL  68           HB       VAL  68  13.889 -10.098   3.433
 1043   HG11  VAL  68          HG11      VAL  68  13.475  -7.875   4.438
 1044   HG12  VAL  68          HG12      VAL  68  12.886  -7.276   2.885
 1045   HG13  VAL  68          HG13      VAL  68  14.571  -7.769   3.061
 1046   HG21  VAL  68          HG21      VAL  68  11.552 -10.843   3.187
 1047   HG22  VAL  68          HG22      VAL  68  11.017  -9.175   2.967
 1048   HG23  VAL  68          HG23      VAL  68  11.694  -9.688   4.514
  Start of MODEL   11
    1    H1   MET   1           H1       MET   1  30.178 -26.551 -21.298
    2    H2   MET   1           H2       MET   1  29.651 -27.251 -19.852
    3    H3   MET   1           H3       MET   1  29.629 -25.567 -20.039
    4    HA   MET   1           HA       MET   1  27.976 -25.724 -21.767
    5    HB2  MET   1           HB2      MET   1  28.116 -28.718 -21.179
    6    HB3  MET   1           HB3      MET   1  26.865 -27.963 -22.160
    7    HG2  MET   1           HG2      MET   1  28.542 -27.265 -23.803
    8    HG3  MET   1           HG3      MET   1  29.824 -27.960 -22.809
    9    HE1  MET   1           HE1      MET   1  26.227 -29.560 -23.409
   10    HE2  MET   1           HE2      MET   1  26.548 -30.560 -24.825
   11    HE3  MET   1           HE3      MET   1  26.582 -28.803 -24.964
   12    H    GLY   2           H        GLY   2  25.535 -26.809 -21.221
   13    HA2  GLY   2           HA2      GLY   2  23.840 -27.198 -19.698
   14    HA3  GLY   2           HA3      GLY   2  25.026 -27.231 -18.407
   15    H    HIS   3           H        HIS   3  24.253 -24.605 -20.708
   16    HA   HIS   3           HA       HIS   3  23.775 -22.709 -18.547
   17    HB2  HIS   3           HB2      HIS   3  23.496 -22.325 -21.561
   18    HB3  HIS   3           HB3      HIS   3  23.545 -21.045 -20.347
   19    HD2  HIS   3           HD2      HIS   3  26.100 -20.551 -19.217
   20    HE1  HIS   3           HE1      HIS   3  28.154 -22.967 -22.020
   21    HE2  HIS   3           HE2      HIS   3  28.394 -21.183 -20.251
   22    H    HIS   4           H        HIS   4  21.866 -22.979 -17.482
   23    HA   HIS   4           HA       HIS   4  19.382 -23.585 -19.010
   24    HB2  HIS   4           HB2      HIS   4  20.248 -25.636 -17.943
   25    HB3  HIS   4           HB3      HIS   4  20.313 -24.825 -16.383
   26    HD2  HIS   4           HD2      HIS   4  17.631 -26.306 -18.850
   27    HE1  HIS   4           HE1      HIS   4  15.858 -25.617 -15.069
   28    HE2  HIS   4           HE2      HIS   4  15.467 -26.430 -17.430
   29    H    HIS   5           H        HIS   5  20.838 -21.826 -16.334
   30    HA   HIS   5           HA       HIS   5  18.546 -21.265 -14.798
   31    HB2  HIS   5           HB2      HIS   5  21.184 -19.771 -15.008
   32    HB3  HIS   5           HB3      HIS   5  19.941 -19.373 -13.822
   33    HD2  HIS   5           HD2      HIS   5  22.944 -21.650 -14.148
   34    HE1  HIS   5           HE1      HIS   5  20.584 -23.187 -10.988
   35    HE2  HIS   5           HE2      HIS   5  22.746 -23.429 -12.277
   36    H    HIS   6           H        HIS   6  16.770 -20.416 -15.692
   37    HA   HIS   6           HA       HIS   6  16.808 -18.137 -17.515
   38    HB2  HIS   6           HB2      HIS   6  15.193 -20.011 -17.830
   39    HB3  HIS   6           HB3      HIS   6  14.468 -19.654 -16.273
   40    HD2  HIS   6           HD2      HIS   6  12.753 -17.429 -16.225
   41    HE1  HIS   6           HE1      HIS   6  12.725 -16.935 -20.421
   42    HE2  HIS   6           HE2      HIS   6  11.794 -16.105 -18.229
   43    H    HIS   7           H        HIS   7  17.728 -16.523 -16.229
   44    HA   HIS   7           HA       HIS   7  15.905 -15.151 -14.389
   45    HB2  HIS   7           HB2      HIS   7  17.334 -16.631 -12.940
   46    HB3  HIS   7           HB3      HIS   7  18.772 -15.841 -13.575
   47    HD2  HIS   7           HD2      HIS   7  19.471 -13.502 -12.305
   48    HE1  HIS   7           HE1      HIS   7  16.028 -13.242  -9.867
   49    HE2  HIS   7           HE2      HIS   7  18.226 -12.157 -10.472
   50    H    HIS   8           H        HIS   8  15.724 -13.301 -15.499
   51    HA   HIS   8           HA       HIS   8  18.070 -12.118 -16.886
   52    HB2  HIS   8           HB2      HIS   8  15.138 -11.871 -17.695
   53    HB3  HIS   8           HB3      HIS   8  16.550 -11.397 -18.643
   54    HD2  HIS   8           HD2      HIS   8  14.383 -14.518 -17.918
   55    HE1  HIS   8           HE1      HIS   8  17.665 -15.774 -20.264
   56    HE2  HIS   8           HE2      HIS   8  15.371 -16.381 -19.419
   57    H    SER   9           H        SER   9  16.408 -11.619 -14.161
   58    HA   SER   9           HA       SER   9  16.235  -8.658 -14.390
   59    HB2  SER   9           HB2      SER   9  14.628  -8.774 -12.480
   60    HB3  SER   9           HB3      SER   9  14.063  -9.694 -13.872
   61    HG   SER   9           HG       SER   9  14.339 -10.568 -11.426
   62    H    HIS  10           H        HIS  10  17.150  -7.362 -12.785
   63    HA   HIS  10           HA       HIS  10  18.458  -8.493 -10.441
   64    HB2  HIS  10           HB2      HIS  10  20.220  -8.688 -12.219
   65    HB3  HIS  10           HB3      HIS  10  20.109  -6.955 -12.503
   66    HD1  HIS  10           HD1      HIS  10  21.541  -5.475 -11.039
   67    HD2  HIS  10           HD2      HIS  10  21.302  -9.361  -9.582
   68    HE1  HIS  10           HE1      HIS  10  23.206  -5.602  -9.175
   69    HE2  HIS  10           HE2      HIS  10  23.104  -7.969  -8.361
   70    H    MET  11           H        MET  11  17.340  -7.240  -9.033
   71    HA   MET  11           HA       MET  11  17.592  -4.302  -9.183
   72    HB2  MET  11           HB2      MET  11  15.362  -4.979 -10.123
   73    HB3  MET  11           HB3      MET  11  14.976  -5.769  -8.602
   74    HG2  MET  11           HG2      MET  11  15.033  -3.610  -7.446
   75    HG3  MET  11           HG3      MET  11  15.489  -2.803  -8.953
   76    HE1  MET  11           HE1      MET  11  11.763  -1.627  -8.476
   77    HE2  MET  11           HE2      MET  11  13.428  -1.101  -8.722
   78    HE3  MET  11           HE3      MET  11  12.961  -1.868  -7.204
   79    H    GLY  12           H        GLY  12  18.284  -3.481  -7.290
   80    HA2  GLY  12           HA2      GLY  12  17.756  -3.545  -4.766
   81    HA3  GLY  12           HA3      GLY  12  18.349  -5.198  -4.869
   82    H    GLY  13           H        GLY  13  19.965  -4.585  -3.313
   83    HA2  GLY  13           HA2      GLY  13  22.190  -4.275  -2.830
   84    HA3  GLY  13           HA3      GLY  13  22.474  -3.778  -4.488
   85    H    GLY  14           H        GLY  14  23.786  -2.523  -2.405
   86    HA2  GLY  14           HA2      GLY  14  24.403  -0.407  -1.748
   87    HA3  GLY  14           HA3      GLY  14  23.190   0.238  -2.841
   88    H    LYS  15           H        LYS  15  22.620  -1.947  -0.109
   89    HA   LYS  15           HA       LYS  15  20.630  -0.170   1.042
   90    HB2  LYS  15           HB2      LYS  15  20.225  -2.603   0.941
   91    HB3  LYS  15           HB3      LYS  15  21.645  -2.900   1.938
   92    HG2  LYS  15           HG2      LYS  15  20.528  -1.663   3.820
   93    HG3  LYS  15           HG3      LYS  15  19.088  -1.496   2.812
   94    HD2  LYS  15           HD2      LYS  15  18.851  -3.384   4.393
   95    HD3  LYS  15           HD3      LYS  15  18.838  -3.953   2.722
   96    HE2  LYS  15           HE2      LYS  15  20.205  -5.407   4.203
   97    HE3  LYS  15           HE3      LYS  15  21.170  -4.688   2.917
   98    HZ1  LYS  15           HZ1      LYS  15  22.004  -3.066   4.487
   99    HZ2  LYS  15           HZ2      LYS  15  22.290  -4.628   5.060
  100    HZ3  LYS  15           HZ3      LYS  15  21.038  -3.710   5.716
  101    H    GLY  16           H        GLY  16  21.673   1.612   1.921
  102    HA2  GLY  16           HA2      GLY  16  23.960   1.456   3.676
  103    HA3  GLY  16           HA3      GLY  16  23.009   2.885   3.315
  104    HA   PRO  17           HA       PRO  17  21.916   0.997   7.691
  105    HB2  PRO  17           HB2      PRO  17  23.951   2.929   8.770
  106    HB3  PRO  17           HB3      PRO  17  23.603   1.270   9.276
  107    HG2  PRO  17           HG2      PRO  17  25.822   1.817   7.886
  108    HG3  PRO  17           HG3      PRO  17  24.893   0.335   7.555
  109    HD2  PRO  17           HD2      PRO  17  24.896   2.947   6.021
  110    HD3  PRO  17           HD3      PRO  17  24.978   1.281   5.399
  111    H    ALA  18           H        ALA  18  20.461   2.080   9.040
  112    HA   ALA  18           HA       ALA  18  19.490   4.683   8.254
  113    HB1  ALA  18           HB1      ALA  18  17.804   4.372  10.029
  114    HB2  ALA  18           HB2      ALA  18  18.664   2.945  10.609
  115    HB3  ALA  18           HB3      ALA  18  17.925   2.936   9.008
  116    H    ALA  19           H        ALA  19  21.419   5.949   8.606
  117    HA   ALA  19           HA       ALA  19  22.444   6.398  11.281
  118    HB1  ALA  19           HB1      ALA  19  23.922   6.558   9.327
  119    HB2  ALA  19           HB2      ALA  19  23.893   8.078  10.221
  120    HB3  ALA  19           HB3      ALA  19  22.988   7.924   8.712
  121    H    GLU  20           H        GLU  20  19.611   7.352   9.869
  122    HA   GLU  20           HA       GLU  20  19.281   9.657  11.709
  123    HB2  GLU  20           HB2      GLU  20  17.866   9.356   9.020
  124    HB3  GLU  20           HB3      GLU  20  17.771  10.728  10.118
  125    HG2  GLU  20           HG2      GLU  20  20.187  11.179   9.674
  126    HG3  GLU  20           HG3      GLU  20  20.181   9.875   8.486
  127    H    GLU  21           H        GLU  21  17.173   9.830  12.664
  128    HA   GLU  21           HA       GLU  21  15.287   7.583  12.282
  129    HB2  GLU  21           HB2      GLU  21  14.161   8.267  14.315
  130    HB3  GLU  21           HB3      GLU  21  15.878   8.160  14.662
  131    HG2  GLU  21           HG2      GLU  21  14.414  10.775  14.133
  132    HG3  GLU  21           HG3      GLU  21  14.688  10.105  15.738
  133    HA   PRO  22           HA       PRO  22  12.704  10.229   9.682
  134    HB2  PRO  22           HB2      PRO  22  10.358   8.758  10.844
  135    HB3  PRO  22           HB3      PRO  22  10.839   8.945   9.152
  136    HG2  PRO  22           HG2      PRO  22  11.204   6.615  10.391
  137    HG3  PRO  22           HG3      PRO  22  12.455   7.244   9.291
  138    HD2  PRO  22           HD2      PRO  22  12.381   7.331  12.322
  139    HD3  PRO  22           HD3      PRO  22  13.728   6.890  11.243
  140    H    LEU  23           H        LEU  23  12.989  12.233  10.770
  141    HA   LEU  23           HA       LEU  23  11.411  13.069  13.015
  142    HB2  LEU  23           HB2      LEU  23  12.794  14.749  10.883
  143    HB3  LEU  23           HB3      LEU  23  12.143  15.365  12.396
  144    HG   LEU  23           HG       LEU  23  14.480  13.414  12.150
  145   HD11  LEU  23          HD11      LEU  23  15.893  15.267  12.942
  146   HD12  LEU  23          HD12      LEU  23  14.501  16.351  12.925
  147   HD13  LEU  23          HD13      LEU  23  15.109  15.671  11.414
  148   HD21  LEU  23          HD21      LEU  23  13.309  14.704  14.648
  149   HD22  LEU  23          HD22      LEU  23  14.781  13.732  14.590
  150   HD23  LEU  23          HD23      LEU  23  13.226  12.991  14.223
  151    H    SER  24           H        SER  24   9.344  13.800  13.077
  152    HA   SER  24           HA       SER  24   7.627  13.557  10.823
  153    HB2  SER  24           HB2      SER  24   5.827  14.304  12.402
  154    HB3  SER  24           HB3      SER  24   6.818  12.999  13.052
  155    HG   SER  24           HG       SER  24   6.930  15.761  13.713
  156    H    LEU  25           H        LEU  25   8.574  15.011   9.345
  157    HA   LEU  25           HA       LEU  25   7.541  17.583   8.976
  158    HB2  LEU  25           HB2      LEU  25   9.088  18.053  10.966
  159    HB3  LEU  25           HB3      LEU  25  10.446  17.651   9.943
  160    HG   LEU  25           HG       LEU  25   8.577  19.893   9.118
  161   HD11  LEU  25          HD11      LEU  25   9.131  20.407  11.450
  162   HD12  LEU  25          HD12      LEU  25   9.909  21.543  10.351
  163   HD13  LEU  25          HD13      LEU  25  10.853  20.248  11.093
  164   HD21  LEU  25          HD21      LEU  25  10.600  20.836   8.066
  165   HD22  LEU  25          HD22      LEU  25  10.283  19.202   7.492
  166   HD23  LEU  25          HD23      LEU  25  11.557  19.482   8.678
  167    H    LEU  26           H        LEU  26  10.289  15.421   8.554
  168    HA   LEU  26           HA       LEU  26  11.047  16.121   5.889
  169    HB2  LEU  26           HB2      LEU  26  12.412  14.909   7.666
  170    HB3  LEU  26           HB3      LEU  26  11.454  13.478   7.363
  171    HG   LEU  26           HG       LEU  26  13.042  14.726   5.091
  172   HD11  LEU  26          HD11      LEU  26  14.995  13.340   5.665
  173   HD12  LEU  26          HD12      LEU  26  14.195  12.818   7.151
  174   HD13  LEU  26          HD13      LEU  26  14.643  14.510   6.939
  175   HD21  LEU  26          HD21      LEU  26  13.172  12.406   4.262
  176   HD22  LEU  26          HD22      LEU  26  11.499  12.898   4.502
  177   HD23  LEU  26          HD23      LEU  26  12.278  11.839   5.676
  178    H    ASP  27           H        ASP  27  10.652  14.843   3.918
  179    HA   ASP  27           HA       ASP  27   7.933  13.975   3.514
  180    HB2  ASP  27           HB2      ASP  27  10.351  13.786   1.664
  181    HB3  ASP  27           HB3      ASP  27   8.673  13.589   1.172
  182    H    ASP  28           H        ASP  28   8.612  12.205   5.413
  183    HA   ASP  28           HA       ASP  28   9.990   9.851   4.681
  184    HB2  ASP  28           HB2      ASP  28   9.526  10.631   7.046
  185    HB3  ASP  28           HB3      ASP  28   7.840  10.131   6.838
  186    H    MET  29           H        MET  29   6.631  10.836   4.396
  187    HA   MET  29           HA       MET  29   5.362   8.447   3.698
  188    HB2  MET  29           HB2      MET  29   4.737  11.171   2.486
  189    HB3  MET  29           HB3      MET  29   3.638   9.809   2.656
  190    HG2  MET  29           HG2      MET  29   3.992  10.089   5.195
  191    HG3  MET  29           HG3      MET  29   4.683  11.656   4.791
  192    HE1  MET  29           HE1      MET  29   1.542   9.387   4.826
  193    HE2  MET  29           HE2      MET  29   1.610   9.731   3.093
  194    HE3  MET  29           HE3      MET  29   0.302  10.395   4.074
  195    H    ASN  30           H        ASN  30   7.195  10.745   1.701
  196    HA   ASN  30           HA       ASN  30   6.668   9.608  -0.850
  197    HB2  ASN  30           HB2      ASN  30   9.003  11.351   0.046
  198    HB3  ASN  30           HB3      ASN  30   8.562  11.028  -1.629
  199   HD21  ASN  30          HD21      ASN  30   8.251  13.258  -2.014
  200   HD22  ASN  30          HD22      ASN  30   6.891  14.116  -1.391
  201    H    HIS  31           H        HIS  31   9.268   9.066   1.532
  202    HA   HIS  31           HA       HIS  31  10.843   7.234   0.022
  203    HB2  HIS  31           HB2      HIS  31  10.497   7.546   3.036
  204    HB3  HIS  31           HB3      HIS  31  11.669   6.453   2.305
  205    HD2  HIS  31           HD2      HIS  31  11.144  10.282   2.891
  206    HE1  HIS  31           HE1      HIS  31  15.032   9.614   1.374
  207    HE2  HIS  31           HE2      HIS  31  13.364  11.366   2.110
  208    H    CYS  32           H        CYS  32   8.109   6.757   2.255
  209    HA   CYS  32           HA       CYS  32   7.896   3.948   2.134
  210    HB2  CYS  32           HB2      CYS  32   5.693   6.003   2.577
  211    HB3  CYS  32           HB3      CYS  32   5.567   4.281   2.934
  212    HG   CYS  32           HG       CYS  32   8.000   6.141   4.434
  213    H    TYR  33           H        TYR  33   6.481   6.465   0.069
  214    HA   TYR  33           HA       TYR  33   4.913   4.795  -1.607
  215    HB2  TYR  33           HB2      TYR  33   5.907   7.644  -1.804
  216    HB3  TYR  33           HB3      TYR  33   5.184   6.902  -3.229
  217    HD1  TYR  33           HD1      TYR  33   2.919   5.555  -2.636
  218    HD2  TYR  33           HD2      TYR  33   4.368   8.928  -0.463
  219    HE1  TYR  33           HE1      TYR  33   0.666   6.000  -1.856
  220    HE2  TYR  33           HE2      TYR  33   2.090   9.378   0.338
  221    HH   TYR  33           HH       TYR  33  -0.181   8.900  -0.196
  222    H    SER  34           H        SER  34   8.272   5.882  -1.815
  223    HA   SER  34           HA       SER  34   8.892   4.862  -4.388
  224    HB2  SER  34           HB2      SER  34  10.377   6.443  -3.210
  225    HB3  SER  34           HB3      SER  34  10.724   5.234  -1.974
  226    HG   SER  34           HG       SER  34  11.950   5.613  -4.300
  227    H    ARG  35           H        ARG  35   8.947   3.370  -1.169
  228    HA   ARG  35           HA       ARG  35   9.976   0.828  -2.029
  229    HB2  ARG  35           HB2      ARG  35   8.906   1.928   0.559
  230    HB3  ARG  35           HB3      ARG  35   9.055   0.182   0.393
  231    HG2  ARG  35           HG2      ARG  35  11.358   2.065  -0.148
  232    HG3  ARG  35           HG3      ARG  35  11.036   1.385   1.452
  233    HD2  ARG  35           HD2      ARG  35  11.206  -0.907   0.441
  234    HD3  ARG  35           HD3      ARG  35  11.671  -0.156  -1.089
  235    HE   ARG  35           HE       ARG  35  13.605   0.814   0.226
  236   HH11  ARG  35          HH11      ARG  35  12.202  -2.218   1.136
  237   HH12  ARG  35          HH12      ARG  35  13.682  -2.812   1.805
  238   HH21  ARG  35          HH21      ARG  35  15.472   0.018   1.082
  239   HH22  ARG  35          HH22      ARG  35  15.497  -1.567   1.769
  240    H    LEU  36           H        LEU  36   6.685   2.077  -1.642
  241    HA   LEU  36           HA       LEU  36   5.301  -0.354  -2.052
  242    HB2  LEU  36           HB2      LEU  36   4.580   2.476  -2.896
  243    HB3  LEU  36           HB3      LEU  36   3.488   1.112  -3.056
  244    HG   LEU  36           HG       LEU  36   4.568   2.200  -0.421
  245   HD11  LEU  36          HD11      LEU  36   2.273   2.936   0.023
  246   HD12  LEU  36          HD12      LEU  36   1.772   2.387  -1.579
  247   HD13  LEU  36          HD13      LEU  36   2.925   3.713  -1.419
  248   HD21  LEU  36          HD21      LEU  36   4.215  -0.225  -0.264
  249   HD22  LEU  36          HD22      LEU  36   2.574  -0.049  -0.892
  250   HD23  LEU  36          HD23      LEU  36   3.003   0.638   0.678
  251    H    ARG  37           H        ARG  37   6.574   2.046  -4.384
  252    HA   ARG  37           HA       ARG  37   5.942   0.806  -6.805
  253    HB2  ARG  37           HB2      ARG  37   8.362   2.495  -6.116
  254    HB3  ARG  37           HB3      ARG  37   7.901   2.052  -7.757
  255    HG2  ARG  37           HG2      ARG  37   5.770   3.293  -7.491
  256    HG3  ARG  37           HG3      ARG  37   6.252   3.750  -5.853
  257    HD2  ARG  37           HD2      ARG  37   8.203   4.932  -6.732
  258    HD3  ARG  37           HD3      ARG  37   7.795   4.437  -8.373
  259    HE   ARG  37           HE       ARG  37   6.084   6.226  -6.754
  260   HH11  ARG  37          HH11      ARG  37   7.586   5.466  -9.779
  261   HH12  ARG  37          HH12      ARG  37   6.936   6.862 -10.564
  262   HH21  ARG  37          HH21      ARG  37   5.284   8.009  -7.787
  263   HH22  ARG  37          HH22      ARG  37   5.637   8.263  -9.461
  264    H    GLU  38           H        GLU  38   8.513  -0.009  -4.519
  265    HA   GLU  38           HA       GLU  38  10.187  -1.518  -6.306
  266    HB2  GLU  38           HB2      GLU  38   9.960  -1.713  -3.267
  267    HB3  GLU  38           HB3      GLU  38  11.262  -2.398  -4.232
  268    HG2  GLU  38           HG2      GLU  38  10.653   0.559  -3.971
  269    HG3  GLU  38           HG3      GLU  38  11.888  -0.307  -3.067
  270    H    LEU  39           H        LEU  39   7.370  -2.273  -4.370
  271    HA   LEU  39           HA       LEU  39   7.753  -5.191  -4.595
  272    HB2  LEU  39           HB2      LEU  39   5.837  -3.589  -2.862
  273    HB3  LEU  39           HB3      LEU  39   6.095  -5.327  -2.779
  274    HG   LEU  39           HG       LEU  39   8.180  -3.205  -2.109
  275   HD11  LEU  39          HD11      LEU  39   6.413  -3.305  -0.415
  276   HD12  LEU  39          HD12      LEU  39   7.936  -3.925   0.218
  277   HD13  LEU  39          HD13      LEU  39   6.654  -5.045  -0.247
  278   HD21  LEU  39          HD21      LEU  39   8.374  -6.234  -1.908
  279   HD22  LEU  39          HD22      LEU  39   9.568  -5.088  -1.296
  280   HD23  LEU  39          HD23      LEU  39   9.265  -5.196  -3.028
  281    H    VAL  40           H        VAL  40   6.115  -2.875  -6.364
  282    HA   VAL  40           HA       VAL  40   3.817  -4.666  -6.969
  283    HB   VAL  40           HB       VAL  40   3.997  -1.666  -7.511
  284   HG11  VAL  40          HG11      VAL  40   1.626  -3.572  -7.744
  285   HG12  VAL  40          HG12      VAL  40   2.482  -2.806  -9.084
  286   HG13  VAL  40          HG13      VAL  40   1.553  -1.820  -7.956
  287   HG21  VAL  40          HG21      VAL  40   2.526  -3.136  -5.286
  288   HG22  VAL  40          HG22      VAL  40   2.403  -1.407  -5.626
  289   HG23  VAL  40          HG23      VAL  40   3.942  -2.090  -5.096
  290    HA   PRO  41           HA       PRO  41   5.811  -4.913 -11.149
  291    HB2  PRO  41           HB2      PRO  41   5.000  -7.430 -11.751
  292    HB3  PRO  41           HB3      PRO  41   6.378  -7.140 -10.676
  293    HG2  PRO  41           HG2      PRO  41   3.515  -7.779  -9.948
  294    HG3  PRO  41           HG3      PRO  41   5.014  -8.486  -9.302
  295    HD2  PRO  41           HD2      PRO  41   3.633  -6.486  -8.024
  296    HD3  PRO  41           HD3      PRO  41   5.389  -6.692  -7.870
  297    H    GLY  42           H        GLY  42   2.623  -4.814  -9.934
  298    HA2  GLY  42           HA2      GLY  42   1.145  -5.037 -12.412
  299    HA3  GLY  42           HA3      GLY  42   0.530  -4.501 -10.860
  300    H    VAL  43           H        VAL  43   3.295  -2.754 -11.766
  301    HA   VAL  43           HA       VAL  43   1.833  -0.372 -12.563
  302    HB   VAL  43           HB       VAL  43   4.840  -0.881 -12.311
  303   HG11  VAL  43          HG11      VAL  43   4.422   1.005 -13.822
  304   HG12  VAL  43          HG12      VAL  43   5.088   1.591 -12.297
  305   HG13  VAL  43          HG13      VAL  43   3.362   1.762 -12.629
  306   HG21  VAL  43          HG21      VAL  43   4.687   0.342 -10.159
  307   HG22  VAL  43          HG22      VAL  43   3.698  -1.118 -10.142
  308   HG23  VAL  43          HG23      VAL  43   2.934   0.461 -10.346
  309    HA   PRO  44           HA       PRO  44   2.402  -1.334 -17.042
  310    HB2  PRO  44           HB2      PRO  44   1.434   1.473 -17.426
  311    HB3  PRO  44           HB3      PRO  44   0.779  -0.038 -18.075
  312    HG2  PRO  44           HG2      PRO  44  -0.510   1.284 -16.125
  313    HG3  PRO  44           HG3      PRO  44  -0.453  -0.493 -16.134
  314    HD2  PRO  44           HD2      PRO  44   1.219   1.442 -14.510
  315    HD3  PRO  44           HD3      PRO  44   0.387  -0.041 -13.982
  316    H    ARG  45           H        ARG  45   3.612  -0.293 -18.893
  317    HA   ARG  45           HA       ARG  45   6.080   0.985 -18.150
  318    HB2  ARG  45           HB2      ARG  45   4.804   0.452 -20.857
  319    HB3  ARG  45           HB3      ARG  45   6.396   1.188 -20.674
  320    HG2  ARG  45           HG2      ARG  45   7.249  -0.826 -19.586
  321    HG3  ARG  45           HG3      ARG  45   5.646  -1.564 -19.633
  322    HD2  ARG  45           HD2      ARG  45   5.704  -1.662 -22.065
  323    HD3  ARG  45           HD3      ARG  45   7.207  -0.744 -22.107
  324    HE   ARG  45           HE       ARG  45   8.375  -2.650 -21.666
  325   HH11  ARG  45          HH11      ARG  45   5.042  -3.369 -20.969
  326   HH12  ARG  45          HH12      ARG  45   5.368  -5.052 -20.753
  327   HH21  ARG  45          HH21      ARG  45   8.712  -4.797 -21.399
  328   HH22  ARG  45          HH22      ARG  45   7.397  -5.839 -20.977
  329    H    GLY  46           H        GLY  46   3.007   2.132 -19.491
  330    HA2  GLY  46           HA2      GLY  46   3.831   4.953 -19.392
  331    HA3  GLY  46           HA3      GLY  46   2.266   4.322 -19.890
  332    H    THR  47           H        THR  47   1.317   5.973 -18.552
  333    HA   THR  47           HA       THR  47   0.140   6.715 -16.778
  334    HB   THR  47           HB       THR  47   0.824   4.062 -15.430
  335    HG1  THR  47           HG1      THR  47  -0.392   4.050 -17.494
  336   HG21  THR  47          HG21      THR  47   0.028   5.722 -13.775
  337   HG22  THR  47          HG22      THR  47  -1.185   4.466 -14.030
  338   HG23  THR  47          HG23      THR  47  -1.388   6.053 -14.775
  339    H    GLN  48           H        GLN  48   1.286   8.481 -16.099
  340    HA   GLN  48           HA       GLN  48   3.621   8.458 -14.467
  341    HB2  GLN  48           HB2      GLN  48   3.021  10.429 -15.791
  342    HB3  GLN  48           HB3      GLN  48   1.513  10.620 -14.904
  343    HG2  GLN  48           HG2      GLN  48   2.721  11.223 -12.876
  344    HG3  GLN  48           HG3      GLN  48   4.266  10.870 -13.650
  345   HE21  GLN  48          HE21      GLN  48   4.997  12.967 -13.212
  346   HE22  GLN  48          HE22      GLN  48   4.444  14.337 -14.100
  347    H    LEU  49           H        LEU  49   3.645   7.557 -12.481
  348    HA   LEU  49           HA       LEU  49   1.268   7.109 -10.926
  349    HB2  LEU  49           HB2      LEU  49   4.167   6.667 -10.140
  350    HB3  LEU  49           HB3      LEU  49   2.765   6.056  -9.279
  351    HG   LEU  49           HG       LEU  49   3.713   5.191 -12.034
  352   HD11  LEU  49          HD11      LEU  49   3.629   3.690  -9.395
  353   HD12  LEU  49          HD12      LEU  49   5.074   4.304 -10.199
  354   HD13  LEU  49          HD13      LEU  49   4.132   3.021 -10.949
  355   HD21  LEU  49          HD21      LEU  49   1.263   5.169 -12.006
  356   HD22  LEU  49          HD22      LEU  49   1.262   4.247 -10.498
  357   HD23  LEU  49          HD23      LEU  49   1.889   3.522 -11.981
  358    H    SER  50           H        SER  50   0.437   9.147 -10.330
  359    HA   SER  50           HA       SER  50   1.792  10.913  -8.499
  360    HB2  SER  50           HB2      SER  50  -1.214  10.475  -8.867
  361    HB3  SER  50           HB3      SER  50  -0.457  11.854  -8.067
  362    HG   SER  50           HG       SER  50  -0.539  12.700  -9.996
  363    H    GLN  51           H        GLN  51   1.163  11.102  -6.166
  364    HA   GLN  51           HA       GLN  51   1.682   8.888  -4.629
  365    HB2  GLN  51           HB2      GLN  51   0.783  10.209  -2.688
  366    HB3  GLN  51           HB3      GLN  51   1.886  11.110  -3.723
  367    HG2  GLN  51           HG2      GLN  51  -0.114  12.158  -4.841
  368    HG3  GLN  51           HG3      GLN  51  -1.140  11.362  -3.649
  369   HE21  GLN  51          HE21      GLN  51  -1.030  12.084  -1.469
  370   HE22  GLN  51          HE22      GLN  51  -0.384  13.627  -1.060
  371    H    VAL  52           H        VAL  52  -1.564   9.996  -5.594
  372    HA   VAL  52           HA       VAL  52  -3.035   8.044  -4.091
  373    HB   VAL  52           HB       VAL  52  -4.020   9.572  -6.553
  374   HG11  VAL  52          HG11      VAL  52  -6.262   9.263  -5.540
  375   HG12  VAL  52          HG12      VAL  52  -5.544   8.318  -4.232
  376   HG13  VAL  52          HG13      VAL  52  -5.488   7.717  -5.892
  377   HG21  VAL  52          HG21      VAL  52  -4.104  10.453  -3.632
  378   HG22  VAL  52          HG22      VAL  52  -4.886  11.287  -4.978
  379   HG23  VAL  52          HG23      VAL  52  -3.127  11.182  -4.911
  380    H    GLU  53           H        GLU  53  -1.947   8.251  -7.491
  381    HA   GLU  53           HA       GLU  53  -3.157   5.929  -8.535
  382    HB2  GLU  53           HB2      GLU  53  -0.535   7.197  -9.451
  383    HB3  GLU  53           HB3      GLU  53  -1.537   6.102 -10.396
  384    HG2  GLU  53           HG2      GLU  53  -2.220   8.931  -9.545
  385    HG3  GLU  53           HG3      GLU  53  -1.846   8.369 -11.174
  386    H    ILE  54           H        ILE  54  -0.088   6.372  -6.847
  387    HA   ILE  54           HA       ILE  54   1.070   3.836  -7.173
  388    HB   ILE  54           HB       ILE  54   1.250   5.797  -4.842
  389   HG12  ILE  54          HG12      ILE  54   3.225   5.285  -7.126
  390   HG13  ILE  54          HG13      ILE  54   2.096   6.635  -7.060
  391   HG21  ILE  54          HG21      ILE  54   1.880   3.626  -3.964
  392   HG22  ILE  54          HG22      ILE  54   3.338   4.592  -4.163
  393   HG23  ILE  54          HG23      ILE  54   2.960   3.325  -5.334
  394   HD11  ILE  54          HD11      ILE  54   4.359   6.127  -5.131
  395   HD12  ILE  54          HD12      ILE  54   3.227   7.483  -5.064
  396   HD13  ILE  54          HD13      ILE  54   4.330   7.317  -6.431
  397    H    LEU  55           H        LEU  55  -1.071   5.044  -4.538
  398    HA   LEU  55           HA       LEU  55  -1.340   2.658  -3.102
  399    HB2  LEU  55           HB2      LEU  55  -3.345   4.912  -3.431
  400    HB3  LEU  55           HB3      LEU  55  -3.523   3.603  -2.275
  401    HG   LEU  55           HG       LEU  55  -1.394   5.775  -2.249
  402   HD11  LEU  55          HD11      LEU  55  -3.579   6.500  -1.402
  403   HD12  LEU  55          HD12      LEU  55  -2.408   6.396  -0.088
  404   HD13  LEU  55          HD13      LEU  55  -3.623   5.130  -0.286
  405   HD21  LEU  55          HD21      LEU  55  -1.631   3.351  -0.435
  406   HD22  LEU  55          HD22      LEU  55  -0.546   4.716  -0.179
  407   HD23  LEU  55          HD23      LEU  55  -0.333   3.679  -1.585
  408    H    GLN  56           H        GLN  56  -3.299   3.879  -5.827
  409    HA   GLN  56           HA       GLN  56  -5.192   1.807  -5.984
  410    HB2  GLN  56           HB2      GLN  56  -4.025   3.501  -8.228
  411    HB3  GLN  56           HB3      GLN  56  -5.491   2.531  -8.359
  412    HG2  GLN  56           HG2      GLN  56  -6.617   3.923  -6.698
  413    HG3  GLN  56           HG3      GLN  56  -5.132   4.830  -6.410
  414   HE21  GLN  56          HE21      GLN  56  -6.143   6.779  -6.946
  415   HE22  GLN  56          HE22      GLN  56  -6.513   7.208  -8.573
  416    H    ARG  57           H        ARG  57  -1.930   2.018  -7.455
  417    HA   ARG  57           HA       ARG  57  -2.003  -0.442  -8.878
  418    HB2  ARG  57           HB2      ARG  57   0.111   1.518  -8.115
  419    HB3  ARG  57           HB3      ARG  57   0.699  -0.122  -8.303
  420    HG2  ARG  57           HG2      ARG  57   1.041   0.936 -10.392
  421    HG3  ARG  57           HG3      ARG  57  -0.326  -0.149 -10.615
  422    HD2  ARG  57           HD2      ARG  57  -0.533   2.856 -10.204
  423    HD3  ARG  57           HD3      ARG  57  -0.609   2.047 -11.764
  424    HE   ARG  57           HE       ARG  57  -2.726   2.395  -9.909
  425   HH11  ARG  57          HH11      ARG  57  -1.597   0.021 -12.177
  426   HH12  ARG  57          HH12      ARG  57  -3.184  -0.575 -12.489
  427   HH21  ARG  57          HH21      ARG  57  -4.735   1.618 -10.366
  428   HH22  ARG  57          HH22      ARG  57  -4.931   0.312 -11.477
  429    H    VAL  58           H        VAL  58  -1.080   0.334  -5.545
  430    HA   VAL  58           HA       VAL  58  -0.061  -2.234  -4.847
  431    HB   VAL  58           HB       VAL  58  -1.152  -0.055  -3.001
  432   HG11  VAL  58          HG11      VAL  58   0.207  -1.154  -1.231
  433   HG12  VAL  58          HG12      VAL  58   0.608  -2.455  -2.357
  434   HG13  VAL  58          HG13      VAL  58  -1.063  -2.215  -1.843
  435   HG21  VAL  58          HG21      VAL  58   1.208   0.620  -2.693
  436   HG22  VAL  58          HG22      VAL  58   0.733   0.751  -4.385
  437   HG23  VAL  58          HG23      VAL  58   1.722  -0.607  -3.855
  438    H    ILE  59           H        ILE  59  -3.279  -0.742  -4.429
  439    HA   ILE  59           HA       ILE  59  -4.537  -2.722  -2.881
  440    HB   ILE  59           HB       ILE  59  -5.719  -0.762  -4.904
  441   HG12  ILE  59          HG12      ILE  59  -5.714  -0.567  -1.850
  442   HG13  ILE  59          HG13      ILE  59  -4.474   0.166  -2.857
  443   HG21  ILE  59          HG21      ILE  59  -7.343  -2.578  -4.562
  444   HG22  ILE  59          HG22      ILE  59  -7.919  -1.099  -3.796
  445   HG23  ILE  59          HG23      ILE  59  -7.224  -2.386  -2.810
  446   HD11  ILE  59          HD11      ILE  59  -6.156   1.590  -3.903
  447   HD12  ILE  59          HD12      ILE  59  -6.134   1.778  -2.150
  448   HD13  ILE  59          HD13      ILE  59  -7.412   0.837  -2.915
  449    H    ASP  60           H        ASP  60  -4.599  -2.265  -6.430
  450    HA   ASP  60           HA       ASP  60  -5.955  -4.652  -7.103
  451    HB2  ASP  60           HB2      ASP  60  -4.114  -2.834  -8.698
  452    HB3  ASP  60           HB3      ASP  60  -4.941  -4.212  -9.424
  453    H    TYR  61           H        TYR  61  -2.469  -3.986  -6.734
  454    HA   TYR  61           HA       TYR  61  -1.381  -6.440  -7.537
  455    HB2  TYR  61           HB2      TYR  61   0.149  -4.664  -7.095
  456    HB3  TYR  61           HB3      TYR  61  -0.506  -4.378  -5.489
  457    HD1  TYR  61           HD1      TYR  61   1.378  -6.966  -7.461
  458    HD2  TYR  61           HD2      TYR  61   0.610  -5.307  -3.591
  459    HE1  TYR  61           HE1      TYR  61   3.138  -8.383  -6.504
  460    HE2  TYR  61           HE2      TYR  61   2.388  -6.713  -2.650
  461    HH   TYR  61           HH       TYR  61   3.553  -8.801  -3.150
  462    H    ILE  62           H        ILE  62  -2.571  -5.472  -4.319
  463    HA   ILE  62           HA       ILE  62  -2.026  -7.916  -2.983
  464    HB   ILE  62           HB       ILE  62  -4.031  -5.728  -2.250
  465   HG12  ILE  62          HG12      ILE  62  -1.168  -6.137  -1.232
  466   HG13  ILE  62          HG13      ILE  62  -1.646  -4.920  -2.406
  467   HG21  ILE  62          HG21      ILE  62  -4.535  -7.821  -1.054
  468   HG22  ILE  62          HG22      ILE  62  -3.899  -6.612   0.057
  469   HG23  ILE  62          HG23      ILE  62  -2.859  -7.924  -0.501
  470   HD11  ILE  62          HD11      ILE  62  -2.525  -5.059   0.483
  471   HD12  ILE  62          HD12      ILE  62  -3.068  -3.852  -0.689
  472   HD13  ILE  62          HD13      ILE  62  -1.369  -3.929  -0.223
  473    H    LEU  63           H        LEU  63  -4.797  -6.801  -4.899
  474    HA   LEU  63           HA       LEU  63  -6.594  -8.933  -4.271
  475    HB2  LEU  63           HB2      LEU  63  -6.432  -7.148  -6.723
  476    HB3  LEU  63           HB3      LEU  63  -7.744  -8.279  -6.423
  477    HG   LEU  63           HG       LEU  63  -7.065  -5.858  -4.701
  478   HD11  LEU  63          HD11      LEU  63  -9.184  -4.921  -5.521
  479   HD12  LEU  63          HD12      LEU  63  -9.404  -6.321  -6.574
  480   HD13  LEU  63          HD13      LEU  63  -8.056  -5.216  -6.844
  481   HD21  LEU  63          HD21      LEU  63  -9.331  -7.862  -4.395
  482   HD22  LEU  63          HD22      LEU  63  -9.153  -6.368  -3.472
  483   HD23  LEU  63          HD23      LEU  63  -7.962  -7.653  -3.299
  484    H    ASP  64           H        ASP  64  -3.980  -8.646  -6.676
  485    HA   ASP  64           HA       ASP  64  -4.500 -11.057  -8.094
  486    HB2  ASP  64           HB2      ASP  64  -1.833  -9.642  -7.673
  487    HB3  ASP  64           HB3      ASP  64  -2.154 -10.876  -8.881
  488    H    LEU  65           H        LEU  65  -2.848 -10.366  -5.099
  489    HA   LEU  65           HA       LEU  65  -1.705 -13.007  -4.753
  490    HB2  LEU  65           HB2      LEU  65  -2.060 -10.794  -2.704
  491    HB3  LEU  65           HB3      LEU  65  -0.974 -12.172  -2.588
  492    HG   LEU  65           HG       LEU  65  -0.728  -9.834  -4.523
  493   HD11  LEU  65          HD11      LEU  65  -0.055  -9.258  -2.259
  494   HD12  LEU  65          HD12      LEU  65   1.347  -9.330  -3.322
  495   HD13  LEU  65          HD13      LEU  65   1.029 -10.652  -2.198
  496   HD21  LEU  65          HD21      LEU  65   1.062 -12.281  -4.320
  497   HD22  LEU  65          HD22      LEU  65   1.378 -10.848  -5.302
  498   HD23  LEU  65          HD23      LEU  65  -0.006 -11.873  -5.668
  499    H    GLN  66           H        GLN  66  -4.447 -11.195  -3.362
  500    HA   GLN  66           HA       GLN  66  -5.387 -13.442  -1.769
  501    HB2  GLN  66           HB2      GLN  66  -6.651 -10.709  -2.232
  502    HB3  GLN  66           HB3      GLN  66  -7.284 -11.944  -1.148
  503    HG2  GLN  66           HG2      GLN  66  -5.165 -11.801   0.177
  504    HG3  GLN  66           HG3      GLN  66  -4.642 -10.472  -0.860
  505   HE21  GLN  66          HE21      GLN  66  -4.567  -9.067   0.944
  506   HE22  GLN  66          HE22      GLN  66  -5.994  -8.449   1.683
  507    H    VAL  67           H        VAL  67  -6.079 -15.045  -3.038
  508    HA   VAL  67           HA       VAL  67  -7.678 -14.605  -5.442
  509    HB   VAL  67           HB       VAL  67  -6.715 -17.251  -4.256
  510   HG11  VAL  67          HG11      VAL  67  -7.753 -16.602  -7.045
  511   HG12  VAL  67          HG12      VAL  67  -8.591 -17.548  -5.813
  512   HG13  VAL  67          HG13      VAL  67  -7.105 -18.163  -6.532
  513   HG21  VAL  67          HG21      VAL  67  -5.394 -15.538  -6.409
  514   HG22  VAL  67          HG22      VAL  67  -4.869 -17.152  -5.919
  515   HG23  VAL  67          HG23      VAL  67  -4.781 -15.812  -4.775
  516    H    VAL  68           H        VAL  68  -9.635 -13.864  -4.627
  517    HA   VAL  68           HA       VAL  68 -11.185 -15.342  -2.684
  518    HB   VAL  68           HB       VAL  68 -13.028 -13.671  -3.232
  519   HG11  VAL  68          HG11      VAL  68 -10.327 -12.522  -2.412
  520   HG12  VAL  68          HG12      VAL  68 -11.484 -13.319  -1.345
  521   HG13  VAL  68          HG13      VAL  68 -11.898 -11.779  -2.095
  522   HG21  VAL  68          HG21      VAL  68 -12.387 -13.105  -5.557
  523   HG22  VAL  68          HG22      VAL  68 -10.886 -12.378  -4.983
  524   HG23  VAL  68          HG23      VAL  68 -12.439 -11.652  -4.558
  525    H1   MET   1           H1       MET   1  30.769  -4.962   5.589
  526    H2   MET   1           H2       MET   1  29.554  -3.972   6.225
  527    H3   MET   1           H3       MET   1  30.517  -4.899   7.258
  528    HA   MET   1           HA       MET   1  32.456  -3.652   6.711
  529    HB2  MET   1           HB2      MET   1  31.718  -3.208   4.336
  530    HB3  MET   1           HB3      MET   1  30.616  -1.982   4.936
  531    HG2  MET   1           HG2      MET   1  33.590  -1.801   5.430
  532    HG3  MET   1           HG3      MET   1  32.857  -1.207   3.943
  533    HE1  MET   1           HE1      MET   1  30.119   0.098   4.769
  534    HE2  MET   1           HE2      MET   1  31.321   0.907   3.760
  535    HE3  MET   1           HE3      MET   1  30.631   1.743   5.150
  536    H    GLY   2           H        GLY   2  32.678  -2.845   8.735
  537    HA2  GLY   2           HA2      GLY   2  30.449  -1.668  10.174
  538    HA3  GLY   2           HA3      GLY   2  32.027  -2.076  10.821
  539    H    HIS   3           H        HIS   3  30.581   0.221   8.522
  540    HA   HIS   3           HA       HIS   3  31.365   2.552   9.971
  541    HB2  HIS   3           HB2      HIS   3  33.582   1.996   8.947
  542    HB3  HIS   3           HB3      HIS   3  32.851   1.985   7.349
  543    HD2  HIS   3           HD2      HIS   3  33.295   4.324   6.058
  544    HE1  HIS   3           HE1      HIS   3  33.663   6.797   9.465
  545    HE2  HIS   3           HE2      HIS   3  33.507   6.742   6.944
  546    H    HIS   4           H        HIS   4  30.655   4.556   8.789
  547    HA   HIS   4           HA       HIS   4  29.029   4.277   6.392
  548    HB2  HIS   4           HB2      HIS   4  26.963   5.214   7.382
  549    HB3  HIS   4           HB3      HIS   4  27.382   3.703   8.174
  550    HD2  HIS   4           HD2      HIS   4  28.461   4.024  10.833
  551    HE1  HIS   4           HE1      HIS   4  26.910   7.942  11.226
  552    HE2  HIS   4           HE2      HIS   4  28.183   6.083  12.379
  553    H    HIS   5           H        HIS   5  28.471   6.359   5.449
  554    HA   HIS   5           HA       HIS   5  30.073   8.670   6.422
  555    HB2  HIS   5           HB2      HIS   5  30.545   7.802   4.099
  556    HB3  HIS   5           HB3      HIS   5  28.883   8.163   3.653
  557    HD2  HIS   5           HD2      HIS   5  28.699  10.559   2.382
  558    HE1  HIS   5           HE1      HIS   5  32.042  12.406   4.196
  559    HE2  HIS   5           HE2      HIS   5  30.061  12.743   2.663
  560    H    HIS   6           H        HIS   6  27.609   7.909   7.666
  561    HA   HIS   6           HA       HIS   6  25.545   8.500   8.302
  562    HB2  HIS   6           HB2      HIS   6  26.595  10.709   8.734
  563    HB3  HIS   6           HB3      HIS   6  26.221  11.217   7.097
  564    HD2  HIS   6           HD2      HIS   6  23.466  11.800   6.630
  565    HE1  HIS   6           HE1      HIS   6  22.529  11.969  10.744
  566    HE2  HIS   6           HE2      HIS   6  21.685  12.395   8.399
  567    H    HIS   7           H        HIS   7  24.735   6.937   6.821
  568    HA   HIS   7           HA       HIS   7  23.672   7.758   4.251
  569    HB2  HIS   7           HB2      HIS   7  23.345   5.173   5.834
  570    HB3  HIS   7           HB3      HIS   7  22.709   5.433   4.212
  571    HD2  HIS   7           HD2      HIS   7  24.537   5.212   2.149
  572    HE1  HIS   7           HE1      HIS   7  27.845   4.311   4.619
  573    HE2  HIS   7           HE2      HIS   7  26.924   4.217   2.272
  574    H    HIS   8           H        HIS   8  21.663   8.461   3.818
  575    HA   HIS   8           HA       HIS   8  19.936   9.284   6.023
  576    HB2  HIS   8           HB2      HIS   8  19.824   9.830   3.023
  577    HB3  HIS   8           HB3      HIS   8  18.732  10.548   4.202
  578    HD2  HIS   8           HD2      HIS   8  22.721  10.421   4.185
  579    HE1  HIS   8           HE1      HIS   8  21.383  14.394   4.663
  580    HE2  HIS   8           HE2      HIS   8  23.383  12.861   4.705
  581    H    SER   9           H        SER   9  20.000   6.421   5.460
  582    HA   SER   9           HA       SER   9  17.510   5.693   4.135
  583    HB2  SER   9           HB2      SER   9  19.645   3.966   5.472
  584    HB3  SER   9           HB3      SER   9  18.296   3.359   4.513
  585    HG   SER   9           HG       SER   9  19.313   4.968   2.884
  586    H    HIS  10           H        HIS  10  16.804   7.248   6.199
  587    HA   HIS  10           HA       HIS  10  16.196   5.971   8.647
  588    HB2  HIS  10           HB2      HIS  10  14.414   7.854   8.823
  589    HB3  HIS  10           HB3      HIS  10  16.097   8.341   8.683
  590    HD1  HIS  10           HD1      HIS  10  16.788   9.664   6.603
  591    HD2  HIS  10           HD2      HIS  10  12.811   8.452   6.506
  592    HE1  HIS  10           HE1      HIS  10  15.770  10.854   4.659
  593    HE2  HIS  10           HE2      HIS  10  13.435   9.955   4.511
  594    H    MET  11           H        MET  11  15.271   3.990   8.487
  595    HA   MET  11           HA       MET  11  13.566   3.122   6.396
  596    HB2  MET  11           HB2      MET  11  14.161   1.778   9.066
  597    HB3  MET  11           HB3      MET  11  13.478   0.978   7.652
  598    HG2  MET  11           HG2      MET  11  15.537   1.339   6.402
  599    HG3  MET  11           HG3      MET  11  16.218   2.273   7.735
  600    HE1  MET  11           HE1      MET  11  18.439   0.823   7.850
  601    HE2  MET  11           HE2      MET  11  17.876  -0.088   6.445
  602    HE3  MET  11           HE3      MET  11  18.441  -0.942   7.879
  603    H    GLY  12           H        GLY  12  12.848   3.622   9.866
  604    HA2  GLY  12           HA2      GLY  12  10.222   4.640   9.487
  605    HA3  GLY  12           HA3      GLY  12  10.138   2.926   9.882
  606    H    GLY  13           H        GLY  13   8.887   4.126  11.714
  607    HA2  GLY  13           HA2      GLY  13   8.818   4.408  14.030
  608    HA3  GLY  13           HA3      GLY  13  10.574   4.307  14.089
  609    H    GLY  14           H        GLY  14   8.119   6.460  12.636
  610    HA2  GLY  14           HA2      GLY  14   9.303   8.832  13.947
  611    HA3  GLY  14           HA3      GLY  14   9.194   8.805  12.191
  612    H    LYS  15           H        LYS  15   7.361   8.761  15.175
  613    HA   LYS  15           HA       LYS  15   4.887   9.640  13.770
  614    HB2  LYS  15           HB2      LYS  15   5.023   7.936  16.301
  615    HB3  LYS  15           HB3      LYS  15   3.571   8.371  15.402
  616    HG2  LYS  15           HG2      LYS  15   4.243   6.978  13.525
  617    HG3  LYS  15           HG3      LYS  15   5.808   6.655  14.272
  618    HD2  LYS  15           HD2      LYS  15   4.564   5.524  16.174
  619    HD3  LYS  15           HD3      LYS  15   3.082   5.702  15.227
  620    HE2  LYS  15           HE2      LYS  15   4.106   4.371  13.404
  621    HE3  LYS  15           HE3      LYS  15   5.567   4.175  14.374
  622    HZ1  LYS  15           HZ1      LYS  15   2.866   3.208  15.131
  623    HZ2  LYS  15           HZ2      LYS  15   4.296   2.971  16.003
  624    HZ3  LYS  15           HZ3      LYS  15   4.106   2.255  14.487
  625    H    GLY  16           H        GLY  16   3.308  10.636  15.533
  626    HA2  GLY  16           HA2      GLY  16   4.512  12.114  17.708
  627    HA3  GLY  16           HA3      GLY  16   4.162  13.120  16.303
  628    HA   PRO  17           HA       PRO  17   0.190  13.180  18.794
  629    HB2  PRO  17           HB2      PRO  17  -0.533  15.722  17.945
  630    HB3  PRO  17           HB3      PRO  17   0.454  15.407  19.378
  631    HG2  PRO  17           HG2      PRO  17   1.340  16.166  16.596
  632    HG3  PRO  17           HG3      PRO  17   1.905  16.795  18.160
  633    HD2  PRO  17           HD2      PRO  17   3.333  14.952  16.799
  634    HD3  PRO  17           HD3      PRO  17   3.251  14.911  18.574
  635    H    ALA  18           H        ALA  18  -1.208  11.860  17.753
  636    HA   ALA  18           HA       ALA  18  -1.370  11.530  14.953
  637    HB1  ALA  18           HB1      ALA  18  -1.835   9.714  16.549
  638    HB2  ALA  18           HB2      ALA  18  -3.165   9.920  15.408
  639    HB3  ALA  18           HB3      ALA  18  -3.316  10.527  17.059
  640    H    ALA  19           H        ALA  19  -1.893  13.454  13.951
  641    HA   ALA  19           HA       ALA  19  -4.386  14.871  14.514
  642    HB1  ALA  19           HB1      ALA  19  -2.315  16.147  14.104
  643    HB2  ALA  19           HB2      ALA  19  -3.544  16.518  12.895
  644    HB3  ALA  19           HB3      ALA  19  -2.199  15.451  12.487
  645    H    GLU  20           H        GLU  20  -5.779  15.518  12.642
  646    HA   GLU  20           HA       GLU  20  -5.961  13.615  10.415
  647    HB2  GLU  20           HB2      GLU  20  -8.400  13.158  10.944
  648    HB3  GLU  20           HB3      GLU  20  -7.264  12.440  12.079
  649    HG2  GLU  20           HG2      GLU  20  -7.719  14.219  13.710
  650    HG3  GLU  20           HG3      GLU  20  -8.796  15.017  12.565
  651    H    GLU  21           H        GLU  21  -6.772  14.530   8.603
  652    HA   GLU  21           HA       GLU  21  -7.616  17.293   8.532
  653    HB2  GLU  21           HB2      GLU  21  -7.809  16.886   6.062
  654    HB3  GLU  21           HB3      GLU  21  -6.234  16.480   6.729
  655    HG2  GLU  21           HG2      GLU  21  -7.055  14.049   6.817
  656    HG3  GLU  21           HG3      GLU  21  -8.407  14.576   5.816
  657    HA   PRO  22           HA       PRO  22 -11.860  16.563   9.326
  658    HB2  PRO  22           HB2      PRO  22 -13.037  18.860   8.507
  659    HB3  PRO  22           HB3      PRO  22 -11.849  18.828   9.817
  660    HG2  PRO  22           HG2      PRO  22 -11.439  19.539   6.912
  661    HG3  PRO  22           HG3      PRO  22 -10.870  20.400   8.358
  662    HD2  PRO  22           HD2      PRO  22  -9.289  18.683   6.911
  663    HD3  PRO  22           HD3      PRO  22  -9.068  18.960   8.653
  664    H    LEU  23           H        LEU  23 -10.935  16.052   6.278
  665    HA   LEU  23           HA       LEU  23 -11.747  15.102   4.420
  666    HB2  LEU  23           HB2      LEU  23 -13.902  14.143   6.327
  667    HB3  LEU  23           HB3      LEU  23 -13.640  13.492   4.716
  668    HG   LEU  23           HG       LEU  23 -11.690  13.321   7.053
  669   HD11  LEU  23          HD11      LEU  23 -13.302  11.141   5.685
  670   HD12  LEU  23          HD12      LEU  23 -13.589  11.788   7.301
  671   HD13  LEU  23          HD13      LEU  23 -12.108  10.893   6.963
  672   HD21  LEU  23          HD21      LEU  23 -10.427  13.562   4.972
  673   HD22  LEU  23          HD22      LEU  23 -11.366  12.269   4.220
  674   HD23  LEU  23          HD23      LEU  23 -10.293  11.909   5.573
  675    H    SER  24           H        SER  24 -12.276  16.631   2.952
  676    HA   SER  24           HA       SER  24 -15.136  17.383   2.678
  677    HB2  SER  24           HB2      SER  24 -14.470  19.652   1.881
  678    HB3  SER  24           HB3      SER  24 -13.972  19.377   3.546
  679    HG   SER  24           HG       SER  24 -12.064  18.646   1.722
  680    H    LEU  25           H        LEU  25 -15.888  17.523   0.515
  681    HA   LEU  25           HA       LEU  25 -16.190  16.560  -1.522
  682    HB2  LEU  25           HB2      LEU  25 -13.217  17.171  -1.843
  683    HB3  LEU  25           HB3      LEU  25 -14.201  16.504  -3.132
  684    HG   LEU  25           HG       LEU  25 -15.628  18.592  -3.042
  685   HD11  LEU  25          HD11      LEU  25 -15.105  19.380  -0.778
  686   HD12  LEU  25          HD12      LEU  25 -14.745  20.620  -1.974
  687   HD13  LEU  25          HD13      LEU  25 -13.431  19.684  -1.252
  688   HD21  LEU  25          HD21      LEU  25 -13.904  18.296  -4.758
  689   HD22  LEU  25          HD22      LEU  25 -12.692  19.012  -3.689
  690   HD23  LEU  25          HD23      LEU  25 -14.038  19.987  -4.284
  691    H    LEU  26           H        LEU  26 -14.624  14.711  -3.052
  692    HA   LEU  26           HA       LEU  26 -14.514  12.397  -1.244
  693    HB2  LEU  26           HB2      LEU  26 -14.412  12.578  -4.264
  694    HB3  LEU  26           HB3      LEU  26 -14.117  11.086  -3.381
  695    HG   LEU  26           HG       LEU  26 -16.478  11.574  -2.279
  696   HD11  LEU  26          HD11      LEU  26 -18.082  12.701  -3.742
  697   HD12  LEU  26          HD12      LEU  26 -16.781  13.154  -4.843
  698   HD13  LEU  26          HD13      LEU  26 -16.818  13.807  -3.204
  699   HD21  LEU  26          HD21      LEU  26 -15.963   9.621  -3.623
  700   HD22  LEU  26          HD22      LEU  26 -16.226  10.540  -5.111
  701   HD23  LEU  26          HD23      LEU  26 -17.571  10.236  -4.009
  702    H    ASP  27           H        ASP  27 -12.693  12.618  -0.082
  703    HA   ASP  27           HA       ASP  27 -10.075  13.139  -1.133
  704    HB2  ASP  27           HB2      ASP  27 -10.918  11.894   1.521
  705    HB3  ASP  27           HB3      ASP  27  -9.293  12.455   1.136
  706    H    ASP  28           H        ASP  28  -9.885  11.656  -2.901
  707    HA   ASP  28           HA       ASP  28 -10.317   8.856  -2.661
  708    HB2  ASP  28           HB2      ASP  28 -10.413  10.255  -4.797
  709    HB3  ASP  28           HB3      ASP  28  -8.649  10.219  -4.816
  710    H    MET  29           H        MET  29  -7.465  10.857  -2.183
  711    HA   MET  29           HA       MET  29  -5.411   9.014  -1.828
  712    HB2  MET  29           HB2      MET  29  -5.084  11.429  -1.605
  713    HB3  MET  29           HB3      MET  29  -6.144  11.494  -0.210
  714    HG2  MET  29           HG2      MET  29  -4.177  11.538   0.940
  715    HG3  MET  29           HG3      MET  29  -4.224   9.791   0.728
  716    HE1  MET  29           HE1      MET  29  -3.389   9.229  -2.236
  717    HE2  MET  29           HE2      MET  29  -2.610   8.453  -0.856
  718    HE3  MET  29           HE3      MET  29  -1.629   9.206  -2.112
  719    H    ASN  30           H        ASN  30  -7.791  10.104   0.564
  720    HA   ASN  30           HA       ASN  30  -7.005   8.274   2.638
  721    HB2  ASN  30           HB2      ASN  30  -9.373  10.181   2.395
  722    HB3  ASN  30           HB3      ASN  30  -8.913   9.325   3.877
  723   HD21  ASN  30          HD21      ASN  30  -9.007  12.223   3.256
  724   HD22  ASN  30          HD22      ASN  30  -7.431  12.823   3.597
  725    H    HIS  31           H        HIS  31  -9.426   8.252   0.109
  726    HA   HIS  31           HA       HIS  31 -11.054   6.118   1.094
  727    HB2  HIS  31           HB2      HIS  31 -11.729   7.800  -0.696
  728    HB3  HIS  31           HB3      HIS  31 -10.659   6.966  -1.812
  729    HD2  HIS  31           HD2      HIS  31 -14.265   6.859  -0.662
  730    HE1  HIS  31           HE1      HIS  31 -13.496   3.153  -2.548
  731    HE2  HIS  31           HE2      HIS  31 -15.234   4.568  -1.384
  732    H    CYS  32           H        CYS  32  -8.258   6.304  -1.102
  733    HA   CYS  32           HA       CYS  32  -7.947   3.547  -1.637
  734    HB2  CYS  32           HB2      CYS  32  -5.967   5.845  -1.705
  735    HB3  CYS  32           HB3      CYS  32  -5.514   4.201  -2.139
  736    HG   CYS  32           HG       CYS  32  -7.663   6.275  -3.796
  737    H    TYR  33           H        TYR  33  -6.656   5.602   0.992
  738    HA   TYR  33           HA       TYR  33  -5.195   3.633   2.401
  739    HB2  TYR  33           HB2      TYR  33  -6.575   6.180   3.300
  740    HB3  TYR  33           HB3      TYR  33  -5.782   5.131   4.472
  741    HD1  TYR  33           HD1      TYR  33  -3.330   4.296   3.229
  742    HD2  TYR  33           HD2      TYR  33  -5.220   8.121   3.009
  743    HE1  TYR  33           HE1      TYR  33  -1.157   5.345   2.871
  744    HE2  TYR  33           HE2      TYR  33  -3.034   9.180   2.621
  745    HH   TYR  33           HH       TYR  33  -0.266   7.460   1.818
  746    H    SER  34           H        SER  34  -8.654   4.434   2.471
  747    HA   SER  34           HA       SER  34  -9.410   2.677   4.592
  748    HB2  SER  34           HB2      SER  34 -11.075   3.824   2.311
  749    HB3  SER  34           HB3      SER  34 -11.740   2.985   3.715
  750    HG   SER  34           HG       SER  34 -10.140   5.330   3.847
  751    H    ARG  35           H        ARG  35  -9.061   2.260   1.100
  752    HA   ARG  35           HA       ARG  35 -10.140  -0.378   0.915
  753    HB2  ARG  35           HB2      ARG  35  -8.496   1.328  -0.911
  754    HB3  ARG  35           HB3      ARG  35  -8.877  -0.350  -1.325
  755    HG2  ARG  35           HG2      ARG  35 -11.218   0.054  -1.326
  756    HG3  ARG  35           HG3      ARG  35 -11.033   1.619  -0.524
  757    HD2  ARG  35           HD2      ARG  35 -11.538   1.905  -2.848
  758    HD3  ARG  35           HD3      ARG  35  -9.927   2.503  -2.490
  759    HE   ARG  35           HE       ARG  35 -10.065  -0.203  -3.556
  760   HH11  ARG  35          HH11      ARG  35  -9.510   3.133  -4.301
  761   HH12  ARG  35          HH12      ARG  35  -8.860   2.776  -5.861
  762   HH21  ARG  35          HH21      ARG  35  -9.202  -0.612  -5.546
  763   HH22  ARG  35          HH22      ARG  35  -8.686   0.696  -6.550
  764    H    LEU  36           H        LEU  36  -6.861   0.893   1.418
  765    HA   LEU  36           HA       LEU  36  -5.451  -1.570   1.474
  766    HB2  LEU  36           HB2      LEU  36  -4.929   1.053   2.928
  767    HB3  LEU  36           HB3      LEU  36  -3.802  -0.294   2.923
  768    HG   LEU  36           HG       LEU  36  -4.682   1.232   0.436
  769   HD11  LEU  36          HD11      LEU  36  -2.070   1.409   1.954
  770   HD12  LEU  36          HD12      LEU  36  -3.316   2.656   1.864
  771   HD13  LEU  36          HD13      LEU  36  -2.429   2.195   0.413
  772   HD21  LEU  36          HD21      LEU  36  -2.873   0.009  -0.719
  773   HD22  LEU  36          HD22      LEU  36  -4.093  -1.096  -0.095
  774   HD23  LEU  36          HD23      LEU  36  -2.552  -0.921   0.748
  775    H    ARG  37           H        ARG  37  -7.088   0.311   4.033
  776    HA   ARG  37           HA       ARG  37  -6.632  -1.281   6.264
  777    HB2  ARG  37           HB2      ARG  37  -7.681   1.021   6.193
  778    HB3  ARG  37           HB3      ARG  37  -9.159   0.290   5.602
  779    HG2  ARG  37           HG2      ARG  37  -9.503   0.685   7.911
  780    HG3  ARG  37           HG3      ARG  37  -9.238  -1.050   7.755
  781    HD2  ARG  37           HD2      ARG  37  -6.885  -0.746   8.483
  782    HD3  ARG  37           HD3      ARG  37  -7.168   0.988   8.652
  783    HE   ARG  37           HE       ARG  37  -7.981  -1.118  10.461
  784   HH11  ARG  37          HH11      ARG  37  -8.708   2.156   9.535
  785   HH12  ARG  37          HH12      ARG  37  -9.324   2.555  11.101
  786   HH21  ARG  37          HH21      ARG  37  -8.751  -0.560  12.432
  787   HH22  ARG  37          HH22      ARG  37  -9.346   1.042  12.714
  788    H    GLU  38           H        GLU  38  -8.780  -1.834   3.566
  789    HA   GLU  38           HA       GLU  38 -10.422  -3.892   4.766
  790    HB2  GLU  38           HB2      GLU  38  -9.941  -3.181   1.837
  791    HB3  GLU  38           HB3      GLU  38 -11.160  -4.317   2.401
  792    HG2  GLU  38           HG2      GLU  38 -11.086  -1.354   3.020
  793    HG3  GLU  38           HG3      GLU  38 -12.121  -2.131   1.827
  794    H    LEU  39           H        LEU  39  -7.470  -3.805   2.815
  795    HA   LEU  39           HA       LEU  39  -7.454  -6.715   2.391
  796    HB2  LEU  39           HB2      LEU  39  -5.751  -4.506   1.186
  797    HB3  LEU  39           HB3      LEU  39  -5.647  -6.205   0.745
  798    HG   LEU  39           HG       LEU  39  -8.077  -4.416   0.308
  799   HD11  LEU  39          HD11      LEU  39  -6.108  -5.541  -1.706
  800   HD12  LEU  39          HD12      LEU  39  -6.247  -3.852  -1.214
  801   HD13  LEU  39          HD13      LEU  39  -7.570  -4.623  -2.086
  802   HD21  LEU  39          HD21      LEU  39  -8.792  -6.721   0.742
  803   HD22  LEU  39          HD22      LEU  39  -7.658  -7.332  -0.465
  804   HD23  LEU  39          HD23      LEU  39  -9.020  -6.325  -0.960
  805    H    VAL  40           H        VAL  40  -6.054  -4.612   4.653
  806    HA   VAL  40           HA       VAL  40  -3.610  -6.276   4.965
  807    HB   VAL  40           HB       VAL  40  -4.126  -3.511   6.160
  808   HG11  VAL  40          HG11      VAL  40  -2.495  -4.807   7.475
  809   HG12  VAL  40          HG12      VAL  40  -1.689  -3.487   6.631
  810   HG13  VAL  40          HG13      VAL  40  -1.549  -5.137   6.020
  811   HG21  VAL  40          HG21      VAL  40  -2.549  -2.662   4.440
  812   HG22  VAL  40          HG22      VAL  40  -4.011  -3.344   3.726
  813   HG23  VAL  40          HG23      VAL  40  -2.500  -4.266   3.700
  814    HA   PRO  41           HA       PRO  41  -5.659  -7.730   8.888
  815    HB2  PRO  41           HB2      PRO  41  -4.444 -10.168   8.956
  816    HB3  PRO  41           HB3      PRO  41  -5.863  -9.867   7.940
  817    HG2  PRO  41           HG2      PRO  41  -2.944  -9.835   7.155
  818    HG3  PRO  41           HG3      PRO  41  -4.305 -10.645   6.345
  819    HD2  PRO  41           HD2      PRO  41  -3.361  -8.241   5.501
  820    HD3  PRO  41           HD3      PRO  41  -5.079  -8.661   5.378
  821    H    GLY  42           H        GLY  42  -2.476  -7.030   7.810
  822    HA2  GLY  42           HA2      GLY  42  -0.941  -7.351  10.156
  823    HA3  GLY  42           HA3      GLY  42  -0.625  -6.199   8.869
  824    H    VAL  43           H        VAL  43  -3.475  -5.083   9.444
  825    HA   VAL  43           HA       VAL  43  -2.886  -3.063  11.353
  826    HB   VAL  43           HB       VAL  43  -5.611  -4.026  10.349
  827   HG11  VAL  43          HG11      VAL  43  -5.874  -2.723  12.414
  828   HG12  VAL  43          HG12      VAL  43  -6.481  -1.809  11.033
  829   HG13  VAL  43          HG13      VAL  43  -4.911  -1.410  11.736
  830   HG21  VAL  43          HG21      VAL  43  -3.864  -1.747   9.325
  831   HG22  VAL  43          HG22      VAL  43  -5.489  -2.131   8.754
  832   HG23  VAL  43          HG23      VAL  43  -4.176  -3.277   8.496
  833    HA   PRO  44           HA       PRO  44  -3.173  -5.793  14.924
  834    HB2  PRO  44           HB2      PRO  44  -2.904  -3.950  16.940
  835    HB3  PRO  44           HB3      PRO  44  -1.554  -4.470  15.921
  836    HG2  PRO  44           HG2      PRO  44  -3.255  -1.991  15.695
  837    HG3  PRO  44           HG3      PRO  44  -1.491  -2.149  15.558
  838    HD2  PRO  44           HD2      PRO  44  -3.109  -1.967  13.375
  839    HD3  PRO  44           HD3      PRO  44  -1.607  -2.916  13.358
  840    H    ARG  45           H        ARG  45  -5.254  -6.575  14.754
  841    HA   ARG  45           HA       ARG  45  -7.435  -6.965  15.074
  842    HB2  ARG  45           HB2      ARG  45  -7.156  -5.285  17.587
  843    HB3  ARG  45           HB3      ARG  45  -8.437  -6.443  17.250
  844    HG2  ARG  45           HG2      ARG  45  -6.561  -8.217  17.121
  845    HG3  ARG  45           HG3      ARG  45  -5.521  -6.994  17.850
  846    HD2  ARG  45           HD2      ARG  45  -6.253  -8.179  19.719
  847    HD3  ARG  45           HD3      ARG  45  -7.409  -6.850  19.678
  848    HE   ARG  45           HE       ARG  45  -7.905  -9.667  19.114
  849   HH11  ARG  45          HH11      ARG  45  -9.289  -6.491  19.069
  850   HH12  ARG  45          HH12      ARG  45 -10.900  -7.099  18.946
  851   HH21  ARG  45          HH21      ARG  45  -9.957 -10.389  18.945
  852   HH22  ARG  45          HH22      ARG  45 -11.269  -9.266  18.892
  853    H    GLY  46           H        GLY  46  -7.672  -3.747  16.567
  854    HA2  GLY  46           HA2      GLY  46  -9.278  -2.724  14.282
  855    HA3  GLY  46           HA3      GLY  46  -9.558  -2.287  15.964
  856    H    THR  47           H        THR  47  -8.321  -0.722  16.929
  857    HA   THR  47           HA       THR  47  -6.865   0.942  17.313
  858    HB   THR  47           HB       THR  47  -4.941  -0.772  15.691
  859    HG1  THR  47           HG1      THR  47  -4.355  -1.240  18.072
  860   HG21  THR  47          HG21      THR  47  -3.137   0.330  16.977
  861   HG22  THR  47          HG22      THR  47  -4.323   1.386  17.752
  862   HG23  THR  47          HG23      THR  47  -4.030   1.511  16.017
  863    H    GLN  48           H        GLN  48  -7.457   2.851  16.407
  864    HA   GLN  48           HA       GLN  48  -7.390   3.529  13.667
  865    HB2  GLN  48           HB2      GLN  48  -7.578   5.918  14.474
  866    HB3  GLN  48           HB3      GLN  48  -8.803   4.820  15.099
  867    HG2  GLN  48           HG2      GLN  48  -7.672   4.723  17.262
  868    HG3  GLN  48           HG3      GLN  48  -6.346   5.709  16.650
  869   HE21  GLN  48          HE21      GLN  48  -6.702   7.943  16.320
  870   HE22  GLN  48          HE22      GLN  48  -8.050   8.762  17.026
  871    H    LEU  49           H        LEU  49  -5.633   3.541  12.450
  872    HA   LEU  49           HA       LEU  49  -2.955   4.145  13.472
  873    HB2  LEU  49           HB2      LEU  49  -3.875   3.250  10.714
  874    HB3  LEU  49           HB3      LEU  49  -2.201   3.367  11.237
  875    HG   LEU  49           HG       LEU  49  -4.257   1.448  12.415
  876   HD11  LEU  49          HD11      LEU  49  -1.976   0.864  10.506
  877   HD12  LEU  49          HD12      LEU  49  -3.697   0.842  10.108
  878   HD13  LEU  49          HD13      LEU  49  -3.045  -0.330  11.252
  879   HD21  LEU  49          HD21      LEU  49  -1.263   1.638  12.936
  880   HD22  LEU  49          HD22      LEU  49  -2.345   0.390  13.560
  881   HD23  LEU  49          HD23      LEU  49  -2.548   2.062  14.075
  882    H    SER  50           H        SER  50  -1.494   5.408  11.865
  883    HA   SER  50           HA       SER  50  -2.760   7.941  11.010
  884    HB2  SER  50           HB2      SER  50  -0.775   8.123  12.479
  885    HB3  SER  50           HB3      SER  50   0.193   7.218  11.317
  886    HG   SER  50           HG       SER  50  -0.858   9.832  11.136
  887    H    GLN  51           H        GLN  51  -1.794   8.915   8.925
  888    HA   GLN  51           HA       GLN  51  -2.371   7.263   6.694
  889    HB2  GLN  51           HB2      GLN  51  -0.886   9.923   6.759
  890    HB3  GLN  51           HB3      GLN  51  -1.616   9.195   5.328
  891    HG2  GLN  51           HG2      GLN  51  -3.854   9.426   6.342
  892    HG3  GLN  51           HG3      GLN  51  -3.133  10.113   7.795
  893   HE21  GLN  51          HE21      GLN  51  -4.039  10.739   4.479
  894   HE22  GLN  51          HE22      GLN  51  -3.765  12.442   4.526
  895    H    VAL  52           H        VAL  52   0.737   8.377   8.063
  896    HA   VAL  52           HA       VAL  52   2.428   7.081   6.136
  897    HB   VAL  52           HB       VAL  52   3.299   7.799   8.974
  898   HG11  VAL  52          HG11      VAL  52   5.517   8.163   7.914
  899   HG12  VAL  52          HG12      VAL  52   4.843   7.710   6.346
  900   HG13  VAL  52          HG13      VAL  52   4.940   6.518   7.645
  901   HG21  VAL  52          HG21      VAL  52   2.171   9.780   8.104
  902   HG22  VAL  52          HG22      VAL  52   3.092   9.681   6.601
  903   HG23  VAL  52          HG23      VAL  52   3.920  10.056   8.115
  904    H    GLU  53           H        GLU  53   1.163   6.192   9.317
  905    HA   GLU  53           HA       GLU  53   2.497   3.802   9.847
  906    HB2  GLU  53           HB2      GLU  53   0.024   5.122  10.797
  907    HB3  GLU  53           HB3      GLU  53  -0.117   3.379  10.861
  908    HG2  GLU  53           HG2      GLU  53   2.193   4.881  12.119
  909    HG3  GLU  53           HG3      GLU  53   0.688   4.524  12.972
  910    H    ILE  54           H        ILE  54  -0.518   4.298   8.001
  911    HA   ILE  54           HA       ILE  54  -1.011   1.621   7.309
  912    HB   ILE  54           HB       ILE  54  -1.745   4.192   5.846
  913   HG12  ILE  54          HG12      ILE  54  -3.415   2.358   7.644
  914   HG13  ILE  54          HG13      ILE  54  -2.760   3.921   8.114
  915   HG21  ILE  54          HG21      ILE  54  -2.732   1.373   5.246
  916   HG22  ILE  54          HG22      ILE  54  -1.779   2.413   4.181
  917   HG23  ILE  54          HG23      ILE  54  -3.436   2.852   4.581
  918   HD11  ILE  54          HD11      ILE  54  -4.866   3.430   6.006
  919   HD12  ILE  54          HD12      ILE  54  -4.195   5.006   6.433
  920   HD13  ILE  54          HD13      ILE  54  -5.118   4.088   7.622
  921    H    LEU  55           H        LEU  55   0.824   4.149   5.494
  922    HA   LEU  55           HA       LEU  55   1.521   2.707   3.217
  923    HB2  LEU  55           HB2      LEU  55   3.124   4.802   4.720
  924    HB3  LEU  55           HB3      LEU  55   3.559   4.220   3.122
  925    HG   LEU  55           HG       LEU  55   0.994   5.709   3.800
  926   HD11  LEU  55          HD11      LEU  55   1.973   7.576   2.525
  927   HD12  LEU  55          HD12      LEU  55   3.473   6.665   2.331
  928   HD13  LEU  55          HD13      LEU  55   2.951   7.179   3.938
  929   HD21  LEU  55          HD21      LEU  55   0.638   5.785   1.360
  930   HD22  LEU  55          HD22      LEU  55   0.653   4.129   1.957
  931   HD23  LEU  55          HD23      LEU  55   2.065   4.773   1.114
  932    H    GLN  56           H        GLN  56   3.432   2.972   6.230
  933    HA   GLN  56           HA       GLN  56   5.541   1.238   5.414
  934    HB2  GLN  56           HB2      GLN  56   4.721   2.314   8.135
  935    HB3  GLN  56           HB3      GLN  56   6.138   1.288   7.912
  936    HG2  GLN  56           HG2      GLN  56   7.099   2.960   6.357
  937    HG3  GLN  56           HG3      GLN  56   5.684   3.986   6.589
  938   HE21  GLN  56          HE21      GLN  56   7.082   5.656   7.302
  939   HE22  GLN  56          HE22      GLN  56   7.784   5.638   8.875
  940    H    ARG  57           H        ARG  57   2.533   0.693   7.172
  941    HA   ARG  57           HA       ARG  57   3.095  -2.006   7.986
  942    HB2  ARG  57           HB2      ARG  57   1.480  -0.478   9.131
  943    HB3  ARG  57           HB3      ARG  57   0.412  -0.594   7.739
  944    HG2  ARG  57           HG2      ARG  57   0.034  -2.961   8.161
  945    HG3  ARG  57           HG3      ARG  57   1.248  -2.960   9.445
  946    HD2  ARG  57           HD2      ARG  57  -1.384  -1.451   9.466
  947    HD3  ARG  57           HD3      ARG  57  -1.004  -2.896  10.402
  948    HE   ARG  57           HE       ARG  57  -0.098  -0.171  10.912
  949   HH11  ARG  57          HH11      ARG  57   0.289  -3.505  11.790
  950   HH12  ARG  57          HH12      ARG  57   0.957  -3.113  13.335
  951   HH21  ARG  57          HH21      ARG  57   0.748   0.279  12.885
  952   HH22  ARG  57          HH22      ARG  57   1.208  -1.013  13.941
  953    H    VAL  58           H        VAL  58   1.665  -0.554   5.117
  954    HA   VAL  58           HA       VAL  58   0.700  -2.998   3.950
  955    HB   VAL  58           HB       VAL  58   1.254  -0.257   2.720
  956   HG11  VAL  58          HG11      VAL  58   0.069  -1.035   0.689
  957   HG12  VAL  58          HG12      VAL  58  -0.010  -2.669   1.357
  958   HG13  VAL  58          HG13      VAL  58   1.551  -1.952   0.960
  959   HG21  VAL  58          HG21      VAL  58  -0.681  -0.360   4.269
  960   HG22  VAL  58          HG22      VAL  58  -1.377  -1.678   3.326
  961   HG23  VAL  58          HG23      VAL  58  -1.209  -0.074   2.610
  962    H    ILE  59           H        ILE  59   3.694  -1.046   3.548
  963    HA   ILE  59           HA       ILE  59   5.111  -2.687   1.767
  964    HB   ILE  59           HB       ILE  59   6.226  -1.133   4.156
  965   HG12  ILE  59          HG12      ILE  59   6.071  -0.235   1.234
  966   HG13  ILE  59          HG13      ILE  59   4.912   0.242   2.469
  967   HG21  ILE  59          HG21      ILE  59   8.400  -1.130   2.947
  968   HG22  ILE  59          HG22      ILE  59   7.705  -2.166   1.699
  969   HG23  ILE  59          HG23      ILE  59   7.880  -2.769   3.346
  970   HD11  ILE  59          HD11      ILE  59   7.859   0.878   2.487
  971   HD12  ILE  59          HD12      ILE  59   6.682   1.375   3.707
  972   HD13  ILE  59          HD13      ILE  59   6.551   1.980   2.056
  973    H    ASP  60           H        ASP  60   5.063  -2.784   5.338
  974    HA   ASP  60           HA       ASP  60   6.597  -5.093   5.779
  975    HB2  ASP  60           HB2      ASP  60   6.136  -3.439   7.534
  976    HB3  ASP  60           HB3      ASP  60   4.417  -3.804   7.472
  977    H    TYR  61           H        TYR  61   3.124  -4.721   5.171
  978    HA   TYR  61           HA       TYR  61   2.245  -7.358   5.668
  979    HB2  TYR  61           HB2      TYR  61   0.571  -5.654   5.440
  980    HB3  TYR  61           HB3      TYR  61   1.193  -5.136   3.879
  981    HD1  TYR  61           HD1      TYR  61  -0.460  -8.066   5.555
  982    HD2  TYR  61           HD2      TYR  61   0.196  -5.972   1.877
  983    HE1  TYR  61           HE1      TYR  61  -2.069  -9.529   4.423
  984    HE2  TYR  61           HE2      TYR  61  -1.435  -7.432   0.768
  985    HH   TYR  61           HH       TYR  61  -2.337  -9.803   1.142
  986    H    ILE  62           H        ILE  62   3.322  -5.811   2.633
  987    HA   ILE  62           HA       ILE  62   3.091  -8.106   0.975
  988    HB   ILE  62           HB       ILE  62   4.877  -5.659   0.591
  989   HG12  ILE  62          HG12      ILE  62   2.072  -6.145  -0.546
  990   HG13  ILE  62          HG13      ILE  62   2.395  -5.141   0.860
  991   HG21  ILE  62          HG21      ILE  62   3.901  -7.694  -1.452
  992   HG22  ILE  62          HG22      ILE  62   5.561  -7.516  -0.873
  993   HG23  ILE  62          HG23      ILE  62   4.817  -6.231  -1.823
  994   HD11  ILE  62          HD11      ILE  62   3.380  -4.624  -1.949
  995   HD12  ILE  62          HD12      ILE  62   3.716  -3.615  -0.541
  996   HD13  ILE  62          HD13      ILE  62   2.062  -3.792  -1.125
  997    H    LEU  63           H        LEU  63   5.788  -6.786   2.882
  998    HA   LEU  63           HA       LEU  63   7.787  -8.670   2.126
  999    HB2  LEU  63           HB2      LEU  63   7.554  -6.992   4.655
 1000    HB3  LEU  63           HB3      LEU  63   8.994  -7.867   4.157
 1001    HG   LEU  63           HG       LEU  63   7.756  -5.498   2.701
 1002   HD11  LEU  63          HD11      LEU  63   9.799  -4.289   3.352
 1003   HD12  LEU  63          HD12      LEU  63  10.342  -5.699   4.267
 1004   HD13  LEU  63          HD13      LEU  63   8.884  -4.835   4.758
 1005   HD21  LEU  63          HD21      LEU  63  10.257  -7.056   1.971
 1006   HD22  LEU  63          HD22      LEU  63   9.696  -5.575   1.192
 1007   HD23  LEU  63          HD23      LEU  63   8.737  -7.049   1.071
 1008    H    ASP  64           H        ASP  64   5.232  -8.707   4.557
 1009    HA   ASP  64           HA       ASP  64   6.042 -11.027   6.000
 1010    HB2  ASP  64           HB2      ASP  64   4.391  -9.393   6.875
 1011    HB3  ASP  64           HB3      ASP  64   3.261  -9.841   5.604
 1012    H    LEU  65           H        LEU  65   4.095 -10.527   3.091
 1013    HA   LEU  65           HA       LEU  65   3.309 -13.257   2.673
 1014    HB2  LEU  65           HB2      LEU  65   3.533 -10.991   0.653
 1015    HB3  LEU  65           HB3      LEU  65   2.629 -12.485   0.433
 1016    HG   LEU  65           HG       LEU  65   1.985 -10.323   2.477
 1017   HD11  LEU  65          HD11      LEU  65   1.506  -9.565   0.220
 1018   HD12  LEU  65          HD12      LEU  65   0.012  -9.854   1.105
 1019   HD13  LEU  65          HD13      LEU  65   0.561 -11.024  -0.096
 1020   HD21  LEU  65          HD21      LEU  65  -0.090 -11.575   2.906
 1021   HD22  LEU  65          HD22      LEU  65   1.336 -12.523   3.321
 1022   HD23  LEU  65          HD23      LEU  65   0.457 -12.864   1.829
 1023    H    GLN  66           H        GLN  66   6.030 -11.276   1.677
 1024    HA   GLN  66           HA       GLN  66   7.207 -13.307  -0.079
 1025    HB2  GLN  66           HB2      GLN  66   8.114 -10.496   0.671
 1026    HB3  GLN  66           HB3      GLN  66   8.939 -11.525  -0.498
 1027    HG2  GLN  66           HG2      GLN  66   7.066 -11.447  -2.013
 1028    HG3  GLN  66           HG3      GLN  66   6.045 -10.669  -0.808
 1029   HE21  GLN  66          HE21      GLN  66   8.049  -8.754   0.069
 1030   HE22  GLN  66          HE22      GLN  66   8.221  -7.613  -1.206
 1031    H    VAL  67           H        VAL  67   9.572 -13.830   0.140
 1032    HA   VAL  67           HA       VAL  67  10.265 -14.583   2.883
 1033    HB   VAL  67           HB       VAL  67  11.779 -15.158   0.290
 1034   HG11  VAL  67          HG11      VAL  67  13.225 -15.361   2.274
 1035   HG12  VAL  67          HG12      VAL  67  12.921 -16.947   1.565
 1036   HG13  VAL  67          HG13      VAL  67  12.065 -16.457   3.030
 1037   HG21  VAL  67          HG21      VAL  67   9.525 -16.144   0.205
 1038   HG22  VAL  67          HG22      VAL  67   9.785 -16.927   1.765
 1039   HG23  VAL  67          HG23      VAL  67  10.745 -17.409   0.365
 1040    H    VAL  68           H        VAL  68  11.027 -12.861   4.026
 1041    HA   VAL  68           HA       VAL  68  13.213 -11.193   2.895
 1042    HB   VAL  68           HB       VAL  68  12.492  -9.362   4.429
 1043   HG11  VAL  68          HG11      VAL  68  10.505  -8.664   3.150
 1044   HG12  VAL  68          HG12      VAL  68  10.313 -10.304   2.527
 1045   HG13  VAL  68          HG13      VAL  68  11.738  -9.353   2.093
 1046   HG21  VAL  68          HG21      VAL  68  10.070 -11.116   5.030
 1047   HG22  VAL  68          HG22      VAL  68  10.281  -9.439   5.540
 1048   HG23  VAL  68          HG23      VAL  68  11.350 -10.690   6.172
  Start of MODEL   12
    1    H1   MET   1           H1       MET   1  17.781 -35.015  23.105
    2    H2   MET   1           H2       MET   1  19.224 -34.168  22.876
    3    H3   MET   1           H3       MET   1  18.433 -34.857  21.552
    4    HA   MET   1           HA       MET   1  16.578 -33.379  21.832
    5    HB2  MET   1           HB2      MET   1  18.247 -32.156  24.074
    6    HB3  MET   1           HB3      MET   1  16.737 -31.489  23.460
    7    HG2  MET   1           HG2      MET   1  16.298 -32.612  25.533
    8    HG3  MET   1           HG3      MET   1  15.574 -33.563  24.235
    9    HE1  MET   1           HE1      MET   1  15.366 -35.615  26.049
   10    HE2  MET   1           HE2      MET   1  16.151 -34.611  27.270
   11    HE3  MET   1           HE3      MET   1  16.756 -36.234  26.942
   12    H    GLY   2           H        GLY   2  16.603 -31.804  20.279
   13    HA2  GLY   2           HA2      GLY   2  18.630 -29.844  19.890
   14    HA3  GLY   2           HA3      GLY   2  18.893 -31.185  18.779
   15    H    HIS   3           H        HIS   3  16.723 -28.565  19.681
   16    HA   HIS   3           HA       HIS   3  15.515 -28.520  17.011
   17    HB2  HIS   3           HB2      HIS   3  13.198 -28.523  17.845
   18    HB3  HIS   3           HB3      HIS   3  14.011 -30.013  18.298
   19    HD2  HIS   3           HD2      HIS   3  15.006 -29.849  21.129
   20    HE1  HIS   3           HE1      HIS   3  11.642 -27.504  22.159
   21    HE2  HIS   3           HE2      HIS   3  13.652 -28.755  23.042
   22    H    HIS   4           H        HIS   4  14.514 -26.554  16.457
   23    HA   HIS   4           HA       HIS   4  14.997 -24.237  18.234
   24    HB2  HIS   4           HB2      HIS   4  14.661 -24.408  15.212
   25    HB3  HIS   4           HB3      HIS   4  14.611 -22.878  16.084
   26    HD2  HIS   4           HD2      HIS   4  17.107 -22.417  17.618
   27    HE1  HIS   4           HE1      HIS   4  19.340 -24.495  14.692
   28    HE2  HIS   4           HE2      HIS   4  19.427 -22.756  16.518
   29    H    HIS   5           H        HIS   5  13.372 -22.827  18.723
   30    HA   HIS   5           HA       HIS   5  10.659 -23.785  18.833
   31    HB2  HIS   5           HB2      HIS   5  10.219 -21.684  20.091
   32    HB3  HIS   5           HB3      HIS   5  11.632 -22.526  20.712
   33    HD2  HIS   5           HD2      HIS   5  14.157 -21.329  19.820
   34    HE1  HIS   5           HE1      HIS   5  12.336 -17.556  19.301
   35    HE2  HIS   5           HE2      HIS   5  14.507 -18.832  19.268
   36    H    HIS   6           H        HIS   6   8.822 -22.103  18.332
   37    HA   HIS   6           HA       HIS   6   9.185 -20.706  15.766
   38    HB2  HIS   6           HB2      HIS   6   8.581 -23.008  15.126
   39    HB3  HIS   6           HB3      HIS   6   7.185 -22.971  16.197
   40    HD2  HIS   6           HD2      HIS   6   8.345 -21.164  12.864
   41    HE1  HIS   6           HE1      HIS   6   4.123 -21.209  13.107
   42    HE2  HIS   6           HE2      HIS   6   6.116 -20.456  11.756
   43    H    HIS   7           H        HIS   7   8.020 -18.879  15.649
   44    HA   HIS   7           HA       HIS   7   5.928 -18.247  17.634
   45    HB2  HIS   7           HB2      HIS   7   7.333 -16.408  15.637
   46    HB3  HIS   7           HB3      HIS   7   6.215 -15.900  16.903
   47    HD2  HIS   7           HD2      HIS   7   7.261 -16.469  19.601
   48    HE1  HIS   7           HE1      HIS   7  11.238 -16.140  18.207
   49    HE2  HIS   7           HE2      HIS   7   9.730 -15.993  20.223
   50    H    HIS   8           H        HIS   8   3.865 -17.600  17.016
   51    HA   HIS   8           HA       HIS   8   2.968 -17.567  14.271
   52    HB2  HIS   8           HB2      HIS   8   1.321 -19.470  14.617
   53    HB3  HIS   8           HB3      HIS   8   3.002 -19.963  14.499
   54    HD2  HIS   8           HD2      HIS   8   4.181 -20.681  17.085
   55    HE1  HIS   8           HE1      HIS   8   0.382 -21.502  18.750
   56    HE2  HIS   8           HE2      HIS   8   2.876 -21.617  19.119
   57    H    SER   9           H        SER   9   2.115 -15.553  14.641
   58    HA   SER   9           HA       SER   9  -0.383 -15.381  16.185
   59    HB2  SER   9           HB2      SER   9   0.301 -13.184  17.191
   60    HB3  SER   9           HB3      SER   9   1.285 -14.524  17.769
   61    HG   SER   9           HG       SER   9   2.069 -12.818  15.633
   62    H    HIS  10           H        HIS  10  -1.905 -14.612  14.838
   63    HA   HIS  10           HA       HIS  10  -1.360 -12.443  12.947
   64    HB2  HIS  10           HB2      HIS  10  -0.775 -14.449  11.650
   65    HB3  HIS  10           HB3      HIS  10  -2.308 -15.202  12.060
   66    HD1  HIS  10           HD1      HIS  10  -3.897 -15.127  10.155
   67    HD2  HIS  10           HD2      HIS  10  -1.348 -11.843  10.141
   68    HE1  HIS  10           HE1      HIS  10  -4.504 -13.810   8.114
   69    HE2  HIS  10           HE2      HIS  10  -2.904 -11.885   8.088
   70    H    MET  11           H        MET  11  -2.826 -11.111  13.941
   71    HA   MET  11           HA       MET  11  -5.643 -11.518  13.494
   72    HB2  MET  11           HB2      MET  11  -5.309 -12.829  15.604
   73    HB3  MET  11           HB3      MET  11  -4.680 -11.393  16.393
   74    HG2  MET  11           HG2      MET  11  -6.879 -10.299  16.144
   75    HG3  MET  11           HG3      MET  11  -7.504 -11.746  15.349
   76    HE1  MET  11           HE1      MET  11  -9.521 -11.701  17.218
   77    HE2  MET  11           HE2      MET  11  -8.777 -10.309  18.008
   78    HE3  MET  11           HE3      MET  11  -9.208 -11.733  18.953
   79    H    GLY  12           H        GLY  12  -5.635  -9.591  12.391
   80    HA2  GLY  12           HA2      GLY  12  -5.147  -7.082  13.935
   81    HA3  GLY  12           HA3      GLY  12  -5.001  -7.231  12.187
   82    H    GLY  13           H        GLY  13  -6.472  -5.335  12.272
   83    HA2  GLY  13           HA2      GLY  13  -8.494  -4.543  11.497
   84    HA3  GLY  13           HA3      GLY  13  -9.181  -6.146  11.658
   85    H    GLY  14           H        GLY  14  -9.996  -3.272  12.492
   86    HA2  GLY  14           HA2      GLY  14 -11.759  -3.810  14.491
   87    HA3  GLY  14           HA3      GLY  14 -10.292  -3.398  15.371
   88    H    LYS  15           H        LYS  15 -11.854  -1.765  16.179
   89    HA   LYS  15           HA       LYS  15 -11.915   0.708  14.538
   90    HB2  LYS  15           HB2      LYS  15 -14.005  -0.327  16.514
   91    HB3  LYS  15           HB3      LYS  15 -14.064   1.255  15.738
   92    HG2  LYS  15           HG2      LYS  15 -14.364   0.254  13.557
   93    HG3  LYS  15           HG3      LYS  15 -14.079  -1.363  14.203
   94    HD2  LYS  15           HD2      LYS  15 -16.159  -1.229  15.513
   95    HD3  LYS  15           HD3      LYS  15 -16.437   0.419  14.937
   96    HE2  LYS  15           HE2      LYS  15 -16.717  -0.381  12.656
   97    HE3  LYS  15           HE3      LYS  15 -16.280  -2.022  13.134
   98    HZ1  LYS  15           HZ1      LYS  15 -18.258  -2.132  14.484
   99    HZ2  LYS  15           HZ2      LYS  15 -18.667  -1.733  12.892
  100    HZ3  LYS  15           HZ3      LYS  15 -18.662  -0.538  14.086
  101    H    GLY  16           H        GLY  16 -10.707   2.300  15.441
  102    HA2  GLY  16           HA2      GLY  16 -10.666   2.687  18.372
  103    HA3  GLY  16           HA3      GLY  16  -9.131   2.511  17.529
  104    HA   PRO  17           HA       PRO  17 -10.356   7.074  17.456
  105    HB2  PRO  17           HB2      PRO  17  -8.305   8.096  18.943
  106    HB3  PRO  17           HB3      PRO  17  -9.779   7.458  19.685
  107    HG2  PRO  17           HG2      PRO  17  -7.089   6.143  19.373
  108    HG3  PRO  17           HG3      PRO  17  -8.177   6.147  20.778
  109    HD2  PRO  17           HD2      PRO  17  -8.006   4.051  18.994
  110    HD3  PRO  17           HD3      PRO  17  -9.467   4.410  19.936
  111    H    ALA  18           H        ALA  18  -9.851   7.783  15.434
  112    HA   ALA  18           HA       ALA  18  -7.799   6.794  13.811
  113    HB1  ALA  18           HB1      ALA  18  -9.899   7.750  12.943
  114    HB2  ALA  18           HB2      ALA  18  -8.491   8.457  12.151
  115    HB3  ALA  18           HB3      ALA  18  -9.358   9.368  13.392
  116    H    ALA  19           H        ALA  19  -5.714   7.003  14.453
  117    HA   ALA  19           HA       ALA  19  -4.615   9.498  15.507
  118    HB1  ALA  19           HB1      ALA  19  -3.279   6.799  15.073
  119    HB2  ALA  19           HB2      ALA  19  -4.028   7.345  16.572
  120    HB3  ALA  19           HB3      ALA  19  -2.593   8.166  15.955
  121    H    GLU  20           H        GLU  20  -4.538  10.932  13.754
  122    HA   GLU  20           HA       GLU  20  -2.584  10.339  11.605
  123    HB2  GLU  20           HB2      GLU  20  -5.187  11.878  11.226
  124    HB3  GLU  20           HB3      GLU  20  -3.944  11.647  10.004
  125    HG2  GLU  20           HG2      GLU  20  -4.404   9.112  10.296
  126    HG3  GLU  20           HG3      GLU  20  -5.871   9.612  11.133
  127    H    GLU  21           H        GLU  21  -1.530  12.175  10.676
  128    HA   GLU  21           HA       GLU  21  -1.854  14.814  11.878
  129    HB2  GLU  21           HB2      GLU  21   0.515  15.088  12.438
  130    HB3  GLU  21           HB3      GLU  21  -0.129  13.698  13.304
  131    HG2  GLU  21           HG2      GLU  21   0.912  12.195  11.595
  132    HG3  GLU  21           HG3      GLU  21   1.616  13.611  10.818
  133    HA   PRO  22           HA       PRO  22  -1.098  15.882   7.560
  134    HB2  PRO  22           HB2      PRO  22  -0.745  18.557   7.714
  135    HB3  PRO  22           HB3      PRO  22  -2.290  17.816   8.160
  136    HG2  PRO  22           HG2      PRO  22  -0.024  18.685   9.962
  137    HG3  PRO  22           HG3      PRO  22  -1.761  19.039  10.111
  138    HD2  PRO  22           HD2      PRO  22  -0.542  17.018  11.498
  139    HD3  PRO  22           HD3      PRO  22  -2.243  16.934  10.989
  140    H    LEU  23           H        LEU  23   0.496  17.345   6.192
  141    HA   LEU  23           HA       LEU  23   3.156  16.360   6.433
  142    HB2  LEU  23           HB2      LEU  23   2.112  18.650   4.710
  143    HB3  LEU  23           HB3      LEU  23   3.669  17.864   4.514
  144    HG   LEU  23           HG       LEU  23   0.967  16.514   4.112
  145   HD11  LEU  23          HD11      LEU  23   2.985  17.401   2.021
  146   HD12  LEU  23          HD12      LEU  23   1.417  18.147   2.335
  147   HD13  LEU  23          HD13      LEU  23   1.494  16.501   1.713
  148   HD21  LEU  23          HD21      LEU  23   3.763  15.413   3.624
  149   HD22  LEU  23          HD22      LEU  23   2.249  14.601   3.216
  150   HD23  LEU  23          HD23      LEU  23   2.653  14.907   4.901
  151    H    SER  24           H        SER  24   4.117  16.934   8.326
  152    HA   SER  24           HA       SER  24   4.700  19.800   8.862
  153    HB2  SER  24           HB2      SER  24   2.947  19.007  10.429
  154    HB3  SER  24           HB3      SER  24   3.975  17.664  10.923
  155    HG   SER  24           HG       SER  24   4.122  20.367  11.571
  156    H    LEU  25           H        LEU  25   5.618  16.456   9.694
  157    HA   LEU  25           HA       LEU  25   8.383  17.071  10.263
  158    HB2  LEU  25           HB2      LEU  25   8.685  14.742  10.733
  159    HB3  LEU  25           HB3      LEU  25   7.152  15.222  11.427
  160    HG   LEU  25           HG       LEU  25   7.401  13.684   8.801
  161   HD11  LEU  25          HD11      LEU  25   6.809  11.649  10.041
  162   HD12  LEU  25          HD12      LEU  25   6.831  12.548  11.561
  163   HD13  LEU  25          HD13      LEU  25   8.319  12.333  10.638
  164   HD21  LEU  25          HD21      LEU  25   5.259  14.883   9.008
  165   HD22  LEU  25          HD22      LEU  25   4.960  14.109  10.566
  166   HD23  LEU  25          HD23      LEU  25   5.024  13.139   9.092
  167    H    LEU  26           H        LEU  26  10.005  15.331   9.185
  168    HA   LEU  26           HA       LEU  26  10.363  16.040   6.436
  169    HB2  LEU  26           HB2      LEU  26  12.123  15.491   8.247
  170    HB3  LEU  26           HB3      LEU  26  11.807  13.804   7.916
  171    HG   LEU  26           HG       LEU  26  12.734  15.676   5.697
  172   HD11  LEU  26          HD11      LEU  26  14.564  14.167   7.600
  173   HD12  LEU  26          HD12      LEU  26  14.363  15.919   7.521
  174   HD13  LEU  26          HD13      LEU  26  15.069  15.057   6.156
  175   HD21  LEU  26          HD21      LEU  26  13.662  13.624   4.689
  176   HD22  LEU  26          HD22      LEU  26  11.929  13.470   4.958
  177   HD23  LEU  26          HD23      LEU  26  13.061  12.669   6.049
  178    H    ASP  27           H        ASP  27  10.137  14.784   4.561
  179    HA   ASP  27           HA       ASP  27   7.939  13.050   4.326
  180    HB2  ASP  27           HB2      ASP  27  10.208  13.610   2.387
  181    HB3  ASP  27           HB3      ASP  27   8.752  12.699   1.967
  182    H    ASP  28           H        ASP  28   8.305  11.347   5.860
  183    HA   ASP  28           HA       ASP  28   9.945   9.088   5.086
  184    HB2  ASP  28           HB2      ASP  28   9.114   9.462   7.433
  185    HB3  ASP  28           HB3      ASP  28   7.461   9.224   6.876
  186    H    MET  29           H        MET  29   6.797  10.395   4.340
  187    HA   MET  29           HA       MET  29   5.321   8.249   3.395
  188    HB2  MET  29           HB2      MET  29   5.225  11.042   2.182
  189    HB3  MET  29           HB3      MET  29   3.937   9.846   2.194
  190    HG2  MET  29           HG2      MET  29   4.158  10.089   4.812
  191    HG3  MET  29           HG3      MET  29   4.895  11.633   4.391
  192    HE1  MET  29           HE1      MET  29   1.727   9.381   4.228
  193    HE2  MET  29           HE2      MET  29   1.965   9.695   2.505
  194    HE3  MET  29           HE3      MET  29   0.575  10.387   3.345
  195    H    ASN  30           H        ASN  30   7.401  10.450   1.529
  196    HA   ASN  30           HA       ASN  30   6.865   9.351  -1.035
  197    HB2  ASN  30           HB2      ASN  30   8.955  11.278   0.041
  198    HB3  ASN  30           HB3      ASN  30   8.926  10.804  -1.667
  199   HD21  ASN  30          HD21      ASN  30   7.260  12.587   0.833
  200   HD22  ASN  30          HD22      ASN  30   6.180  13.415  -0.218
  201    H    HIS  31           H        HIS  31   9.379   8.644   1.346
  202    HA   HIS  31           HA       HIS  31  10.961   6.923  -0.328
  203    HB2  HIS  31           HB2      HIS  31  10.747   7.141   2.702
  204    HB3  HIS  31           HB3      HIS  31  11.892   6.080   1.882
  205    HD2  HIS  31           HD2      HIS  31  11.169   9.983   1.893
  206    HE1  HIS  31           HE1      HIS  31  15.306   9.254   1.480
  207    HE2  HIS  31           HE2      HIS  31  13.544  10.989   1.955
  208    H    CYS  32           H        CYS  32   8.334   6.348   2.021
  209    HA   CYS  32           HA       CYS  32   8.104   3.552   1.752
  210    HB2  CYS  32           HB2      CYS  32   5.964   5.613   2.412
  211    HB3  CYS  32           HB3      CYS  32   5.730   3.870   2.546
  212    HG   CYS  32           HG       CYS  32   7.239   5.976   4.623
  213    H    TYR  33           H        TYR  33   6.602   6.176  -0.130
  214    HA   TYR  33           HA       TYR  33   4.963   4.641  -1.835
  215    HB2  TYR  33           HB2      TYR  33   6.124   7.423  -1.991
  216    HB3  TYR  33           HB3      TYR  33   5.347   6.758  -3.423
  217    HD1  TYR  33           HD1      TYR  33   3.041   5.369  -2.548
  218    HD2  TYR  33           HD2      TYR  33   4.653   8.990  -0.949
  219    HE1  TYR  33           HE1      TYR  33   0.812   6.044  -1.836
  220    HE2  TYR  33           HE2      TYR  33   2.403   9.656  -0.205
  221    HH   TYR  33           HH       TYR  33   0.073   9.189  -0.768
  222    H    SER  34           H        SER  34   8.336   5.692  -2.186
  223    HA   SER  34           HA       SER  34   8.852   4.613  -4.748
  224    HB2  SER  34           HB2      SER  34  10.761   5.054  -2.413
  225    HB3  SER  34           HB3      SER  34  11.258   4.718  -4.077
  226    HG   SER  34           HG       SER  34  10.624   7.062  -2.991
  227    H    ARG  35           H        ARG  35   9.271   3.229  -1.489
  228    HA   ARG  35           HA       ARG  35  10.277   0.697  -2.186
  229    HB2  ARG  35           HB2      ARG  35  10.290   1.890   0.076
  230    HB3  ARG  35           HB3      ARG  35   8.637   1.323   0.293
  231    HG2  ARG  35           HG2      ARG  35   9.291  -0.916   0.472
  232    HG3  ARG  35           HG3      ARG  35  10.807  -0.649  -0.385
  233    HD2  ARG  35           HD2      ARG  35  11.337  -1.040   1.896
  234    HD3  ARG  35           HD3      ARG  35  11.621   0.665   1.595
  235    HE   ARG  35           HE       ARG  35   9.233  -0.389   2.993
  236   HH11  ARG  35          HH11      ARG  35  11.599   2.093   2.672
  237   HH12  ARG  35          HH12      ARG  35  11.092   2.907   4.108
  238   HH21  ARG  35          HH21      ARG  35   8.591   0.684   4.829
  239   HH22  ARG  35          HH22      ARG  35   9.409   2.131   5.303
  240    H    LEU  36           H        LEU  36   6.948   1.896  -1.936
  241    HA   LEU  36           HA       LEU  36   5.549  -0.555  -2.291
  242    HB2  LEU  36           HB2      LEU  36   4.761   2.306  -2.985
  243    HB3  LEU  36           HB3      LEU  36   3.660   0.942  -3.117
  244    HG   LEU  36           HG       LEU  36   4.940   1.892  -0.526
  245   HD11  LEU  36          HD11      LEU  36   2.748   2.745   0.105
  246   HD12  LEU  36          HD12      LEU  36   2.104   2.305  -1.478
  247   HD13  LEU  36          HD13      LEU  36   3.353   3.545  -1.345
  248   HD21  LEU  36          HD21      LEU  36   4.462  -0.519  -0.470
  249   HD22  LEU  36          HD22      LEU  36   2.792  -0.215  -0.959
  250   HD23  LEU  36          HD23      LEU  36   3.377   0.362   0.603
  251    H    ARG  37           H        ARG  37   6.391   2.020  -4.657
  252    HA   ARG  37           HA       ARG  37   5.518   0.853  -7.017
  253    HB2  ARG  37           HB2      ARG  37   7.763   2.798  -6.492
  254    HB3  ARG  37           HB3      ARG  37   7.308   2.317  -8.128
  255    HG2  ARG  37           HG2      ARG  37   5.039   3.168  -7.798
  256    HG3  ARG  37           HG3      ARG  37   5.410   3.580  -6.119
  257    HD2  ARG  37           HD2      ARG  37   5.459   5.538  -7.585
  258    HD3  ARG  37           HD3      ARG  37   7.035   5.232  -6.857
  259    HE   ARG  37           HE       ARG  37   7.010   3.982  -9.350
  260   HH11  ARG  37          HH11      ARG  37   6.910   7.242  -8.162
  261   HH12  ARG  37          HH12      ARG  37   7.639   7.876  -9.592
  262   HH21  ARG  37          HH21      ARG  37   7.956   4.830 -11.129
  263   HH22  ARG  37          HH22      ARG  37   8.231   6.532 -11.241
  264    H    GLU  38           H        GLU  38   8.342   0.035  -5.187
  265    HA   GLU  38           HA       GLU  38   9.767  -1.377  -7.304
  266    HB2  GLU  38           HB2      GLU  38  10.247  -1.123  -4.305
  267    HB3  GLU  38           HB3      GLU  38  11.302  -2.038  -5.379
  268    HG2  GLU  38           HG2      GLU  38  11.920  -0.028  -6.593
  269    HG3  GLU  38           HG3      GLU  38  10.726   0.922  -5.710
  270    H    LEU  39           H        LEU  39   7.604  -2.171  -4.635
  271    HA   LEU  39           HA       LEU  39   7.863  -5.075  -5.050
  272    HB2  LEU  39           HB2      LEU  39   6.270  -3.517  -2.978
  273    HB3  LEU  39           HB3      LEU  39   6.456  -5.264  -3.011
  274    HG   LEU  39           HG       LEU  39   8.716  -3.268  -2.557
  275   HD11  LEU  39          HD11      LEU  39   7.361  -5.102  -0.558
  276   HD12  LEU  39          HD12      LEU  39   7.202  -3.347  -0.634
  277   HD13  LEU  39          HD13      LEU  39   8.759  -4.069  -0.238
  278   HD21  LEU  39          HD21      LEU  39   8.798  -6.310  -2.455
  279   HD22  LEU  39          HD22      LEU  39  10.121  -5.221  -2.030
  280   HD23  LEU  39          HD23      LEU  39   9.543  -5.289  -3.691
  281    H    VAL  40           H        VAL  40   5.869  -2.545  -6.155
  282    HA   VAL  40           HA       VAL  40   3.509  -4.257  -6.639
  283    HB   VAL  40           HB       VAL  40   3.828  -1.230  -6.963
  284   HG11  VAL  40          HG11      VAL  40   1.322  -2.926  -7.327
  285   HG12  VAL  40          HG12      VAL  40   2.198  -2.069  -8.597
  286   HG13  VAL  40          HG13      VAL  40   1.374  -1.158  -7.332
  287   HG21  VAL  40          HG21      VAL  40   2.313  -2.831  -4.855
  288   HG22  VAL  40          HG22      VAL  40   2.300  -1.069  -5.008
  289   HG23  VAL  40          HG23      VAL  40   3.800  -1.906  -4.607
  290    HA   PRO  41           HA       PRO  41   5.100  -4.454 -10.992
  291    HB2  PRO  41           HB2      PRO  41   3.781  -6.719 -11.725
  292    HB3  PRO  41           HB3      PRO  41   5.253  -6.774 -10.741
  293    HG2  PRO  41           HG2      PRO  41   2.376  -6.939  -9.846
  294    HG3  PRO  41           HG3      PRO  41   3.754  -7.955  -9.365
  295    HD2  PRO  41           HD2      PRO  41   2.861  -5.872  -7.833
  296    HD3  PRO  41           HD3      PRO  41   4.564  -6.367  -7.864
  297    H    GLY  42           H        GLY  42   2.027  -3.855  -9.636
  298    HA2  GLY  42           HA2      GLY  42   0.386  -3.555 -11.932
  299    HA3  GLY  42           HA3      GLY  42   0.156  -2.753 -10.388
  300    H    VAL  43           H        VAL  43   2.937  -1.547 -10.669
  301    HA   VAL  43           HA       VAL  43   2.290   0.870 -12.090
  302    HB   VAL  43           HB       VAL  43   4.982  -0.049 -10.960
  303   HG11  VAL  43          HG11      VAL  43   4.108   2.750 -11.792
  304   HG12  VAL  43          HG12      VAL  43   5.293   1.739 -12.620
  305   HG13  VAL  43          HG13      VAL  43   5.635   2.342 -10.999
  306   HG21  VAL  43          HG21      VAL  43   3.263   0.065  -9.204
  307   HG22  VAL  43          HG22      VAL  43   2.860   1.719  -9.672
  308   HG23  VAL  43          HG23      VAL  43   4.448   1.356  -8.992
  309    HA   PRO  44           HA       PRO  44   3.420  -1.079 -16.101
  310    HB2  PRO  44           HB2      PRO  44   2.748   1.610 -17.231
  311    HB3  PRO  44           HB3      PRO  44   2.082   0.019 -17.627
  312    HG2  PRO  44           HG2      PRO  44   0.646   1.784 -16.213
  313    HG3  PRO  44           HG3      PRO  44   0.584   0.049 -15.831
  314    HD2  PRO  44           HD2      PRO  44   2.134   2.239 -14.438
  315    HD3  PRO  44           HD3      PRO  44   1.157   0.932 -13.733
  316    H    ARG  45           H        ARG  45   5.265   1.191 -14.526
  317    HA   ARG  45           HA       ARG  45   7.364   1.986 -14.672
  318    HB2  ARG  45           HB2      ARG  45   7.689   0.357 -17.230
  319    HB3  ARG  45           HB3      ARG  45   8.987   1.074 -16.283
  320    HG2  ARG  45           HG2      ARG  45   7.153  -1.172 -15.386
  321    HG3  ARG  45           HG3      ARG  45   8.832  -1.337 -15.899
  322    HD2  ARG  45           HD2      ARG  45   9.567  -0.007 -13.955
  323    HD3  ARG  45           HD3      ARG  45   7.882   0.205 -13.454
  324    HE   ARG  45           HE       ARG  45   8.246  -2.516 -13.642
  325   HH11  ARG  45          HH11      ARG  45   9.750  -0.019 -11.756
  326   HH12  ARG  45          HH12      ARG  45  10.077  -1.095 -10.449
  327   HH21  ARG  45          HH21      ARG  45   8.695  -3.819 -11.954
  328   HH22  ARG  45          HH22      ARG  45   9.469  -3.188 -10.547
  329    H    GLY  46           H        GLY  46   8.070   4.001 -15.267
  330    HA2  GLY  46           HA2      GLY  46   8.154   6.028 -16.392
  331    HA3  GLY  46           HA3      GLY  46   7.480   5.243 -17.815
  332    H    THR  47           H        THR  47   5.214   4.842 -17.887
  333    HA   THR  47           HA       THR  47   3.021   5.153 -17.756
  334    HB   THR  47           HB       THR  47   3.179   3.496 -16.067
  335    HG1  THR  47           HG1      THR  47   1.392   5.439 -14.979
  336   HG21  THR  47          HG21      THR  47   3.307   3.959 -13.635
  337   HG22  THR  47          HG22      THR  47   3.570   5.667 -13.987
  338   HG23  THR  47          HG23      THR  47   4.774   4.476 -14.480
  339    H    GLN  48           H        GLN  48   4.116   7.266 -15.065
  340    HA   GLN  48           HA       GLN  48   3.614   9.356 -14.415
  341    HB2  GLN  48           HB2      GLN  48   3.084  10.084 -16.738
  342    HB3  GLN  48           HB3      GLN  48   1.446   9.471 -16.553
  343    HG2  GLN  48           HG2      GLN  48   1.116  11.129 -14.679
  344    HG3  GLN  48           HG3      GLN  48   2.706  11.787 -15.054
  345   HE21  GLN  48          HE21      GLN  48  -0.594  11.462 -16.171
  346   HE22  GLN  48          HE22      GLN  48  -0.504  12.680 -17.390
  347    H    LEU  49           H        LEU  49   3.084   8.504 -12.486
  348    HA   LEU  49           HA       LEU  49   0.210   8.250 -11.801
  349    HB2  LEU  49           HB2      LEU  49   2.521   6.629 -10.648
  350    HB3  LEU  49           HB3      LEU  49   0.876   6.593 -10.028
  351    HG   LEU  49           HG       LEU  49   1.687   5.681 -12.818
  352   HD11  LEU  49          HD11      LEU  49   1.352   3.381 -12.004
  353   HD12  LEU  49          HD12      LEU  49   1.086   3.993 -10.370
  354   HD13  LEU  49          HD13      LEU  49   2.660   4.192 -11.146
  355   HD21  LEU  49          HD21      LEU  49  -0.559   4.703 -12.954
  356   HD22  LEU  49          HD22      LEU  49  -0.649   6.447 -12.731
  357   HD23  LEU  49          HD23      LEU  49  -0.968   5.368 -11.369
  358    H    SER  50           H        SER  50  -0.380   9.717 -10.287
  359    HA   SER  50           HA       SER  50   1.581  11.285  -8.788
  360    HB2  SER  50           HB2      SER  50  -1.466  11.415  -8.778
  361    HB3  SER  50           HB3      SER  50  -0.370  12.611  -8.078
  362    HG   SER  50           HG       SER  50  -0.922  12.035 -10.766
  363    H    GLN  51           H        GLN  51   0.770  11.769  -6.353
  364    HA   GLN  51           HA       GLN  51   1.439   9.665  -4.687
  365    HB2  GLN  51           HB2      GLN  51  -0.330  12.073  -4.082
  366    HB3  GLN  51           HB3      GLN  51   0.326  11.022  -2.835
  367    HG2  GLN  51           HG2      GLN  51   2.081  12.536  -4.785
  368    HG3  GLN  51           HG3      GLN  51   1.541  13.218  -3.253
  369   HE21  GLN  51          HE21      GLN  51   2.417  12.413  -1.324
  370   HE22  GLN  51          HE22      GLN  51   3.819  11.409  -1.299
  371    H    VAL  52           H        VAL  52  -1.855  10.699  -5.534
  372    HA   VAL  52           HA       VAL  52  -3.278   8.750  -4.001
  373    HB   VAL  52           HB       VAL  52  -4.242  10.324  -6.442
  374   HG11  VAL  52          HG11      VAL  52  -5.732   8.450  -5.899
  375   HG12  VAL  52          HG12      VAL  52  -6.512   9.984  -5.513
  376   HG13  VAL  52          HG13      VAL  52  -5.832   8.990  -4.221
  377   HG21  VAL  52          HG21      VAL  52  -5.148  11.977  -4.829
  378   HG22  VAL  52          HG22      VAL  52  -3.393  11.864  -4.716
  379   HG23  VAL  52          HG23      VAL  52  -4.403  11.091  -3.494
  380    H    GLU  53           H        GLU  53  -2.175   8.871  -7.371
  381    HA   GLU  53           HA       GLU  53  -3.592   6.553  -8.286
  382    HB2  GLU  53           HB2      GLU  53  -1.258   8.051  -9.535
  383    HB3  GLU  53           HB3      GLU  53  -2.221   6.818 -10.352
  384    HG2  GLU  53           HG2      GLU  53  -4.232   8.223 -10.160
  385    HG3  GLU  53           HG3      GLU  53  -3.309   9.449  -9.288
  386    H    ILE  54           H        ILE  54  -0.385   7.020  -6.889
  387    HA   ILE  54           HA       ILE  54   0.701   4.450  -7.403
  388    HB   ILE  54           HB       ILE  54   1.180   6.346  -5.054
  389   HG12  ILE  54          HG12      ILE  54   2.864   5.834  -7.560
  390   HG13  ILE  54          HG13      ILE  54   1.876   7.259  -7.267
  391   HG21  ILE  54          HG21      ILE  54   2.743   3.826  -5.766
  392   HG22  ILE  54          HG22      ILE  54   1.794   4.113  -4.301
  393   HG23  ILE  54          HG23      ILE  54   3.264   5.037  -4.588
  394   HD11  ILE  54          HD11      ILE  54   4.334   6.433  -5.726
  395   HD12  ILE  54          HD12      ILE  54   3.327   7.837  -5.353
  396   HD13  ILE  54          HD13      ILE  54   4.200   7.757  -6.883
  397    H    LEU  55           H        LEU  55  -1.236   5.721  -4.679
  398    HA   LEU  55           HA       LEU  55  -1.503   3.457  -3.079
  399    HB2  LEU  55           HB2      LEU  55  -3.481   5.691  -3.629
  400    HB3  LEU  55           HB3      LEU  55  -3.695   4.505  -2.352
  401    HG   LEU  55           HG       LEU  55  -1.367   6.449  -2.508
  402   HD11  LEU  55          HD11      LEU  55  -3.480   7.638  -2.115
  403   HD12  LEU  55          HD12      LEU  55  -2.468   7.654  -0.673
  404   HD13  LEU  55          HD13      LEU  55  -3.852   6.561  -0.763
  405   HD21  LEU  55          HD21      LEU  55  -0.794   4.366  -1.344
  406   HD22  LEU  55          HD22      LEU  55  -2.217   4.526  -0.311
  407   HD23  LEU  55          HD23      LEU  55  -0.907   5.703  -0.203
  408    H    GLN  56           H        GLN  56  -3.491   4.440  -5.845
  409    HA   GLN  56           HA       GLN  56  -5.406   2.394  -5.861
  410    HB2  GLN  56           HB2      GLN  56  -4.165   3.892  -8.206
  411    HB3  GLN  56           HB3      GLN  56  -5.640   2.930  -8.302
  412    HG2  GLN  56           HG2      GLN  56  -6.820   4.457  -6.841
  413    HG3  GLN  56           HG3      GLN  56  -5.331   5.330  -6.473
  414   HE21  GLN  56          HE21      GLN  56  -6.227   7.282  -7.165
  415   HE22  GLN  56          HE22      GLN  56  -6.464   7.644  -8.835
  416    H    ARG  57           H        ARG  57  -2.155   2.482  -7.345
  417    HA   ARG  57           HA       ARG  57  -2.231  -0.126  -8.518
  418    HB2  ARG  57           HB2      ARG  57   0.157   1.609  -7.766
  419    HB3  ARG  57           HB3      ARG  57   0.254   0.153  -8.755
  420    HG2  ARG  57           HG2      ARG  57  -1.280   2.673  -9.464
  421    HG3  ARG  57           HG3      ARG  57   0.288   2.200 -10.118
  422    HD2  ARG  57           HD2      ARG  57  -0.647   0.349 -11.295
  423    HD3  ARG  57           HD3      ARG  57  -2.177   0.455 -10.423
  424    HE   ARG  57           HE       ARG  57  -1.263   2.207 -12.596
  425   HH11  ARG  57          HH11      ARG  57  -3.805   1.292 -10.424
  426   HH12  ARG  57          HH12      ARG  57  -4.976   2.280 -11.223
  427   HH21  ARG  57          HH21      ARG  57  -2.790   3.437 -13.608
  428   HH22  ARG  57          HH22      ARG  57  -4.409   3.481 -13.000
  429    H    VAL  58           H        VAL  58  -1.275   1.046  -5.341
  430    HA   VAL  58           HA       VAL  58  -0.074  -1.343  -4.347
  431    HB   VAL  58           HB       VAL  58  -1.461   0.915  -2.823
  432   HG11  VAL  58          HG11      VAL  58  -1.263  -1.091  -1.417
  433   HG12  VAL  58          HG12      VAL  58  -0.170   0.170  -0.855
  434   HG13  VAL  58          HG13      VAL  58   0.461  -1.197  -1.777
  435   HG21  VAL  58          HG21      VAL  58   0.810   1.824  -2.484
  436   HG22  VAL  58          HG22      VAL  58   0.426   1.708  -4.198
  437   HG23  VAL  58          HG23      VAL  58   1.493   0.517  -3.458
  438    H    ILE  59           H        ILE  59  -3.433  -0.141  -4.340
  439    HA   ILE  59           HA       ILE  59  -4.683  -2.330  -3.048
  440    HB   ILE  59           HB       ILE  59  -5.808  -0.557  -5.270
  441   HG12  ILE  59          HG12      ILE  59  -6.142  -0.252  -2.244
  442   HG13  ILE  59          HG13      ILE  59  -5.044   0.708  -3.229
  443   HG21  ILE  59          HG21      ILE  59  -8.057  -1.209  -4.448
  444   HG22  ILE  59          HG22      ILE  59  -7.317  -2.320  -3.293
  445   HG23  ILE  59          HG23      ILE  59  -7.152  -2.608  -5.026
  446   HD11  ILE  59          HD11      ILE  59  -8.044   0.657  -3.506
  447   HD12  ILE  59          HD12      ILE  59  -6.925   1.655  -4.440
  448   HD13  ILE  59          HD13      ILE  59  -7.089   1.898  -2.705
  449    H    ASP  60           H        ASP  60  -4.084  -1.684  -6.540
  450    HA   ASP  60           HA       ASP  60  -5.110  -3.986  -7.705
  451    HB2  ASP  60           HB2      ASP  60  -2.680  -2.365  -8.574
  452    HB3  ASP  60           HB3      ASP  60  -3.435  -3.601  -9.576
  453    H    TYR  61           H        TYR  61  -1.889  -3.495  -6.317
  454    HA   TYR  61           HA       TYR  61  -0.646  -5.897  -6.986
  455    HB2  TYR  61           HB2      TYR  61   0.681  -4.122  -6.054
  456    HB3  TYR  61           HB3      TYR  61  -0.301  -4.055  -4.594
  457    HD1  TYR  61           HD1      TYR  61   1.886  -6.481  -6.478
  458    HD2  TYR  61           HD2      TYR  61   0.550  -5.121  -2.648
  459    HE1  TYR  61           HE1      TYR  61   3.425  -8.051  -5.380
  460    HE2  TYR  61           HE2      TYR  61   2.100  -6.683  -1.565
  461    HH   TYR  61           HH       TYR  61   3.233  -8.811  -2.092
  462    H    ILE  62           H        ILE  62  -2.512  -5.110  -4.047
  463    HA   ILE  62           HA       ILE  62  -2.297  -7.715  -2.896
  464    HB   ILE  62           HB       ILE  62  -4.396  -5.603  -2.219
  465   HG12  ILE  62          HG12      ILE  62  -1.611  -5.919  -0.966
  466   HG13  ILE  62          HG13      ILE  62  -2.019  -4.682  -2.147
  467   HG21  ILE  62          HG21      ILE  62  -3.229  -7.883  -0.560
  468   HG22  ILE  62          HG22      ILE  62  -4.855  -7.826  -1.245
  469   HG23  ILE  62          HG23      ILE  62  -4.393  -6.689   0.017
  470   HD11  ILE  62          HD11      ILE  62  -1.996  -3.760   0.077
  471   HD12  ILE  62          HD12      ILE  62  -3.179  -4.947   0.627
  472   HD13  ILE  62          HD13      ILE  62  -3.640  -3.723  -0.562
  473    H    LEU  63           H        LEU  63  -4.678  -6.196  -5.057
  474    HA   LEU  63           HA       LEU  63  -6.702  -8.186  -4.967
  475    HB2  LEU  63           HB2      LEU  63  -5.936  -6.310  -7.235
  476    HB3  LEU  63           HB3      LEU  63  -7.405  -7.276  -7.202
  477    HG   LEU  63           HG       LEU  63  -6.716  -5.027  -5.269
  478   HD11  LEU  63          HD11      LEU  63  -7.259  -4.177  -7.490
  479   HD12  LEU  63          HD12      LEU  63  -8.540  -3.783  -6.347
  480   HD13  LEU  63          HD13      LEU  63  -8.765  -5.101  -7.502
  481   HD21  LEU  63          HD21      LEU  63  -9.003  -5.292  -4.382
  482   HD22  LEU  63          HD22      LEU  63  -8.035  -6.738  -4.118
  483   HD23  LEU  63          HD23      LEU  63  -9.240  -6.712  -5.406
  484    H    ASP  64           H        ASP  64  -3.770  -7.879  -6.969
  485    HA   ASP  64           HA       ASP  64  -4.097 -10.232  -8.522
  486    HB2  ASP  64           HB2      ASP  64  -1.625  -8.628  -7.752
  487    HB3  ASP  64           HB3      ASP  64  -1.541 -10.034  -8.801
  488    H    LEU  65           H        LEU  65  -2.731  -9.682  -5.293
  489    HA   LEU  65           HA       LEU  65  -1.619 -12.288  -4.900
  490    HB2  LEU  65           HB2      LEU  65  -2.604 -10.279  -2.843
  491    HB3  LEU  65           HB3      LEU  65  -1.652 -11.706  -2.471
  492    HG   LEU  65           HG       LEU  65  -0.737  -9.259  -4.026
  493   HD11  LEU  65          HD11      LEU  65  -0.811  -8.893  -1.622
  494   HD12  LEU  65          HD12      LEU  65   0.860  -8.971  -2.169
  495   HD13  LEU  65          HD13      LEU  65   0.143 -10.352  -1.337
  496   HD21  LEU  65          HD21      LEU  65   0.825 -11.814  -3.503
  497   HD22  LEU  65          HD22      LEU  65   1.483 -10.326  -4.190
  498   HD23  LEU  65          HD23      LEU  65   0.256 -11.233  -5.072
  499    H    GLN  66           H        GLN  66  -4.779 -10.880  -4.188
  500    HA   GLN  66           HA       GLN  66  -5.794 -13.137  -2.705
  501    HB2  GLN  66           HB2      GLN  66  -7.267 -10.695  -3.789
  502    HB3  GLN  66           HB3      GLN  66  -7.944 -11.863  -2.661
  503    HG2  GLN  66           HG2      GLN  66  -5.600 -10.019  -2.110
  504    HG3  GLN  66           HG3      GLN  66  -7.248  -9.790  -1.542
  505   HE21  GLN  66          HE21      GLN  66  -8.044 -11.186   0.084
  506   HE22  GLN  66          HE22      GLN  66  -6.978 -12.088   1.097
  507    H    VAL  67           H        VAL  67  -6.915 -11.626  -5.750
  508    HA   VAL  67           HA       VAL  67  -8.383 -14.099  -6.455
  509    HB   VAL  67           HB       VAL  67  -8.810 -11.257  -7.498
  510   HG11  VAL  67          HG11      VAL  67  -9.631 -12.945  -9.077
  511   HG12  VAL  67          HG12      VAL  67 -10.988 -12.093  -8.341
  512   HG13  VAL  67          HG13      VAL  67 -10.571 -13.722  -7.801
  513   HG21  VAL  67          HG21      VAL  67 -10.379 -12.722  -5.332
  514   HG22  VAL  67          HG22      VAL  67 -10.788 -11.143  -6.007
  515   HG23  VAL  67          HG23      VAL  67  -9.300 -11.347  -5.085
  516    H    VAL  68           H        VAL  68  -8.134 -15.059  -8.474
  517    HA   VAL  68           HA       VAL  68  -5.670 -14.682  -9.905
  518    HB   VAL  68           HB       VAL  68  -8.071 -16.408 -10.702
  519   HG11  VAL  68          HG11      VAL  68  -6.433 -17.737 -12.010
  520   HG12  VAL  68          HG12      VAL  68  -5.156 -16.599 -11.573
  521   HG13  VAL  68          HG13      VAL  68  -6.507 -16.067 -12.574
  522   HG21  VAL  68          HG21      VAL  68  -7.313 -17.000  -8.440
  523   HG22  VAL  68          HG22      VAL  68  -5.651 -17.161  -9.010
  524   HG23  VAL  68          HG23      VAL  68  -6.890 -18.284  -9.577
  525    H1   MET   1           H1       MET   1  20.783   7.644  16.977
  526    H2   MET   1           H2       MET   1  22.267   7.107  16.372
  527    H3   MET   1           H3       MET   1  20.862   6.924  15.448
  528    HA   MET   1           HA       MET   1  22.065   9.506  16.257
  529    HB2  MET   1           HB2      MET   1  22.792   9.772  13.925
  530    HB3  MET   1           HB3      MET   1  23.476   8.304  14.610
  531    HG2  MET   1           HG2      MET   1  21.119   8.447  12.714
  532    HG3  MET   1           HG3      MET   1  22.763   7.946  12.306
  533    HE1  MET   1           HE1      MET   1  21.616   5.708  11.207
  534    HE2  MET   1           HE2      MET   1  20.018   6.233  11.743
  535    HE3  MET   1           HE3      MET   1  20.591   4.613  12.133
  536    H    GLY   2           H        GLY   2  20.999  11.379  15.463
  537    HA2  GLY   2           HA2      GLY   2  18.722  11.449  13.819
  538    HA3  GLY   2           HA3      GLY   2  18.174  11.309  15.483
  539    H    HIS   3           H        HIS   3  18.408  13.524  13.212
  540    HA   HIS   3           HA       HIS   3  19.566  15.694  14.852
  541    HB2  HIS   3           HB2      HIS   3  19.536  17.067  12.786
  542    HB3  HIS   3           HB3      HIS   3  20.440  15.579  12.556
  543    HD2  HIS   3           HD2      HIS   3  19.242  13.706  10.795
  544    HE1  HIS   3           HE1      HIS   3  16.381  16.446   9.319
  545    HE2  HIS   3           HE2      HIS   3  17.538  14.234   8.924
  546    H    HIS   4           H        HIS   4  18.159  16.761  16.148
  547    HA   HIS   4           HA       HIS   4  15.368  17.193  15.361
  548    HB2  HIS   4           HB2      HIS   4  15.953  16.743  17.774
  549    HB3  HIS   4           HB3      HIS   4  16.828  18.272  17.819
  550    HD2  HIS   4           HD2      HIS   4  13.117  16.986  17.560
  551    HE1  HIS   4           HE1      HIS   4  13.098  21.100  18.539
  552    HE2  HIS   4           HE2      HIS   4  11.709  18.992  18.399
  553    H    HIS   5           H        HIS   5  15.852  18.322  13.439
  554    HA   HIS   5           HA       HIS   5  16.529  21.200  13.785
  555    HB2  HIS   5           HB2      HIS   5  18.395  19.951  12.664
  556    HB3  HIS   5           HB3      HIS   5  17.281  19.430  11.408
  557    HD2  HIS   5           HD2      HIS   5  19.343  22.566  12.443
  558    HE1  HIS   5           HE1      HIS   5  17.345  23.393   8.807
  559    HE2  HIS   5           HE2      HIS   5  19.200  24.105  10.368
  560    H    HIS   6           H        HIS   6  14.924  18.777  11.691
  561    HA   HIS   6           HA       HIS   6  13.129  20.636  10.460
  562    HB2  HIS   6           HB2      HIS   6  12.029  18.661   9.486
  563    HB3  HIS   6           HB3      HIS   6  13.774  18.540   9.325
  564    HD2  HIS   6           HD2      HIS   6  14.912  16.755  11.443
  565    HE1  HIS   6           HE1      HIS   6  11.367  14.451  11.432
  566    HE2  HIS   6           HE2      HIS   6  13.719  14.641  12.336
  567    H    HIS   7           H        HIS   7  11.545  21.642  11.508
  568    HA   HIS   7           HA       HIS   7   9.504  20.243  13.006
  569    HB2  HIS   7           HB2      HIS   7  11.122  20.687  14.826
  570    HB3  HIS   7           HB3      HIS   7  11.191  22.390  14.386
  571    HD2  HIS   7           HD2      HIS   7   8.795  19.879  16.214
  572    HE1  HIS   7           HE1      HIS   7   7.407  23.831  16.839
  573    HE2  HIS   7           HE2      HIS   7   7.046  21.390  17.386
  574    H    HIS   8           H        HIS   8   7.639  21.094  12.279
  575    HA   HIS   8           HA       HIS   8   7.597  23.659  10.870
  576    HB2  HIS   8           HB2      HIS   8   6.516  21.677   9.856
  577    HB3  HIS   8           HB3      HIS   8   5.420  21.553  11.227
  578    HD2  HIS   8           HD2      HIS   8   6.102  24.049   8.239
  579    HE1  HIS   8           HE1      HIS   8   2.118  24.473   9.595
  580    HE2  HIS   8           HE2      HIS   8   3.747  24.992   7.731
  581    H    SER   9           H        SER   9   6.869  25.511  11.710
  582    HA   SER   9           HA       SER   9   5.237  25.553  14.201
  583    HB2  SER   9           HB2      SER   9   7.300  27.582  13.222
  584    HB3  SER   9           HB3      SER   9   6.344  27.735  14.699
  585    HG   SER   9           HG       SER   9   7.897  25.422  14.296
  586    H    HIS  10           H        HIS  10   4.421  28.228  14.186
  587    HA   HIS  10           HA       HIS  10   2.240  28.212  12.367
  588    HB2  HIS  10           HB2      HIS  10   3.308  30.433  14.146
  589    HB3  HIS  10           HB3      HIS  10   1.851  30.607  13.170
  590    HD1  HIS  10           HD1      HIS  10   0.213  28.237  13.668
  591    HD2  HIS  10           HD2      HIS  10   2.526  29.888  16.698
  592    HE1  HIS  10           HE1      HIS  10  -0.826  27.462  15.805
  593    HE2  HIS  10           HE2      HIS  10   0.731  28.269  17.596
  594    H    MET  11           H        MET  11   1.802  29.310  10.523
  595    HA   MET  11           HA       MET  11   3.723  31.116   9.244
  596    HB2  MET  11           HB2      MET  11   3.660  29.695   7.116
  597    HB3  MET  11           HB3      MET  11   4.602  29.033   8.443
  598    HG2  MET  11           HG2      MET  11   3.373  27.257   7.371
  599    HG3  MET  11           HG3      MET  11   2.724  27.504   8.992
  600    HE1  MET  11           HE1      MET  11   1.122  25.784   6.839
  601    HE2  MET  11           HE2      MET  11  -0.502  26.433   7.058
  602    HE3  MET  11           HE3      MET  11   0.521  26.140   8.463
  603    H    GLY  12           H        GLY  12   2.784  31.790   6.993
  604    HA2  GLY  12           HA2      GLY  12   1.122  32.765   5.740
  605    HA3  GLY  12           HA3      GLY  12  -0.019  31.666   6.496
  606    H    GLY  13           H        GLY  13   2.003  34.378   7.661
  607    HA2  GLY  13           HA2      GLY  13   0.118  35.354   9.551
  608    HA3  GLY  13           HA3      GLY  13   1.561  36.187   9.001
  609    H    GLY  14           H        GLY  14  -1.608  36.676   9.310
  610    HA2  GLY  14           HA2      GLY  14  -2.584  38.741   8.524
  611    HA3  GLY  14           HA3      GLY  14  -1.794  38.507   6.974
  612    H    LYS  15           H        LYS  15  -2.452  35.817   6.508
  613    HA   LYS  15           HA       LYS  15  -3.976  34.397   5.655
  614    HB2  LYS  15           HB2      LYS  15  -5.020  34.436   7.903
  615    HB3  LYS  15           HB3      LYS  15  -6.014  35.806   7.425
  616    HG2  LYS  15           HG2      LYS  15  -7.084  34.345   5.667
  617    HG3  LYS  15           HG3      LYS  15  -6.154  32.983   6.297
  618    HD2  LYS  15           HD2      LYS  15  -8.407  32.908   7.228
  619    HD3  LYS  15           HD3      LYS  15  -7.264  33.286   8.518
  620    HE2  LYS  15           HE2      LYS  15  -7.876  35.687   8.339
  621    HE3  LYS  15           HE3      LYS  15  -9.028  35.292   7.062
  622    HZ1  LYS  15           HZ1      LYS  15  -9.140  34.395   9.890
  623    HZ2  LYS  15           HZ2      LYS  15 -10.194  33.874   8.677
  624    HZ3  LYS  15           HZ3      LYS  15 -10.172  35.501   9.132
  625    H    GLY  16           H        GLY  16  -4.757  34.386   3.635
  626    HA2  GLY  16           HA2      GLY  16  -5.461  36.804   2.244
  627    HA3  GLY  16           HA3      GLY  16  -5.357  35.188   1.574
  628    HA   PRO  17           HA       PRO  17  -9.883  36.417   1.729
  629    HB2  PRO  17           HB2      PRO  17 -10.114  35.911  -1.131
  630    HB3  PRO  17           HB3      PRO  17 -10.203  37.457  -0.289
  631    HG2  PRO  17           HG2      PRO  17  -8.147  36.749  -2.001
  632    HG3  PRO  17           HG3      PRO  17  -7.993  37.953  -0.706
  633    HD2  PRO  17           HD2      PRO  17  -7.154  35.053  -0.705
  634    HD3  PRO  17           HD3      PRO  17  -6.288  36.478  -0.082
  635    H    ALA  18           H        ALA  18  -9.179  33.972   2.711
  636    HA   ALA  18           HA       ALA  18 -10.344  31.774   1.225
  637    HB1  ALA  18           HB1      ALA  18  -9.825  30.430   3.219
  638    HB2  ALA  18           HB2      ALA  18  -9.450  31.895   4.131
  639    HB3  ALA  18           HB3      ALA  18  -8.437  31.424   2.767
  640    H    ALA  19           H        ALA  19 -12.413  32.859   0.850
  641    HA   ALA  19           HA       ALA  19 -14.258  33.304   3.075
  642    HB1  ALA  19           HB1      ALA  19 -15.796  34.135   1.339
  643    HB2  ALA  19           HB2      ALA  19 -14.690  33.586   0.075
  644    HB3  ALA  19           HB3      ALA  19 -14.204  34.882   1.170
  645    H    GLU  20           H        GLU  20 -14.196  31.321   0.149
  646    HA   GLU  20           HA       GLU  20 -16.461  29.692   0.812
  647    HB2  GLU  20           HB2      GLU  20 -15.981  28.489  -1.263
  648    HB3  GLU  20           HB3      GLU  20 -15.865  30.217  -1.544
  649    HG2  GLU  20           HG2      GLU  20 -13.458  28.412  -1.115
  650    HG3  GLU  20           HG3      GLU  20 -14.114  28.825  -2.695
  651    H    GLU  21           H        GLU  21 -16.149  27.197   0.502
  652    HA   GLU  21           HA       GLU  21 -14.683  26.112   2.696
  653    HB2  GLU  21           HB2      GLU  21 -15.555  23.932   1.892
  654    HB3  GLU  21           HB3      GLU  21 -16.818  25.160   1.930
  655    HG2  GLU  21           HG2      GLU  21 -16.465  25.485  -0.552
  656    HG3  GLU  21           HG3      GLU  21 -15.376  24.098  -0.519
  657    HA   PRO  22           HA       PRO  22 -10.665  24.957   0.922
  658    HB2  PRO  22           HB2      PRO  22 -10.325  22.354   1.862
  659    HB3  PRO  22           HB3      PRO  22 -10.058  23.805   2.834
  660    HG2  PRO  22           HG2      PRO  22 -12.511  22.046   2.694
  661    HG3  PRO  22           HG3      PRO  22 -11.686  22.700   4.128
  662    HD2  PRO  22           HD2      PRO  22 -13.916  23.851   3.198
  663    HD3  PRO  22           HD3      PRO  22 -12.582  24.857   3.807
  664    H    LEU  23           H        LEU  23 -11.015  24.925  -1.293
  665    HA   LEU  23           HA       LEU  23 -12.356  22.710  -2.642
  666    HB2  LEU  23           HB2      LEU  23 -11.085  25.259  -3.712
  667    HB3  LEU  23           HB3      LEU  23 -11.940  24.088  -4.706
  668    HG   LEU  23           HG       LEU  23 -13.170  25.755  -2.474
  669   HD11  LEU  23          HD11      LEU  23 -14.407  26.892  -4.278
  670   HD12  LEU  23          HD12      LEU  23 -13.517  25.955  -5.482
  671   HD13  LEU  23          HD13      LEU  23 -12.665  27.102  -4.446
  672   HD21  LEU  23          HD21      LEU  23 -14.273  23.563  -2.579
  673   HD22  LEU  23          HD22      LEU  23 -14.510  23.735  -4.320
  674   HD23  LEU  23          HD23      LEU  23 -15.348  24.812  -3.202
  675    H    SER  24           H        SER  24 -11.265  20.906  -3.121
  676    HA   SER  24           HA       SER  24  -8.603  21.042  -4.370
  677    HB2  SER  24           HB2      SER  24  -9.260  19.214  -2.007
  678    HB3  SER  24           HB3      SER  24  -7.792  19.110  -2.981
  679    HG   SER  24           HG       SER  24  -8.360  21.607  -1.919
  680    H    LEU  25           H        LEU  25 -10.698  18.359  -3.222
  681    HA   LEU  25           HA       LEU  25 -11.586  17.413  -5.742
  682    HB2  LEU  25           HB2      LEU  25  -9.035  17.080  -5.944
  683    HB3  LEU  25           HB3      LEU  25  -9.159  15.900  -4.654
  684    HG   LEU  25           HG       LEU  25 -10.636  14.494  -6.119
  685   HD11  LEU  25          HD11      LEU  25 -11.597  16.226  -7.546
  686   HD12  LEU  25          HD12      LEU  25 -10.816  14.992  -8.528
  687   HD13  LEU  25          HD13      LEU  25 -10.019  16.546  -8.275
  688   HD21  LEU  25          HD21      LEU  25  -8.229  14.018  -6.013
  689   HD22  LEU  25          HD22      LEU  25  -7.922  15.157  -7.327
  690   HD23  LEU  25          HD23      LEU  25  -8.855  13.688  -7.626
  691    H    LEU  26           H        LEU  26 -12.534  15.148  -5.530
  692    HA   LEU  26           HA       LEU  26 -13.571  14.388  -2.989
  693    HB2  LEU  26           HB2      LEU  26 -14.535  13.784  -5.235
  694    HB3  LEU  26           HB3      LEU  26 -13.207  12.676  -5.494
  695    HG   LEU  26           HG       LEU  26 -15.053  12.262  -3.109
  696   HD11  LEU  26          HD11      LEU  26 -16.553  10.852  -4.453
  697   HD12  LEU  26          HD12      LEU  26 -15.674  11.290  -5.922
  698   HD13  LEU  26          HD13      LEU  26 -16.570  12.518  -5.028
  699   HD21  LEU  26          HD21      LEU  26 -13.542  10.257  -4.837
  700   HD22  LEU  26          HD22      LEU  26 -14.504   9.882  -3.402
  701   HD23  LEU  26          HD23      LEU  26 -13.035  10.837  -3.247
  702    H    ASP  27           H        ASP  27 -12.822  12.829  -1.480
  703    HA   ASP  27           HA       ASP  27  -9.975  12.418  -1.335
  704    HB2  ASP  27           HB2      ASP  27 -12.217  11.391   0.450
  705    HB3  ASP  27           HB3      ASP  27 -10.501  11.233   0.812
  706    H    ASP  28           H        ASP  28  -9.916  11.213  -3.432
  707    HA   ASP  28           HA       ASP  28 -10.616   8.432  -3.524
  708    HB2  ASP  28           HB2      ASP  28 -10.202   9.983  -5.535
  709    HB3  ASP  28           HB3      ASP  28  -8.482   9.860  -5.187
  710    H    MET  29           H        MET  29  -7.843  10.325  -2.504
  711    HA   MET  29           HA       MET  29  -5.932   8.316  -2.064
  712    HB2  MET  29           HB2      MET  29  -5.069  10.491  -2.039
  713    HB3  MET  29           HB3      MET  29  -6.348  11.112  -1.011
  714    HG2  MET  29           HG2      MET  29  -5.329  10.291   0.951
  715    HG3  MET  29           HG3      MET  29  -4.295   9.180   0.058
  716    HE1  MET  29           HE1      MET  29  -2.915  10.645  -2.154
  717    HE2  MET  29           HE2      MET  29  -2.012   9.752  -0.924
  718    HE3  MET  29           HE3      MET  29  -1.519  11.390  -1.368
  719    H    ASN  30           H        ASN  30  -8.277   9.759   0.276
  720    HA   ASN  30           HA       ASN  30  -7.609   7.984   2.412
  721    HB2  ASN  30           HB2      ASN  30  -8.698  10.215   2.766
  722    HB3  ASN  30           HB3      ASN  30 -10.187   9.579   2.066
  723   HD21  ASN  30          HD21      ASN  30 -11.406   9.796   3.956
  724   HD22  ASN  30          HD22      ASN  30 -11.135   8.832   5.358
  725    H    HIS  31           H        HIS  31 -10.032   7.835  -0.178
  726    HA   HIS  31           HA       HIS  31 -11.469   5.529   0.555
  727    HB2  HIS  31           HB2      HIS  31 -12.064   7.031  -1.360
  728    HB3  HIS  31           HB3      HIS  31 -10.678   6.424  -2.257
  729    HD2  HIS  31           HD2      HIS  31 -14.354   5.596  -1.663
  730    HE1  HIS  31           HE1      HIS  31 -12.612   2.269  -3.621
  731    HE2  HIS  31           HE2      HIS  31 -14.777   3.442  -3.042
  732    H    CYS  32           H        CYS  32  -8.487   5.863  -1.344
  733    HA   CYS  32           HA       CYS  32  -7.895   3.160  -1.811
  734    HB2  CYS  32           HB2      CYS  32  -6.080   5.590  -1.643
  735    HB3  CYS  32           HB3      CYS  32  -5.503   3.994  -2.114
  736    HG   CYS  32           HG       CYS  32  -6.958   6.309  -3.957
  737    H    TYR  33           H        TYR  33  -6.764   5.350   0.759
  738    HA   TYR  33           HA       TYR  33  -5.184   3.573   2.243
  739    HB2  TYR  33           HB2      TYR  33  -6.575   6.183   2.871
  740    HB3  TYR  33           HB3      TYR  33  -5.820   5.286   4.184
  741    HD1  TYR  33           HD1      TYR  33  -3.379   4.250   3.055
  742    HD2  TYR  33           HD2      TYR  33  -5.145   8.079   2.402
  743    HE1  TYR  33           HE1      TYR  33  -1.172   5.182   2.641
  744    HE2  TYR  33           HE2      TYR  33  -2.920   9.022   1.972
  745    HH   TYR  33           HH       TYR  33  -0.207   7.196   1.371
  746    H    SER  34           H        SER  34  -8.654   4.122   2.297
  747    HA   SER  34           HA       SER  34  -9.273   2.643   4.658
  748    HB2  SER  34           HB2      SER  34 -10.875   4.251   3.707
  749    HB3  SER  34           HB3      SER  34 -11.011   3.291   2.238
  750    HG   SER  34           HG       SER  34 -12.668   3.053   4.021
  751    H    ARG  35           H        ARG  35  -9.387   1.765   1.175
  752    HA   ARG  35           HA       ARG  35  -9.977  -0.960   1.397
  753    HB2  ARG  35           HB2      ARG  35  -8.706   0.717  -0.716
  754    HB3  ARG  35           HB3      ARG  35  -8.467  -1.027  -0.841
  755    HG2  ARG  35           HG2      ARG  35 -10.988  -1.281  -0.659
  756    HG3  ARG  35           HG3      ARG  35 -11.102   0.474  -0.850
  757    HD2  ARG  35           HD2      ARG  35  -9.905   0.316  -2.979
  758    HD3  ARG  35           HD3      ARG  35  -9.761  -1.426  -2.787
  759    HE   ARG  35           HE       ARG  35 -12.449  -0.259  -2.908
  760   HH11  ARG  35          HH11      ARG  35 -10.022  -2.208  -4.430
  761   HH12  ARG  35          HH12      ARG  35 -11.079  -2.724  -5.693
  762   HH21  ARG  35          HH21      ARG  35 -13.775  -0.955  -4.543
  763   HH22  ARG  35          HH22      ARG  35 -13.174  -2.040  -5.747
  764    H    LEU  36           H        LEU  36  -6.800   0.654   1.508
  765    HA   LEU  36           HA       LEU  36  -5.184  -1.655   1.617
  766    HB2  LEU  36           HB2      LEU  36  -4.662   1.094   2.814
  767    HB3  LEU  36           HB3      LEU  36  -3.450  -0.170   2.638
  768    HG   LEU  36           HG       LEU  36  -4.860   1.306   0.383
  769   HD11  LEU  36          HD11      LEU  36  -3.114   2.641   1.455
  770   HD12  LEU  36          HD12      LEU  36  -2.642   2.181  -0.180
  771   HD13  LEU  36          HD13      LEU  36  -1.945   1.338   1.207
  772   HD21  LEU  36          HD21      LEU  36  -4.559  -1.025  -0.294
  773   HD22  LEU  36          HD22      LEU  36  -2.851  -0.959   0.150
  774   HD23  LEU  36          HD23      LEU  36  -3.457   0.022  -1.186
  775    H    ARG  37           H        ARG  37  -6.538   0.335   4.276
  776    HA   ARG  37           HA       ARG  37  -5.676  -1.218   6.453
  777    HB2  ARG  37           HB2      ARG  37  -8.011   0.671   6.080
  778    HB3  ARG  37           HB3      ARG  37  -7.768  -0.167   7.612
  779    HG2  ARG  37           HG2      ARG  37  -5.591   0.869   7.910
  780    HG3  ARG  37           HG3      ARG  37  -5.668   1.589   6.301
  781    HD2  ARG  37           HD2      ARG  37  -7.646   2.235   8.504
  782    HD3  ARG  37           HD3      ARG  37  -6.166   3.151   8.219
  783    HE   ARG  37           HE       ARG  37  -7.599   2.993   5.809
  784   HH11  ARG  37          HH11      ARG  37  -7.992   4.529   8.883
  785   HH12  ARG  37          HH12      ARG  37  -8.802   5.892   8.210
  786   HH21  ARG  37          HH21      ARG  37  -8.638   4.765   4.987
  787   HH22  ARG  37          HH22      ARG  37  -9.177   6.018   6.044
  788    H    GLU  38           H        GLU  38  -8.164  -1.944   4.134
  789    HA   GLU  38           HA       GLU  38  -9.508  -3.949   5.822
  790    HB2  GLU  38           HB2      GLU  38  -9.989  -3.056   2.947
  791    HB3  GLU  38           HB3      GLU  38 -10.928  -4.311   3.754
  792    HG2  GLU  38           HG2      GLU  38 -11.734  -2.683   5.405
  793    HG3  GLU  38           HG3      GLU  38 -10.750  -1.421   4.666
  794    H    LEU  39           H        LEU  39  -7.332  -3.779   3.031
  795    HA   LEU  39           HA       LEU  39  -7.332  -6.656   2.563
  796    HB2  LEU  39           HB2      LEU  39  -5.807  -4.402   1.221
  797    HB3  LEU  39           HB3      LEU  39  -5.745  -6.079   0.713
  798    HG   LEU  39           HG       LEU  39  -8.224  -4.308   0.645
  799   HD11  LEU  39          HD11      LEU  39  -6.592  -3.653  -1.066
  800   HD12  LEU  39          HD12      LEU  39  -8.016  -4.388  -1.799
  801   HD13  LEU  39          HD13      LEU  39  -6.522  -5.317  -1.658
  802   HD21  LEU  39          HD21      LEU  39  -7.900  -7.179  -0.321
  803   HD22  LEU  39          HD22      LEU  39  -9.324  -6.162  -0.561
  804   HD23  LEU  39          HD23      LEU  39  -8.857  -6.647   1.065
  805    H    VAL  40           H        VAL  40  -5.559  -4.485   4.486
  806    HA   VAL  40           HA       VAL  40  -3.305  -6.368   4.876
  807    HB   VAL  40           HB       VAL  40  -3.592  -3.503   5.923
  808   HG11  VAL  40          HG11      VAL  40  -2.130  -4.825   7.364
  809   HG12  VAL  40          HG12      VAL  40  -1.170  -3.656   6.457
  810   HG13  VAL  40          HG13      VAL  40  -1.181  -5.354   5.974
  811   HG21  VAL  40          HG21      VAL  40  -2.011  -4.508   3.524
  812   HG22  VAL  40          HG22      VAL  40  -1.905  -2.881   4.205
  813   HG23  VAL  40          HG23      VAL  40  -3.427  -3.442   3.508
  814    HA   PRO  41           HA       PRO  41  -5.676  -7.341   8.766
  815    HB2  PRO  41           HB2      PRO  41  -4.236  -9.929   8.640
  816    HB3  PRO  41           HB3      PRO  41  -5.976  -9.619   8.646
  817    HG2  PRO  41           HG2      PRO  41  -4.704 -10.519   6.429
  818    HG3  PRO  41           HG3      PRO  41  -6.087  -9.404   6.325
  819    HD2  PRO  41           HD2      PRO  41  -3.126  -8.764   6.181
  820    HD3  PRO  41           HD3      PRO  41  -4.441  -8.230   5.103
  821    H    GLY  42           H        GLY  42  -2.849  -6.085   8.366
  822    HA2  GLY  42           HA2      GLY  42  -1.440  -7.084  10.760
  823    HA3  GLY  42           HA3      GLY  42  -0.738  -6.118   9.473
  824    H    VAL  43           H        VAL  43  -3.699  -4.731  10.215
  825    HA   VAL  43           HA       VAL  43  -2.516  -2.551  11.728
  826    HB   VAL  43           HB       VAL  43  -5.438  -3.022  10.946
  827   HG11  VAL  43          HG11      VAL  43  -5.283  -1.470  12.851
  828   HG12  VAL  43          HG12      VAL  43  -5.796  -0.617  11.396
  829   HG13  VAL  43          HG13      VAL  43  -4.133  -0.465  11.967
  830   HG21  VAL  43          HG21      VAL  43  -5.008  -1.384   9.119
  831   HG22  VAL  43          HG22      VAL  43  -4.013  -2.831   8.958
  832   HG23  VAL  43          HG23      VAL  43  -3.300  -1.334   9.570
  833    HA   PRO  44           HA       PRO  44  -3.053  -4.777  15.597
  834    HB2  PRO  44           HB2      PRO  44  -2.401  -2.796  17.387
  835    HB3  PRO  44           HB3      PRO  44  -1.212  -3.615  16.364
  836    HG2  PRO  44           HG2      PRO  44  -2.599  -0.968  15.897
  837    HG3  PRO  44           HG3      PRO  44  -0.867  -1.357  15.773
  838    HD2  PRO  44           HD2      PRO  44  -2.421  -1.235  13.579
  839    HD3  PRO  44           HD3      PRO  44  -1.132  -2.453  13.714
  840    H    ARG  45           H        ARG  45  -5.435  -4.918  15.104
  841    HA   ARG  45           HA       ARG  45  -7.546  -5.099  15.844
  842    HB2  ARG  45           HB2      ARG  45  -6.070  -4.807  18.479
  843    HB3  ARG  45           HB3      ARG  45  -7.743  -5.341  18.367
  844    HG2  ARG  45           HG2      ARG  45  -5.330  -6.765  17.182
  845    HG3  ARG  45           HG3      ARG  45  -6.246  -7.261  18.609
  846    HD2  ARG  45           HD2      ARG  45  -7.301  -7.136  15.757
  847    HD3  ARG  45           HD3      ARG  45  -6.886  -8.598  16.654
  848    HE   ARG  45           HE       ARG  45  -8.755  -7.376  18.219
  849   HH11  ARG  45          HH11      ARG  45  -8.797  -8.352  14.889
  850   HH12  ARG  45          HH12      ARG  45 -10.487  -8.698  14.924
  851   HH21  ARG  45          HH21      ARG  45 -10.906  -7.824  18.201
  852   HH22  ARG  45          HH22      ARG  45 -11.653  -8.425  16.761
  853    H    GLY  46           H        GLY  46  -6.805  -2.234  15.290
  854    HA2  GLY  46           HA2      GLY  46  -8.770  -0.747  15.057
  855    HA3  GLY  46           HA3      GLY  46  -9.072  -0.973  16.767
  856    H    THR  47           H        THR  47  -8.124   1.252  14.697
  857    HA   THR  47           HA       THR  47  -6.958   3.055  16.505
  858    HB   THR  47           HB       THR  47  -4.892   1.736  16.430
  859    HG1  THR  47           HG1      THR  47  -3.473   3.382  15.754
  860   HG21  THR  47          HG21      THR  47  -3.616   1.334  14.382
  861   HG22  THR  47          HG22      THR  47  -4.888   2.086  13.421
  862   HG23  THR  47          HG23      THR  47  -5.212   0.576  14.276
  863    H    GLN  48           H        GLN  48  -7.500   2.055  13.174
  864    HA   GLN  48           HA       GLN  48  -7.383   3.024  11.147
  865    HB2  GLN  48           HB2      GLN  48  -8.818   5.235  12.663
  866    HB3  GLN  48           HB3      GLN  48  -8.622   5.239  10.916
  867    HG2  GLN  48           HG2      GLN  48 -10.789   4.393  11.268
  868    HG3  GLN  48           HG3      GLN  48  -9.813   2.974  10.902
  869   HE21  GLN  48          HE21      GLN  48 -11.623   4.646  13.342
  870   HE22  GLN  48          HE22      GLN  48 -11.647   3.375  14.505
  871    H    LEU  49           H        LEU  49  -5.222   3.072  10.929
  872    HA   LEU  49           HA       LEU  49  -3.321   4.696  12.127
  873    HB2  LEU  49           HB2      LEU  49  -3.261   3.232   9.471
  874    HB3  LEU  49           HB3      LEU  49  -1.831   3.897  10.240
  875    HG   LEU  49           HG       LEU  49  -3.566   1.759  11.527
  876   HD11  LEU  49          HD11      LEU  49  -1.877   0.125  10.820
  877   HD12  LEU  49          HD12      LEU  49  -1.032   1.377   9.904
  878   HD13  LEU  49          HD13      LEU  49  -2.661   0.883   9.436
  879   HD21  LEU  49          HD21      LEU  49  -1.625   1.397  12.987
  880   HD22  LEU  49          HD22      LEU  49  -2.197   3.057  13.113
  881   HD23  LEU  49          HD23      LEU  49  -0.745   2.696  12.174
  882    H    SER  50           H        SER  50  -1.962   6.381  11.346
  883    HA   SER  50           HA       SER  50  -3.032   8.435   9.714
  884    HB2  SER  50           HB2      SER  50  -1.256   8.863  11.408
  885    HB3  SER  50           HB3      SER  50  -0.101   7.957  10.429
  886    HG   SER  50           HG       SER  50   0.056  10.211  10.047
  887    H    GLN  51           H        GLN  51  -2.251   9.190   7.661
  888    HA   GLN  51           HA       GLN  51  -2.289   7.477   5.530
  889    HB2  GLN  51           HB2      GLN  51  -0.849  10.150   5.721
  890    HB3  GLN  51           HB3      GLN  51  -1.241   9.339   4.207
  891    HG2  GLN  51           HG2      GLN  51  -3.650   9.521   4.738
  892    HG3  GLN  51           HG3      GLN  51  -3.251  10.348   6.244
  893   HE21  GLN  51          HE21      GLN  51  -3.295  10.632   2.751
  894   HE22  GLN  51          HE22      GLN  51  -3.117  12.344   2.697
  895    H    VAL  52           H        VAL  52   0.610   8.555   7.284
  896    HA   VAL  52           HA       VAL  52   2.548   7.287   5.587
  897    HB   VAL  52           HB       VAL  52   2.986   8.006   8.524
  898   HG11  VAL  52          HG11      VAL  52   4.898   7.905   6.158
  899   HG12  VAL  52          HG12      VAL  52   4.810   6.734   7.478
  900   HG13  VAL  52          HG13      VAL  52   5.328   8.388   7.805
  901   HG21  VAL  52          HG21      VAL  52   1.970   9.966   7.465
  902   HG22  VAL  52          HG22      VAL  52   3.140   9.890   6.149
  903   HG23  VAL  52          HG23      VAL  52   3.681  10.271   7.785
  904    H    GLU  53           H        GLU  53   1.209   6.450   8.797
  905    HA   GLU  53           HA       GLU  53   2.570   4.071   9.325
  906    HB2  GLU  53           HB2      GLU  53  -0.200   4.963  10.221
  907    HB3  GLU  53           HB3      GLU  53   0.642   3.579  10.902
  908    HG2  GLU  53           HG2      GLU  53   1.642   6.441  11.016
  909    HG3  GLU  53           HG3      GLU  53   0.776   5.613  12.310
  910    H    ILE  54           H        ILE  54  -0.398   4.565   7.457
  911    HA   ILE  54           HA       ILE  54  -1.165   1.856   7.104
  912    HB   ILE  54           HB       ILE  54  -1.683   4.260   5.289
  913   HG12  ILE  54          HG12      ILE  54  -3.539   2.990   7.366
  914   HG13  ILE  54          HG13      ILE  54  -2.578   4.433   7.656
  915   HG21  ILE  54          HG21      ILE  54  -3.586   2.922   4.357
  916   HG22  ILE  54          HG22      ILE  54  -3.008   1.514   5.252
  917   HG23  ILE  54          HG23      ILE  54  -2.008   2.234   3.984
  918   HD11  ILE  54          HD11      ILE  54  -4.877   4.986   7.187
  919   HD12  ILE  54          HD12      ILE  54  -4.792   4.162   5.631
  920   HD13  ILE  54          HD13      ILE  54  -3.825   5.613   5.918
  921    H    LEU  55           H        LEU  55   0.782   4.052   5.011
  922    HA   LEU  55           HA       LEU  55   1.478   2.347   2.916
  923    HB2  LEU  55           HB2      LEU  55   3.263   4.430   4.247
  924    HB3  LEU  55           HB3      LEU  55   3.533   3.743   2.652
  925    HG   LEU  55           HG       LEU  55   1.172   5.491   3.432
  926   HD11  LEU  55          HD11      LEU  55   2.216   7.219   2.012
  927   HD12  LEU  55          HD12      LEU  55   3.619   6.176   1.769
  928   HD13  LEU  55          HD13      LEU  55   3.244   6.789   3.380
  929   HD21  LEU  55          HD21      LEU  55   0.627   5.516   1.040
  930   HD22  LEU  55          HD22      LEU  55   0.561   3.880   1.687
  931   HD23  LEU  55          HD23      LEU  55   1.944   4.387   0.714
  932    H    GLN  56           H        GLN  56   3.092   2.789   6.039
  933    HA   GLN  56           HA       GLN  56   5.265   1.022   5.643
  934    HB2  GLN  56           HB2      GLN  56   3.999   1.851   8.283
  935    HB3  GLN  56           HB3      GLN  56   5.629   1.224   8.057
  936    HG2  GLN  56           HG2      GLN  56   6.258   3.241   6.811
  937    HG3  GLN  56           HG3      GLN  56   4.614   3.860   6.949
  938   HE21  GLN  56          HE21      GLN  56   7.045   5.121   7.871
  939   HE22  GLN  56          HE22      GLN  56   6.869   5.341   9.572
  940    H    ARG  57           H        ARG  57   2.080   0.531   7.266
  941    HA   ARG  57           HA       ARG  57   2.480  -2.174   8.027
  942    HB2  ARG  57           HB2      ARG  57   0.144  -0.332   7.957
  943    HB3  ARG  57           HB3      ARG  57  -0.281  -2.027   7.809
  944    HG2  ARG  57           HG2      ARG  57  -0.456  -1.507  10.106
  945    HG3  ARG  57           HG3      ARG  57   1.014  -2.459   9.935
  946    HD2  ARG  57           HD2      ARG  57   1.020   0.568  10.073
  947    HD3  ARG  57           HD3      ARG  57   1.127  -0.456  11.503
  948    HE   ARG  57           HE       ARG  57   3.146  -1.318   9.848
  949   HH11  ARG  57          HH11      ARG  57   2.359   1.748  11.236
  950   HH12  ARG  57          HH12      ARG  57   4.014   2.201  11.421
  951   HH21  ARG  57          HH21      ARG  57   5.232  -0.721  10.094
  952   HH22  ARG  57          HH22      ARG  57   5.623   0.808  10.809
  953    H    VAL  58           H        VAL  58   1.323  -0.788   4.982
  954    HA   VAL  58           HA       VAL  58   0.486  -3.201   3.735
  955    HB   VAL  58           HB       VAL  58   1.663  -0.681   2.452
  956   HG11  VAL  58          HG11      VAL  58   0.771  -1.505   0.310
  957   HG12  VAL  58          HG12      VAL  58   0.234  -2.999   1.079
  958   HG13  VAL  58          HG13      VAL  58   1.955  -2.632   0.959
  959   HG21  VAL  58          HG21      VAL  58  -1.240  -1.581   2.714
  960   HG22  VAL  58          HG22      VAL  58  -0.686  -0.128   1.879
  961   HG23  VAL  58          HG23      VAL  58  -0.474  -0.276   3.622
  962    H    ILE  59           H        ILE  59   3.630  -1.516   3.803
  963    HA   ILE  59           HA       ILE  59   5.125  -3.391   2.296
  964    HB   ILE  59           HB       ILE  59   6.078  -1.439   4.445
  965   HG12  ILE  59          HG12      ILE  59   6.061  -1.077   1.404
  966   HG13  ILE  59          HG13      ILE  59   4.804  -0.452   2.461
  967   HG21  ILE  59          HG21      ILE  59   7.702  -2.846   2.281
  968   HG22  ILE  59          HG22      ILE  59   7.815  -3.136   4.018
  969   HG23  ILE  59          HG23      ILE  59   8.310  -1.579   3.351
  970   HD11  ILE  59          HD11      ILE  59   6.361   1.276   1.820
  971   HD12  ILE  59          HD12      ILE  59   7.704   0.358   2.499
  972   HD13  ILE  59          HD13      ILE  59   6.441   0.991   3.560
  973    H    ASP  60           H        ASP  60   4.435  -3.199   5.798
  974    HA   ASP  60           HA       ASP  60   6.044  -5.394   6.644
  975    HB2  ASP  60           HB2      ASP  60   3.535  -4.254   7.944
  976    HB3  ASP  60           HB3      ASP  60   4.670  -5.352   8.727
  977    H    TYR  61           H        TYR  61   2.711  -5.166   5.508
  978    HA   TYR  61           HA       TYR  61   1.802  -7.803   5.860
  979    HB2  TYR  61           HB2      TYR  61   0.210  -6.104   5.277
  980    HB3  TYR  61           HB3      TYR  61   1.127  -5.609   3.869
  981    HD1  TYR  61           HD1      TYR  61  -1.149  -8.261   5.193
  982    HD2  TYR  61           HD2      TYR  61   0.736  -6.636   1.703
  983    HE1  TYR  61           HE1      TYR  61  -2.605  -9.622   3.762
  984    HE2  TYR  61           HE2      TYR  61  -0.731  -8.004   0.285
  985    HH   TYR  61           HH       TYR  61  -3.492  -9.572   1.475
  986    H    ILE  62           H        ILE  62   3.478  -6.290   3.107
  987    HA   ILE  62           HA       ILE  62   3.639  -8.539   1.395
  988    HB   ILE  62           HB       ILE  62   5.553  -6.149   1.546
  989   HG12  ILE  62          HG12      ILE  62   3.063  -6.441  -0.210
  990   HG13  ILE  62          HG13      ILE  62   3.109  -5.512   1.277
  991   HG21  ILE  62          HG21      ILE  62   4.997  -8.040  -0.778
  992   HG22  ILE  62          HG22      ILE  62   6.474  -7.990   0.185
  993   HG23  ILE  62          HG23      ILE  62   6.047  -6.620  -0.838
  994   HD11  ILE  62          HD11      ILE  62   4.704  -4.942  -1.218
  995   HD12  ILE  62          HD12      ILE  62   4.780  -4.012   0.281
  996   HD13  ILE  62          HD13      ILE  62   3.282  -4.066  -0.648
  997    H    LEU  63           H        LEU  63   6.031  -7.176   3.683
  998    HA   LEU  63           HA       LEU  63   8.081  -9.088   3.358
  999    HB2  LEU  63           HB2      LEU  63   7.420  -7.291   5.720
 1000    HB3  LEU  63           HB3      LEU  63   8.906  -8.219   5.581
 1001    HG   LEU  63           HG       LEU  63   8.063  -6.022   3.646
 1002   HD11  LEU  63          HD11      LEU  63  10.112  -5.906   5.881
 1003   HD12  LEU  63          HD12      LEU  63   8.554  -5.077   5.848
 1004   HD13  LEU  63          HD13      LEU  63   9.805  -4.639   4.689
 1005   HD21  LEU  63          HD21      LEU  63  10.689  -7.540   3.859
 1006   HD22  LEU  63          HD22      LEU  63  10.360  -6.192   2.767
 1007   HD23  LEU  63          HD23      LEU  63   9.490  -7.710   2.575
 1008    H    ASP  64           H        ASP  64   5.227  -9.082   5.438
 1009    HA   ASP  64           HA       ASP  64   5.886 -11.274   7.106
 1010    HB2  ASP  64           HB2      ASP  64   4.061  -9.651   7.588
 1011    HB3  ASP  64           HB3      ASP  64   3.132 -10.297   6.243
 1012    H    LEU  65           H        LEU  65   4.264 -11.084   3.957
 1013    HA   LEU  65           HA       LEU  65   3.662 -13.862   3.632
 1014    HB2  LEU  65           HB2      LEU  65   4.069 -11.718   1.508
 1015    HB3  LEU  65           HB3      LEU  65   3.297 -13.275   1.250
 1016    HG   LEU  65           HG       LEU  65   2.222 -11.046   3.020
 1017   HD11  LEU  65          HD11      LEU  65   2.049 -10.467   0.650
 1018   HD12  LEU  65          HD12      LEU  65   0.459 -10.774   1.340
 1019   HD13  LEU  65          HD13      LEU  65   1.224 -11.994   0.317
 1020   HD21  LEU  65          HD21      LEU  65   0.965 -13.724   2.341
 1021   HD22  LEU  65          HD22      LEU  65   0.187 -12.414   3.233
 1022   HD23  LEU  65          HD23      LEU  65   1.591 -13.227   3.917
 1023    H    GLN  66           H        GLN  66   6.368 -11.827   2.583
 1024    HA   GLN  66           HA       GLN  66   7.677 -13.738   0.921
 1025    HB2  GLN  66           HB2      GLN  66   8.720 -11.172   2.183
 1026    HB3  GLN  66           HB3      GLN  66   9.593 -12.106   0.971
 1027    HG2  GLN  66           HG2      GLN  66   7.870 -11.664  -0.687
 1028    HG3  GLN  66           HG3      GLN  66   6.874 -10.839   0.511
 1029   HE21  GLN  66          HE21      GLN  66   7.979  -9.808  -2.024
 1030   HE22  GLN  66          HE22      GLN  66   8.917  -8.426  -1.596
 1031    H    VAL  67           H        VAL  67   8.437 -12.589   4.222
 1032    HA   VAL  67           HA       VAL  67  10.844 -14.159   4.452
 1033    HB   VAL  67           HB       VAL  67   9.342 -12.511   6.534
 1034   HG11  VAL  67          HG11      VAL  67  11.420 -12.570   7.891
 1035   HG12  VAL  67          HG12      VAL  67  12.139 -13.699   6.738
 1036   HG13  VAL  67          HG13      VAL  67  10.726 -14.179   7.681
 1037   HG21  VAL  67          HG21      VAL  67  11.080 -10.796   6.131
 1038   HG22  VAL  67          HG22      VAL  67  10.181 -11.158   4.660
 1039   HG23  VAL  67          HG23      VAL  67  11.803 -11.815   4.880
 1040    H    VAL  68           H        VAL  68  11.043 -16.177   5.172
 1041    HA   VAL  68           HA       VAL  68   8.832 -17.649   6.394
 1042    HB   VAL  68           HB       VAL  68  11.637 -18.658   5.702
 1043   HG11  VAL  68          HG11      VAL  68  10.480 -20.104   7.313
 1044   HG12  VAL  68          HG12      VAL  68  10.609 -20.915   5.752
 1045   HG13  VAL  68          HG13      VAL  68   9.071 -20.207   6.252
 1046   HG21  VAL  68          HG21      VAL  68  10.565 -17.800   3.667
 1047   HG22  VAL  68          HG22      VAL  68   9.122 -18.766   3.982
 1048   HG23  VAL  68          HG23      VAL  68  10.653 -19.563   3.607
  Start of MODEL   13
    1    H1   MET   1           H1       MET   1 -21.314  15.577  24.814
    2    H2   MET   1           H2       MET   1 -20.323  14.416  24.101
    3    H3   MET   1           H3       MET   1 -21.619  15.064  23.234
    4    HA   MET   1           HA       MET   1 -20.611  17.242  23.274
    5    HB2  MET   1           HB2      MET   1 -19.363  16.982  25.388
    6    HB3  MET   1           HB3      MET   1 -18.298  15.794  24.650
    7    HG2  MET   1           HG2      MET   1 -17.425  17.532  23.126
    8    HG3  MET   1           HG3      MET   1 -18.492  18.720  23.886
    9    HE1  MET   1           HE1      MET   1 -14.935  19.765  25.203
   10    HE2  MET   1           HE2      MET   1 -16.401  20.330  24.407
   11    HE3  MET   1           HE3      MET   1 -15.353  19.164  23.598
   12    H    GLY   2           H        GLY   2 -20.094  17.631  21.189
   13    HA2  GLY   2           HA2      GLY   2 -18.351  15.716  19.699
   14    HA3  GLY   2           HA3      GLY   2 -19.746  16.518  18.988
   15    H    HIS   3           H        HIS   3 -16.442  16.924  20.073
   16    HA   HIS   3           HA       HIS   3 -16.202  19.730  19.698
   17    HB2  HIS   3           HB2      HIS   3 -14.596  18.577  21.104
   18    HB3  HIS   3           HB3      HIS   3 -14.102  17.525  19.782
   19    HD2  HIS   3           HD2      HIS   3 -11.672  18.334  18.876
   20    HE1  HIS   3           HE1      HIS   3 -12.252  22.489  19.396
   21    HE2  HIS   3           HE2      HIS   3 -10.760  20.713  18.403
   22    H    HIS   4           H        HIS   4 -15.305  20.926  18.008
   23    HA   HIS   4           HA       HIS   4 -15.511  19.712  15.315
   24    HB2  HIS   4           HB2      HIS   4 -15.550  22.657  16.099
   25    HB3  HIS   4           HB3      HIS   4 -15.916  21.980  14.514
   26    HD2  HIS   4           HD2      HIS   4 -18.331  20.281  14.569
   27    HE1  HIS   4           HE1      HIS   4 -19.901  22.494  17.813
   28    HE2  HIS   4           HE2      HIS   4 -20.443  20.904  15.927
   29    H    HIS   5           H        HIS   5 -13.527  18.987  14.739
   30    HA   HIS   5           HA       HIS   5 -11.059  20.410  15.408
   31    HB2  HIS   5           HB2      HIS   5  -9.961  18.381  14.338
   32    HB3  HIS   5           HB3      HIS   5 -10.953  18.037  15.746
   33    HD2  HIS   5           HD2      HIS   5 -10.523  16.795  12.191
   34    HE1  HIS   5           HE1      HIS   5 -14.334  15.494  13.485
   35    HE2  HIS   5           HE2      HIS   5 -12.658  15.453  11.599
   36    H    HIS   6           H        HIS   6 -12.006  22.250  13.983
   37    HA   HIS   6           HA       HIS   6 -11.680  21.954  11.099
   38    HB2  HIS   6           HB2      HIS   6 -12.319  24.427  12.763
   39    HB3  HIS   6           HB3      HIS   6 -12.296  24.382  11.000
   40    HD2  HIS   6           HD2      HIS   6 -14.835  24.203  13.672
   41    HE1  HIS   6           HE1      HIS   6 -16.374  21.791  10.560
   42    HE2  HIS   6           HE2      HIS   6 -16.927  23.062  12.666
   43    H    HIS   7           H        HIS   7  -9.479  21.374  10.981
   44    HA   HIS   7           HA       HIS   7  -7.759  23.749  10.682
   45    HB2  HIS   7           HB2      HIS   7  -7.055  22.650  12.826
   46    HB3  HIS   7           HB3      HIS   7  -6.785  21.142  11.964
   47    HD2  HIS   7           HD2      HIS   7  -4.435  21.046  10.401
   48    HE1  HIS   7           HE1      HIS   7  -2.943  24.752  11.786
   49    HE2  HIS   7           HE2      HIS   7  -2.366  22.578  10.635
   50    H    HIS   8           H        HIS   8  -7.065  23.794   8.613
   51    HA   HIS   8           HA       HIS   8  -7.613  21.641   6.799
   52    HB2  HIS   8           HB2      HIS   8  -7.828  24.057   6.158
   53    HB3  HIS   8           HB3      HIS   8  -6.082  24.229   6.265
   54    HD2  HIS   8           HD2      HIS   8  -4.655  23.329   4.063
   55    HE1  HIS   8           HE1      HIS   8  -8.026  21.956   1.912
   56    HE2  HIS   8           HE2      HIS   8  -5.592  22.613   1.764
   57    H    SER   9           H        SER   9  -6.333  19.915   7.575
   58    HA   SER   9           HA       SER   9  -3.432  20.019   7.017
   59    HB2  SER   9           HB2      SER   9  -5.128  17.841   8.325
   60    HB3  SER   9           HB3      SER   9  -3.391  17.721   8.037
   61    HG   SER   9           HG       SER   9  -4.787  19.179   9.941
   62    H    HIS  10           H        HIS  10  -3.661  20.223   4.724
   63    HA   HIS  10           HA       HIS  10  -5.102  18.336   3.114
   64    HB2  HIS  10           HB2      HIS  10  -4.508  20.627   2.300
   65    HB3  HIS  10           HB3      HIS  10  -2.802  20.183   2.305
   66    HD1  HIS  10           HD1      HIS  10  -2.082  18.320   0.516
   67    HD2  HIS  10           HD2      HIS  10  -5.905  19.867   0.016
   68    HE1  HIS  10           HE1      HIS  10  -2.777  17.650  -1.791
   69    HE2  HIS  10           HE2      HIS  10  -5.151  18.442  -2.000
   70    H    MET  11           H        MET  11  -1.565  18.852   3.401
   71    HA   MET  11           HA       MET  11   0.248  17.530   3.543
   72    HB2  MET  11           HB2      MET  11  -1.028  16.406   5.361
   73    HB3  MET  11           HB3      MET  11  -1.703  15.280   4.195
   74    HG2  MET  11           HG2      MET  11   0.556  14.394   3.753
   75    HG3  MET  11           HG3      MET  11   1.224  15.523   4.937
   76    HE1  MET  11           HE1      MET  11   2.382  13.542   6.253
   77    HE2  MET  11           HE2      MET  11   1.753  12.399   5.062
   78    HE3  MET  11           HE3      MET  11   1.528  12.094   6.783
   79    H    GLY  12           H        GLY  12   1.579  16.190   2.229
   80    HA2  GLY  12           HA2      GLY  12   1.276  14.129   0.653
   81    HA3  GLY  12           HA3      GLY  12   0.418  15.294  -0.340
   82    H    GLY  13           H        GLY  13   2.055  14.582  -1.920
   83    HA2  GLY  13           HA2      GLY  13   4.000  16.526  -2.474
   84    HA3  GLY  13           HA3      GLY  13   4.837  15.179  -1.707
   85    H    GLY  14           H        GLY  14   5.387  15.982  -4.349
   86    HA2  GLY  14           HA2      GLY  14   4.296  13.738  -5.985
   87    HA3  GLY  14           HA3      GLY  14   4.535  15.349  -6.637
   88    H    LYS  15           H        LYS  15   7.155  15.386  -4.924
   89    HA   LYS  15           HA       LYS  15   8.813  14.028  -6.978
   90    HB2  LYS  15           HB2      LYS  15   9.543  16.439  -5.256
   91    HB3  LYS  15           HB3      LYS  15  10.552  15.731  -6.511
   92    HG2  LYS  15           HG2      LYS  15   7.891  17.137  -6.919
   93    HG3  LYS  15           HG3      LYS  15   9.486  17.772  -7.332
   94    HD2  LYS  15           HD2      LYS  15   9.772  16.044  -9.048
   95    HD3  LYS  15           HD3      LYS  15   8.252  15.280  -8.581
   96    HE2  LYS  15           HE2      LYS  15   7.972  16.608 -10.626
   97    HE3  LYS  15           HE3      LYS  15   7.012  17.281  -9.308
   98    HZ1  LYS  15           HZ1      LYS  15   8.156  18.991 -10.568
   99    HZ2  LYS  15           HZ2      LYS  15   9.649  18.287 -10.210
  100    HZ3  LYS  15           HZ3      LYS  15   8.712  18.953  -8.969
  101    H    GLY  16           H        GLY  16   9.598  15.218  -3.690
  102    HA2  GLY  16           HA2      GLY  16  10.583  14.191  -1.889
  103    HA3  GLY  16           HA3      GLY  16  10.186  12.635  -2.592
  104    HA   PRO  17           HA       PRO  17  14.798  14.239  -3.610
  105    HB2  PRO  17           HB2      PRO  17  16.198  13.826  -1.238
  106    HB3  PRO  17           HB3      PRO  17  15.549  15.390  -1.750
  107    HG2  PRO  17           HG2      PRO  17  14.339  13.376   0.147
  108    HG3  PRO  17           HG3      PRO  17  14.466  15.141   0.319
  109    HD2  PRO  17           HD2      PRO  17  12.162  13.989  -0.457
  110    HD3  PRO  17           HD3      PRO  17  12.683  15.535  -1.161
  111    H    ALA  18           H        ALA  18  15.823  12.622  -4.670
  112    HA   ALA  18           HA       ALA  18  15.134   9.897  -4.378
  113    HB1  ALA  18           HB1      ALA  18  15.788  10.884  -6.534
  114    HB2  ALA  18           HB2      ALA  18  16.772   9.472  -6.159
  115    HB3  ALA  18           HB3      ALA  18  17.440  11.093  -5.953
  116    H    ALA  19           H        ALA  19  15.629   9.049  -2.398
  117    HA   ALA  19           HA       ALA  19  18.465   8.648  -1.669
  118    HB1  ALA  19           HB1      ALA  19  16.320   9.604   0.263
  119    HB2  ALA  19           HB2      ALA  19  17.639  10.588  -0.369
  120    HB3  ALA  19           HB3      ALA  19  17.989   9.214   0.680
  121    H    GLU  20           H        GLU  20  18.610   6.976   0.186
  122    HA   GLU  20           HA       GLU  20  16.583   4.852   0.042
  123    HB2  GLU  20           HB2      GLU  20  18.370   3.160  -0.612
  124    HB3  GLU  20           HB3      GLU  20  17.898   4.276  -1.886
  125    HG2  GLU  20           HG2      GLU  20  19.928   5.616  -1.507
  126    HG3  GLU  20           HG3      GLU  20  20.399   4.548  -0.185
  127    H    GLU  21           H        GLU  21  16.244   4.290   2.096
  128    HA   GLU  21           HA       GLU  21  18.303   3.470   3.921
  129    HB2  GLU  21           HB2      GLU  21  18.003   5.218   5.621
  130    HB3  GLU  21           HB3      GLU  21  18.522   5.946   4.107
  131    HG2  GLU  21           HG2      GLU  21  16.050   6.467   3.676
  132    HG3  GLU  21           HG3      GLU  21  15.767   6.034   5.362
  133    HA   PRO  22           HA       PRO  22  14.938   1.098   5.788
  134    HB2  PRO  22           HB2      PRO  22  15.395   1.404   8.533
  135    HB3  PRO  22           HB3      PRO  22  16.275   0.289   7.485
  136    HG2  PRO  22           HG2      PRO  22  17.061   3.068   8.357
  137    HG3  PRO  22           HG3      PRO  22  18.043   1.582   8.325
  138    HD2  PRO  22           HD2      PRO  22  18.290   3.395   6.382
  139    HD3  PRO  22           HD3      PRO  22  18.291   1.661   5.977
  140    H    LEU  23           H        LEU  23  12.921   1.209   7.002
  141    HA   LEU  23           HA       LEU  23  11.475   3.601   6.670
  142    HB2  LEU  23           HB2      LEU  23  10.775   1.130   8.302
  143    HB3  LEU  23           HB3      LEU  23   9.648   2.429   7.950
  144    HG   LEU  23           HG       LEU  23  10.934   0.597   5.884
  145   HD11  LEU  23          HD11      LEU  23   8.056   0.727   6.844
  146   HD12  LEU  23          HD12      LEU  23   9.216  -0.552   7.208
  147   HD13  LEU  23          HD13      LEU  23   8.668  -0.307   5.550
  148   HD21  LEU  23          HD21      LEU  23  10.590   2.838   4.917
  149   HD22  LEU  23          HD22      LEU  23   8.911   2.837   5.458
  150   HD23  LEU  23          HD23      LEU  23   9.440   1.691   4.225
  151    H    SER  24           H        SER  24  11.649   5.390   7.791
  152    HA   SER  24           HA       SER  24  11.606   5.568  10.676
  153    HB2  SER  24           HB2      SER  24  13.801   6.826  10.822
  154    HB3  SER  24           HB3      SER  24  14.014   5.133  10.386
  155    HG   SER  24           HG       SER  24  14.226   5.792   8.198
  156    H    LEU  25           H        LEU  25  11.050   7.702  11.362
  157    HA   LEU  25           HA       LEU  25   9.413   9.175   9.620
  158    HB2  LEU  25           HB2      LEU  25   9.241   9.008  12.145
  159    HB3  LEU  25           HB3      LEU  25  10.583  10.131  12.260
  160    HG   LEU  25           HG       LEU  25   9.204  11.893  11.154
  161   HD11  LEU  25          HD11      LEU  25   6.781  11.549  10.810
  162   HD12  LEU  25          HD12      LEU  25   6.962   9.843  11.223
  163   HD13  LEU  25          HD13      LEU  25   7.749  10.494   9.783
  164   HD21  LEU  25          HD21      LEU  25   7.674  12.339  13.028
  165   HD22  LEU  25          HD22      LEU  25   9.235  11.776  13.616
  166   HD23  LEU  25          HD23      LEU  25   7.854  10.677  13.596
  167    H    LEU  26           H        LEU  26   9.586  11.600   9.183
  168    HA   LEU  26           HA       LEU  26  10.451  13.272   7.961
  169    HB2  LEU  26           HB2      LEU  26  12.373  13.493   9.455
  170    HB3  LEU  26           HB3      LEU  26  13.206  12.172   8.667
  171    HG   LEU  26           HG       LEU  26  12.538  14.650   7.040
  172   HD11  LEU  26          HD11      LEU  26  14.636  15.742   7.707
  173   HD12  LEU  26          HD12      LEU  26  14.941  14.478   8.901
  174   HD13  LEU  26          HD13      LEU  26  13.559  15.558   9.088
  175   HD21  LEU  26          HD21      LEU  26  14.940  12.770   6.942
  176   HD22  LEU  26          HD22      LEU  26  14.583  14.080   5.812
  177   HD23  LEU  26          HD23      LEU  26  13.523  12.673   5.887
  178    H    ASP  27           H        ASP  27   9.814  13.038   5.937
  179    HA   ASP  27           HA       ASP  27   9.400  12.233   3.874
  180    HB2  ASP  27           HB2      ASP  27  12.422  11.849   4.003
  181    HB3  ASP  27           HB3      ASP  27  11.511  11.491   2.536
  182    H    ASP  28           H        ASP  28   9.231  10.248   6.160
  183    HA   ASP  28           HA       ASP  28   9.966   7.688   5.230
  184    HB2  ASP  28           HB2      ASP  28   9.323   8.246   7.600
  185    HB3  ASP  28           HB3      ASP  28   7.631   8.327   7.087
  186    H    MET  29           H        MET  29   7.048   9.629   4.714
  187    HA   MET  29           HA       MET  29   5.516   7.816   3.201
  188    HB2  MET  29           HB2      MET  29   4.457   9.807   3.983
  189    HB3  MET  29           HB3      MET  29   5.679  10.847   3.270
  190    HG2  MET  29           HG2      MET  29   4.805  10.542   1.080
  191    HG3  MET  29           HG3      MET  29   3.799   9.187   1.586
  192    HE1  MET  29           HE1      MET  29   0.836  10.798   3.390
  193    HE2  MET  29           HE2      MET  29   2.216   9.900   4.032
  194    HE3  MET  29           HE3      MET  29   1.439   9.379   2.531
  195    H    ASN  30           H        ASN  30   8.129  10.038   2.180
  196    HA   ASN  30           HA       ASN  30   8.050   9.571  -0.624
  197    HB2  ASN  30           HB2      ASN  30   9.270  11.483   0.301
  198    HB3  ASN  30           HB3      ASN  30  10.329  10.425   1.223
  199   HD21  ASN  30          HD21      ASN  30  12.213  11.214   0.318
  200   HD22  ASN  30          HD22      ASN  30  12.656  10.951  -1.330
  201    H    HIS  31           H        HIS  31  10.045   8.075   1.948
  202    HA   HIS  31           HA       HIS  31  11.410   6.202   0.313
  203    HB2  HIS  31           HB2      HIS  31  10.982   6.322   3.320
  204    HB3  HIS  31           HB3      HIS  31  11.984   5.093   2.548
  205    HD2  HIS  31           HD2      HIS  31  12.361   8.610   3.933
  206    HE1  HIS  31           HE1      HIS  31  15.625   7.949   1.339
  207    HE2  HIS  31           HE2      HIS  31  14.787   9.240   3.332
  208    H    CYS  32           H        CYS  32   8.410   5.991   2.141
  209    HA   CYS  32           HA       CYS  32   7.894   3.226   1.820
  210    HB2  CYS  32           HB2      CYS  32   6.091   5.567   2.481
  211    HB3  CYS  32           HB3      CYS  32   5.426   3.959   2.233
  212    HG   CYS  32           HG       CYS  32   7.496   4.995   4.748
  213    H    TYR  33           H        TYR  33   6.595   6.043   0.023
  214    HA   TYR  33           HA       TYR  33   5.185   4.609  -1.938
  215    HB2  TYR  33           HB2      TYR  33   6.242   7.431  -1.799
  216    HB3  TYR  33           HB3      TYR  33   5.588   6.853  -3.326
  217    HD1  TYR  33           HD1      TYR  33   3.300   5.175  -2.357
  218    HD2  TYR  33           HD2      TYR  33   4.584   9.059  -1.100
  219    HE1  TYR  33           HE1      TYR  33   1.008   5.738  -1.738
  220    HE2  TYR  33           HE2      TYR  33   2.286   9.607  -0.459
  221    HH   TYR  33           HH       TYR  33   0.024   8.913  -0.974
  222    H    SER  34           H        SER  34   8.587   5.617  -1.889
  223    HA   SER  34           HA       SER  34   9.285   4.887  -4.530
  224    HB2  SER  34           HB2      SER  34  10.758   6.264  -3.091
  225    HB3  SER  34           HB3      SER  34  11.053   4.876  -2.045
  226    HG   SER  34           HG       SER  34  12.594   4.366  -3.371
  227    H    ARG  35           H        ARG  35   9.514   3.046  -1.475
  228    HA   ARG  35           HA       ARG  35  10.476   0.601  -2.468
  229    HB2  ARG  35           HB2      ARG  35  10.513   1.310  -0.091
  230    HB3  ARG  35           HB3      ARG  35   8.755   1.242  -0.023
  231    HG2  ARG  35           HG2      ARG  35   9.668  -0.689   1.079
  232    HG3  ARG  35           HG3      ARG  35   8.865  -1.203  -0.404
  233    HD2  ARG  35           HD2      ARG  35  10.972  -1.564  -1.518
  234    HD3  ARG  35           HD3      ARG  35  11.863  -0.758  -0.219
  235    HE   ARG  35           HE       ARG  35  10.620  -2.834   1.028
  236   HH11  ARG  35          HH11      ARG  35  12.738  -2.750  -1.709
  237   HH12  ARG  35          HH12      ARG  35  13.478  -4.251  -1.288
  238   HH21  ARG  35          HH21      ARG  35  11.615  -4.713   1.532
  239   HH22  ARG  35          HH22      ARG  35  12.862  -5.340   0.508
  240    H    LEU  36           H        LEU  36   7.149   1.807  -2.063
  241    HA   LEU  36           HA       LEU  36   5.733  -0.545  -2.704
  242    HB2  LEU  36           HB2      LEU  36   4.951   2.374  -3.009
  243    HB3  LEU  36           HB3      LEU  36   3.836   1.047  -3.294
  244    HG   LEU  36           HG       LEU  36   5.174   1.662  -0.625
  245   HD11  LEU  36          HD11      LEU  36   2.954   2.362   0.152
  246   HD12  LEU  36          HD12      LEU  36   2.299   2.121  -1.468
  247   HD13  LEU  36          HD13      LEU  36   3.513   3.368  -1.183
  248   HD21  LEU  36          HD21      LEU  36   4.749  -0.749  -0.863
  249   HD22  LEU  36          HD22      LEU  36   3.064  -0.431  -1.282
  250   HD23  LEU  36          HD23      LEU  36   3.662  -0.042   0.333
  251    H    ARG  37           H        ARG  37   6.696   2.203  -4.820
  252    HA   ARG  37           HA       ARG  37   5.690   1.261  -7.262
  253    HB2  ARG  37           HB2      ARG  37   8.125   2.991  -6.732
  254    HB3  ARG  37           HB3      ARG  37   7.446   2.716  -8.335
  255    HG2  ARG  37           HG2      ARG  37   5.301   3.726  -7.583
  256    HG3  ARG  37           HG3      ARG  37   6.023   4.032  -6.002
  257    HD2  ARG  37           HD2      ARG  37   6.924   5.209  -8.646
  258    HD3  ARG  37           HD3      ARG  37   6.047   6.046  -7.372
  259    HE   ARG  37           HE       ARG  37   8.787   4.982  -6.982
  260   HH11  ARG  37          HH11      ARG  37   6.540   7.596  -6.583
  261   HH12  ARG  37          HH12      ARG  37   7.708   8.601  -5.800
  262   HH21  ARG  37          HH21      ARG  37  10.250   6.305  -5.999
  263   HH22  ARG  37          HH22      ARG  37   9.769   7.885  -5.482
  264    H    GLU  38           H        GLU  38   8.429   0.114  -5.491
  265    HA   GLU  38           HA       GLU  38   9.794  -1.122  -7.770
  266    HB2  GLU  38           HB2      GLU  38  10.432  -1.075  -4.789
  267    HB3  GLU  38           HB3      GLU  38  11.439  -1.856  -5.995
  268    HG2  GLU  38           HG2      GLU  38  10.826   1.106  -5.879
  269    HG3  GLU  38           HG3      GLU  38  12.312   0.349  -5.315
  270    H    LEU  39           H        LEU  39   7.770  -2.038  -5.039
  271    HA   LEU  39           HA       LEU  39   7.991  -4.912  -5.513
  272    HB2  LEU  39           HB2      LEU  39   6.320  -3.297  -3.548
  273    HB3  LEU  39           HB3      LEU  39   6.329  -5.052  -3.612
  274    HG   LEU  39           HG       LEU  39   8.798  -3.366  -3.009
  275   HD11  LEU  39          HD11      LEU  39   7.044  -4.888  -1.054
  276   HD12  LEU  39          HD12      LEU  39   7.163  -3.132  -1.186
  277   HD13  LEU  39          HD13      LEU  39   8.561  -4.072  -0.668
  278   HD21  LEU  39          HD21      LEU  39   8.362  -6.378  -2.815
  279   HD22  LEU  39          HD22      LEU  39   9.817  -5.516  -2.311
  280   HD23  LEU  39          HD23      LEU  39   9.362  -5.545  -4.012
  281    H    VAL  40           H        VAL  40   5.878  -2.326  -6.444
  282    HA   VAL  40           HA       VAL  40   3.627  -4.070  -7.137
  283    HB   VAL  40           HB       VAL  40   3.891  -1.031  -7.321
  284   HG11  VAL  40          HG11      VAL  40   1.422  -2.764  -7.755
  285   HG12  VAL  40          HG12      VAL  40   2.270  -1.824  -8.983
  286   HG13  VAL  40          HG13      VAL  40   1.435  -1.000  -7.670
  287   HG21  VAL  40          HG21      VAL  40   2.423  -2.754  -5.275
  288   HG22  VAL  40          HG22      VAL  40   2.375  -0.989  -5.361
  289   HG23  VAL  40          HG23      VAL  40   3.895  -1.807  -5.000
  290    HA   PRO  41           HA       PRO  41   4.954  -3.924 -11.558
  291    HB2  PRO  41           HB2      PRO  41   2.922  -5.992 -12.053
  292    HB3  PRO  41           HB3      PRO  41   4.680  -6.127 -12.159
  293    HG2  PRO  41           HG2      PRO  41   3.191  -7.388 -10.225
  294    HG3  PRO  41           HG3      PRO  41   4.885  -6.907  -9.996
  295    HD2  PRO  41           HD2      PRO  41   2.377  -5.501  -9.071
  296    HD3  PRO  41           HD3      PRO  41   3.899  -5.788  -8.192
  297    H    GLY  42           H        GLY  42   3.533  -3.773 -13.649
  298    HA2  GLY  42           HA2      GLY  42   1.847  -2.757 -14.864
  299    HA3  GLY  42           HA3      GLY  42   0.871  -2.659 -13.409
  300    H    VAL  43           H        VAL  43   3.857  -1.276 -12.782
  301    HA   VAL  43           HA       VAL  43   2.913   1.475 -13.142
  302    HB   VAL  43           HB       VAL  43   5.490   0.436 -11.849
  303   HG11  VAL  43          HG11      VAL  43   4.306   3.249 -11.812
  304   HG12  VAL  43          HG12      VAL  43   5.775   2.746 -12.647
  305   HG13  VAL  43          HG13      VAL  43   5.715   2.719 -10.884
  306   HG21  VAL  43          HG21      VAL  43   2.910   1.378 -10.518
  307   HG22  VAL  43          HG22      VAL  43   4.395   0.927  -9.676
  308   HG23  VAL  43          HG23      VAL  43   3.498  -0.285 -10.590
  309    HA   PRO  44           HA       PRO  44   5.303   1.394 -17.095
  310    HB2  PRO  44           HB2      PRO  44   4.190   4.140 -17.483
  311    HB3  PRO  44           HB3      PRO  44   4.029   2.710 -18.511
  312    HG2  PRO  44           HG2      PRO  44   1.937   3.625 -17.074
  313    HG3  PRO  44           HG3      PRO  44   2.197   1.881 -17.305
  314    HD2  PRO  44           HD2      PRO  44   2.904   3.598 -14.910
  315    HD3  PRO  44           HD3      PRO  44   2.092   2.013 -14.951
  316    H    ARG  45           H        ARG  45   7.365   2.068 -17.481
  317    HA   ARG  45           HA       ARG  45   8.838   3.522 -15.530
  318    HB2  ARG  45           HB2      ARG  45   9.591   2.577 -18.323
  319    HB3  ARG  45           HB3      ARG  45  10.746   3.299 -17.208
  320    HG2  ARG  45           HG2      ARG  45   9.212   0.718 -16.753
  321    HG3  ARG  45           HG3      ARG  45  10.916   0.852 -17.197
  322    HD2  ARG  45           HD2      ARG  45  11.320   2.095 -15.048
  323    HD3  ARG  45           HD3      ARG  45   9.638   1.792 -14.609
  324    HE   ARG  45           HE       ARG  45  10.119  -0.558 -14.518
  325   HH11  ARG  45          HH11      ARG  45  12.942   1.431 -14.710
  326   HH12  ARG  45          HH12      ARG  45  13.961   0.223 -14.016
  327   HH21  ARG  45          HH21      ARG  45  11.459  -2.079 -13.633
  328   HH22  ARG  45          HH22      ARG  45  13.142  -1.734 -13.436
  329    H    GLY  46           H        GLY  46   7.446   4.471 -18.637
  330    HA2  GLY  46           HA2      GLY  46   8.551   7.191 -18.498
  331    HA3  GLY  46           HA3      GLY  46   7.526   6.527 -19.760
  332    H    THR  47           H        THR  47   6.518   6.125 -16.433
  333    HA   THR  47           HA       THR  47   4.742   8.491 -16.499
  334    HB   THR  47           HB       THR  47   3.728   5.680 -15.819
  335    HG1  THR  47           HG1      THR  47   3.585   7.253 -18.168
  336   HG21  THR  47          HG21      THR  47   2.553   7.467 -14.557
  337   HG22  THR  47          HG22      THR  47   1.485   6.736 -15.759
  338   HG23  THR  47          HG23      THR  47   2.210   8.320 -16.052
  339    H    GLN  48           H        GLN  48   5.661   9.560 -14.780
  340    HA   GLN  48           HA       GLN  48   6.357   8.253 -12.288
  341    HB2  GLN  48           HB2      GLN  48   7.638  10.220 -13.090
  342    HB3  GLN  48           HB3      GLN  48   6.194  11.221 -12.987
  343    HG2  GLN  48           HG2      GLN  48   6.141  10.952 -10.547
  344    HG3  GLN  48           HG3      GLN  48   7.534   9.874 -10.610
  345   HE21  GLN  48          HE21      GLN  48   7.204  12.445  -9.189
  346   HE22  GLN  48          HE22      GLN  48   8.486  13.455  -9.753
  347    H    LEU  49           H        LEU  49   4.507   7.322 -11.471
  348    HA   LEU  49           HA       LEU  49   1.979   8.538 -11.134
  349    HB2  LEU  49           HB2      LEU  49   3.240   6.346  -9.449
  350    HB3  LEU  49           HB3      LEU  49   1.530   6.740  -9.501
  351    HG   LEU  49           HG       LEU  49   3.155   5.593 -11.806
  352   HD11  LEU  49          HD11      LEU  49   1.811   3.559 -11.490
  353   HD12  LEU  49          HD12      LEU  49   1.019   4.287 -10.092
  354   HD13  LEU  49          HD13      LEU  49   2.748   3.940 -10.045
  355   HD21  LEU  49          HD21      LEU  49   1.015   5.390 -13.023
  356   HD22  LEU  49          HD22      LEU  49   1.384   7.075 -12.670
  357   HD23  LEU  49          HD23      LEU  49   0.178   6.221 -11.707
  358    H    SER  50           H        SER  50   1.170   9.905  -9.568
  359    HA   SER  50           HA       SER  50   3.148  11.425  -8.092
  360    HB2  SER  50           HB2      SER  50   0.155  11.899  -8.418
  361    HB3  SER  50           HB3      SER  50   1.308  13.048  -7.737
  362    HG   SER  50           HG       SER  50   1.531  11.984 -10.360
  363    H    GLN  51           H        GLN  51  -0.137  10.510  -6.946
  364    HA   GLN  51           HA       GLN  51   0.969   9.714  -4.308
  365    HB2  GLN  51           HB2      GLN  51  -1.360  11.648  -4.731
  366    HB3  GLN  51           HB3      GLN  51  -0.852  11.005  -3.175
  367    HG2  GLN  51           HG2      GLN  51   1.287  12.177  -3.357
  368    HG3  GLN  51           HG3      GLN  51   0.835  12.779  -4.952
  369   HE21  GLN  51          HE21      GLN  51  -0.707  14.453  -5.087
  370   HE22  GLN  51          HE22      GLN  51  -1.185  15.381  -3.717
  371    H    VAL  52           H        VAL  52  -2.310  10.158  -5.679
  372    HA   VAL  52           HA       VAL  52  -3.327   7.880  -4.267
  373    HB   VAL  52           HB       VAL  52  -4.852   9.268  -6.513
  374   HG11  VAL  52          HG11      VAL  52  -5.892   7.268  -5.521
  375   HG12  VAL  52          HG12      VAL  52  -6.827   8.716  -5.139
  376   HG13  VAL  52          HG13      VAL  52  -5.784   7.994  -3.910
  377   HG21  VAL  52          HG21      VAL  52  -3.930  11.083  -5.124
  378   HG22  VAL  52          HG22      VAL  52  -4.591  10.330  -3.671
  379   HG23  VAL  52          HG23      VAL  52  -5.680  10.955  -4.913
  380    H    GLU  53           H        GLU  53  -2.368   8.508  -7.596
  381    HA   GLU  53           HA       GLU  53  -3.125   6.212  -8.948
  382    HB2  GLU  53           HB2      GLU  53  -0.501   7.748  -9.173
  383    HB3  GLU  53           HB3      GLU  53  -1.081   6.584 -10.362
  384    HG2  GLU  53           HG2      GLU  53  -2.978   8.015 -10.909
  385    HG3  GLU  53           HG3      GLU  53  -2.538   9.145  -9.629
  386    H    ILE  54           H        ILE  54  -0.221   6.697  -6.905
  387    HA   ILE  54           HA       ILE  54   0.902   4.111  -7.182
  388    HB   ILE  54           HB       ILE  54   1.159   5.987  -4.782
  389   HG12  ILE  54          HG12      ILE  54   2.957   5.760  -7.248
  390   HG13  ILE  54          HG13      ILE  54   1.864   7.094  -6.902
  391   HG21  ILE  54          HG21      ILE  54   1.885   3.718  -4.201
  392   HG22  ILE  54          HG22      ILE  54   3.292   4.770  -4.316
  393   HG23  ILE  54          HG23      ILE  54   2.926   3.645  -5.627
  394   HD11  ILE  54          HD11      ILE  54   3.198   7.640  -4.903
  395   HD12  ILE  54          HD12      ILE  54   4.128   7.715  -6.400
  396   HD13  ILE  54          HD13      ILE  54   4.314   6.335  -5.319
  397    H    LEU  55           H        LEU  55  -1.240   5.482  -4.646
  398    HA   LEU  55           HA       LEU  55  -1.555   3.303  -2.958
  399    HB2  LEU  55           HB2      LEU  55  -3.615   5.398  -3.743
  400    HB3  LEU  55           HB3      LEU  55  -3.796   4.311  -2.376
  401    HG   LEU  55           HG       LEU  55  -1.602   6.402  -2.656
  402   HD11  LEU  55          HD11      LEU  55  -3.798   7.456  -2.329
  403   HD12  LEU  55          HD12      LEU  55  -2.788   7.646  -0.898
  404   HD13  LEU  55          HD13      LEU  55  -4.084   6.449  -0.906
  405   HD21  LEU  55          HD21      LEU  55  -0.846   4.467  -1.338
  406   HD22  LEU  55          HD22      LEU  55  -2.281   4.581  -0.312
  407   HD23  LEU  55          HD23      LEU  55  -1.078   5.872  -0.297
  408    H    GLN  56           H        GLN  56  -3.564   4.116  -5.775
  409    HA   GLN  56           HA       GLN  56  -5.357   1.962  -5.717
  410    HB2  GLN  56           HB2      GLN  56  -4.353   3.639  -8.051
  411    HB3  GLN  56           HB3      GLN  56  -5.708   2.522  -8.162
  412    HG2  GLN  56           HG2      GLN  56  -6.989   3.837  -6.545
  413    HG3  GLN  56           HG3      GLN  56  -5.614   4.911  -6.291
  414   HE21  GLN  56          HE21      GLN  56  -6.895   6.710  -6.896
  415   HE22  GLN  56          HE22      GLN  56  -7.282   7.028  -8.546
  416    H    ARG  57           H        ARG  57  -2.241   2.314  -7.441
  417    HA   ARG  57           HA       ARG  57  -2.170  -0.207  -8.719
  418    HB2  ARG  57           HB2      ARG  57  -0.010   1.752  -7.892
  419    HB3  ARG  57           HB3      ARG  57   0.408   0.237  -8.673
  420    HG2  ARG  57           HG2      ARG  57  -1.544   2.140  -9.973
  421    HG3  ARG  57           HG3      ARG  57   0.191   2.397 -10.109
  422    HD2  ARG  57           HD2      ARG  57  -0.533   1.224 -12.071
  423    HD3  ARG  57           HD3      ARG  57   0.403   0.096 -11.091
  424    HE   ARG  57           HE       ARG  57  -2.187  -0.394 -10.364
  425   HH11  ARG  57          HH11      ARG  57  -0.630  -0.310 -13.468
  426   HH12  ARG  57          HH12      ARG  57  -1.650  -1.551 -14.106
  427   HH21  ARG  57          HH21      ARG  57  -3.438  -1.975 -11.234
  428   HH22  ARG  57          HH22      ARG  57  -3.196  -2.472 -12.871
  429    H    VAL  58           H        VAL  58  -1.099   0.771  -5.456
  430    HA   VAL  58           HA       VAL  58   0.160  -1.676  -4.747
  431    HB   VAL  58           HB       VAL  58  -1.128   0.390  -2.892
  432   HG11  VAL  58          HG11      VAL  58  -0.835  -1.762  -1.729
  433   HG12  VAL  58          HG12      VAL  58   0.299  -0.568  -1.103
  434   HG13  VAL  58          HG13      VAL  58   0.862  -1.821  -2.215
  435   HG21  VAL  58          HG21      VAL  58   1.149   1.283  -2.593
  436   HG22  VAL  58          HG22      VAL  58   0.680   1.343  -4.289
  437   HG23  VAL  58          HG23      VAL  58   1.789   0.092  -3.731
  438    H    ILE  59           H        ILE  59  -3.187  -0.483  -4.325
  439    HA   ILE  59           HA       ILE  59  -4.288  -2.718  -2.991
  440    HB   ILE  59           HB       ILE  59  -5.699  -0.855  -4.959
  441   HG12  ILE  59          HG12      ILE  59  -5.583  -0.587  -1.914
  442   HG13  ILE  59          HG13      ILE  59  -4.512   0.286  -2.999
  443   HG21  ILE  59          HG21      ILE  59  -7.788  -1.467  -3.752
  444   HG22  ILE  59          HG22      ILE  59  -6.882  -2.615  -2.763
  445   HG23  ILE  59          HG23      ILE  59  -7.035  -2.878  -4.501
  446   HD11  ILE  59          HD11      ILE  59  -7.509   0.531  -2.906
  447   HD12  ILE  59          HD12      ILE  59  -6.432   1.412  -3.995
  448   HD13  ILE  59          HD13      ILE  59  -6.333   1.671  -2.253
  449    H    ASP  60           H        ASP  60  -4.034  -1.990  -6.504
  450    HA   ASP  60           HA       ASP  60  -5.237  -4.279  -7.577
  451    HB2  ASP  60           HB2      ASP  60  -2.893  -2.701  -8.715
  452    HB3  ASP  60           HB3      ASP  60  -3.871  -3.846  -9.631
  453    H    TYR  61           H        TYR  61  -1.845  -3.718  -6.748
  454    HA   TYR  61           HA       TYR  61  -0.742  -6.209  -7.354
  455    HB2  TYR  61           HB2      TYR  61   0.755  -4.425  -6.906
  456    HB3  TYR  61           HB3      TYR  61  -0.031  -4.014  -5.390
  457    HD1  TYR  61           HD1      TYR  61   2.110  -6.642  -7.006
  458    HD2  TYR  61           HD2      TYR  61   0.820  -4.887  -3.315
  459    HE1  TYR  61           HE1      TYR  61   3.785  -7.959  -5.784
  460    HE2  TYR  61           HE2      TYR  61   2.509  -6.195  -2.122
  461    HH   TYR  61           HH       TYR  61   3.750  -8.240  -2.386
  462    H    ILE  62           H        ILE  62  -2.305  -5.097  -4.329
  463    HA   ILE  62           HA       ILE  62  -1.922  -7.550  -2.907
  464    HB   ILE  62           HB       ILE  62  -3.920  -5.322  -2.285
  465   HG12  ILE  62          HG12      ILE  62  -1.120  -5.773  -1.112
  466   HG13  ILE  62          HG13      ILE  62  -1.503  -4.557  -2.322
  467   HG21  ILE  62          HG21      ILE  62  -2.840  -7.531  -0.480
  468   HG22  ILE  62          HG22      ILE  62  -4.479  -7.444  -1.126
  469   HG23  ILE  62          HG23      ILE  62  -3.926  -6.228   0.021
  470   HD11  ILE  62          HD11      ILE  62  -1.334  -3.563  -0.130
  471   HD12  ILE  62          HD12      ILE  62  -2.565  -4.657   0.504
  472   HD13  ILE  62          HD13      ILE  62  -2.996  -3.446  -0.709
  473    H    LEU  63           H        LEU  63  -4.414  -6.418  -5.146
  474    HA   LEU  63           HA       LEU  63  -6.309  -8.507  -4.699
  475    HB2  LEU  63           HB2      LEU  63  -5.792  -6.885  -7.223
  476    HB3  LEU  63           HB3      LEU  63  -7.181  -7.929  -6.970
  477    HG   LEU  63           HG       LEU  63  -6.568  -5.436  -5.339
  478   HD11  LEU  63          HD11      LEU  63  -7.188  -4.823  -7.617
  479   HD12  LEU  63          HD12      LEU  63  -8.473  -4.391  -6.492
  480   HD13  LEU  63          HD13      LEU  63  -8.642  -5.819  -7.514
  481   HD21  LEU  63          HD21      LEU  63  -8.840  -5.720  -4.397
  482   HD22  LEU  63          HD22      LEU  63  -7.779  -7.065  -3.987
  483   HD23  LEU  63          HD23      LEU  63  -8.996  -7.258  -5.253
  484    H    ASP  64           H        ASP  64  -3.356  -8.333  -6.673
  485    HA   ASP  64           HA       ASP  64  -3.578 -10.918  -7.880
  486    HB2  ASP  64           HB2      ASP  64  -1.158  -9.171  -7.249
  487    HB3  ASP  64           HB3      ASP  64  -1.043 -10.693  -8.111
  488    H    LEU  65           H        LEU  65  -2.339  -9.795  -4.754
  489    HA   LEU  65           HA       LEU  65  -1.211 -12.283  -3.881
  490    HB2  LEU  65           HB2      LEU  65  -2.217  -9.994  -2.151
  491    HB3  LEU  65           HB3      LEU  65  -1.084 -11.247  -1.669
  492    HG   LEU  65           HG       LEU  65  -0.548  -9.065  -3.723
  493   HD11  LEU  65          HD11      LEU  65   1.014  -8.122  -2.110
  494   HD12  LEU  65          HD12      LEU  65   0.604  -9.378  -0.947
  495   HD13  LEU  65          HD13      LEU  65  -0.612  -8.193  -1.427
  496   HD21  LEU  65          HD21      LEU  65   1.347 -11.204  -2.705
  497   HD22  LEU  65          HD22      LEU  65   1.768  -9.868  -3.781
  498   HD23  LEU  65          HD23      LEU  65   0.649 -11.114  -4.327
  499    H    GLN  66           H        GLN  66  -4.372 -10.768  -3.513
  500    HA   GLN  66           HA       GLN  66  -5.480 -12.956  -1.889
  501    HB2  GLN  66           HB2      GLN  66  -6.736 -10.325  -2.791
  502    HB3  GLN  66           HB3      GLN  66  -7.489 -11.485  -1.703
  503    HG2  GLN  66           HG2      GLN  66  -4.944  -9.927  -1.138
  504    HG3  GLN  66           HG3      GLN  66  -6.541  -9.555  -0.488
  505   HE21  GLN  66          HE21      GLN  66  -4.035 -10.226   0.888
  506   HE22  GLN  66          HE22      GLN  66  -4.397 -11.577   1.894
  507    H    VAL  67           H        VAL  67  -7.786 -13.691  -2.526
  508    HA   VAL  67           HA       VAL  67  -7.789 -14.602  -5.304
  509    HB   VAL  67           HB       VAL  67  -9.739 -15.208  -3.036
  510   HG11  VAL  67          HG11      VAL  67  -9.469 -16.571  -5.748
  511   HG12  VAL  67          HG12      VAL  67 -10.811 -15.560  -5.214
  512   HG13  VAL  67          HG13      VAL  67 -10.518 -17.109  -4.427
  513   HG21  VAL  67          HG21      VAL  67  -7.401 -16.865  -4.081
  514   HG22  VAL  67          HG22      VAL  67  -8.559 -17.382  -2.851
  515   HG23  VAL  67          HG23      VAL  67  -7.477 -16.028  -2.530
  516    H    VAL  68           H        VAL  68  -8.662 -13.359  -6.851
  517    HA   VAL  68           HA       VAL  68 -10.625 -11.285  -6.364
  518    HB   VAL  68           HB       VAL  68  -9.579 -12.324  -9.053
  519   HG11  VAL  68          HG11      VAL  68 -10.971  -9.702  -8.370
  520   HG12  VAL  68          HG12      VAL  68 -11.663 -11.040  -9.290
  521   HG13  VAL  68          HG13      VAL  68 -10.307 -10.126  -9.952
  522   HG21  VAL  68          HG21      VAL  68  -7.976 -10.422  -8.988
  523   HG22  VAL  68          HG22      VAL  68  -7.702 -11.536  -7.651
  524   HG23  VAL  68          HG23      VAL  68  -8.531 -10.005  -7.364
  525    H1   MET   1           H1       MET   1  -8.937  47.738   8.679
  526    H2   MET   1           H2       MET   1  -8.704  48.604  10.114
  527    H3   MET   1           H3       MET   1  -8.003  49.149   8.680
  528    HA   MET   1           HA       MET   1  -9.933  50.450   9.313
  529    HB2  MET   1           HB2      MET   1 -10.154  48.815   6.753
  530    HB3  MET   1           HB3      MET   1 -11.146  50.232   7.076
  531    HG2  MET   1           HG2      MET   1  -9.112  51.627   7.216
  532    HG3  MET   1           HG3      MET   1  -8.119  50.205   6.874
  533    HE1  MET   1           HE1      MET   1  -7.983  52.455   3.586
  534    HE2  MET   1           HE2      MET   1  -7.007  51.718   4.854
  535    HE3  MET   1           HE3      MET   1  -8.114  53.036   5.245
  536    H    GLY   2           H        GLY   2 -12.313  50.574   9.328
  537    HA2  GLY   2           HA2      GLY   2 -14.468  49.414   9.564
  538    HA3  GLY   2           HA3      GLY   2 -13.616  48.101  10.367
  539    H    HIS   3           H        HIS   3 -14.462  51.524  10.642
  540    HA   HIS   3           HA       HIS   3 -14.691  51.369  13.554
  541    HB2  HIS   3           HB2      HIS   3 -12.328  51.943  13.302
  542    HB3  HIS   3           HB3      HIS   3 -12.707  53.208  12.140
  543    HD2  HIS   3           HD2      HIS   3 -13.741  52.625  15.948
  544    HE1  HIS   3           HE1      HIS   3 -12.633  56.656  15.324
  545    HE2  HIS   3           HE2      HIS   3 -13.225  54.915  17.046
  546    H    HIS   4           H        HIS   4 -16.173  52.793  14.354
  547    HA   HIS   4           HA       HIS   4 -17.485  54.763  12.551
  548    HB2  HIS   4           HB2      HIS   4 -18.769  52.988  14.677
  549    HB3  HIS   4           HB3      HIS   4 -19.618  54.216  13.745
  550    HD2  HIS   4           HD2      HIS   4 -18.421  50.546  13.419
  551    HE1  HIS   4           HE1      HIS   4 -20.241  51.679   9.771
  552    HE2  HIS   4           HE2      HIS   4 -19.477  49.736  11.195
  553    H    HIS   5           H        HIS   5 -19.049  56.175  14.195
  554    HA   HIS   5           HA       HIS   5 -17.377  57.751  15.857
  555    HB2  HIS   5           HB2      HIS   5 -20.424  57.564  15.789
  556    HB3  HIS   5           HB3      HIS   5 -19.512  58.825  16.618
  557    HD2  HIS   5           HD2      HIS   5 -20.674  57.864  13.036
  558    HE1  HIS   5           HE1      HIS   5 -18.510  61.489  12.804
  559    HE2  HIS   5           HE2      HIS   5 -19.792  59.751  11.497
  560    H    HIS   6           H        HIS   6 -16.361  56.723  17.486
  561    HA   HIS   6           HA       HIS   6 -15.878  55.806  19.473
  562    HB2  HIS   6           HB2      HIS   6 -18.869  55.833  20.026
  563    HB3  HIS   6           HB3      HIS   6 -17.653  55.371  21.211
  564    HD2  HIS   6           HD2      HIS   6 -16.101  57.486  22.235
  565    HE1  HIS   6           HE1      HIS   6 -18.568  60.504  20.588
  566    HE2  HIS   6           HE2      HIS   6 -16.844  59.964  22.354
  567    H    HIS   7           H        HIS   7 -18.623  54.082  17.914
  568    HA   HIS   7           HA       HIS   7 -18.100  51.481  18.854
  569    HB2  HIS   7           HB2      HIS   7 -19.456  52.389  16.279
  570    HB3  HIS   7           HB3      HIS   7 -19.500  50.743  16.897
  571    HD2  HIS   7           HD2      HIS   7 -21.513  50.236  18.647
  572    HE1  HIS   7           HE1      HIS   7 -22.765  54.237  19.173
  573    HE2  HIS   7           HE2      HIS   7 -23.224  51.825  19.760
  574    H    HIS   8           H        HIS   8 -15.892  50.980  18.696
  575    HA   HIS   8           HA       HIS   8 -14.658  50.678  16.032
  576    HB2  HIS   8           HB2      HIS   8 -12.609  50.009  17.381
  577    HB3  HIS   8           HB3      HIS   8 -13.176  51.651  17.641
  578    HD2  HIS   8           HD2      HIS   8 -12.936  52.249  20.247
  579    HE1  HIS   8           HE1      HIS   8 -13.892  48.451  21.826
  580    HE2  HIS   8           HE2      HIS   8 -13.028  50.759  22.358
  581    H    SER   9           H        SER   9 -16.481  48.831  18.213
  582    HA   SER   9           HA       SER   9 -15.348  46.218  17.355
  583    HB2  SER   9           HB2      SER   9 -15.278  46.658  19.803
  584    HB3  SER   9           HB3      SER   9 -17.027  46.887  19.812
  585    HG   SER   9           HG       SER   9 -15.969  44.702  20.337
  586    H    HIS  10           H        HIS  10 -16.918  44.426  17.179
  587    HA   HIS  10           HA       HIS  10 -19.720  45.052  16.630
  588    HB2  HIS  10           HB2      HIS  10 -18.690  45.424  14.426
  589    HB3  HIS  10           HB3      HIS  10 -17.890  43.858  14.503
  590    HD1  HIS  10           HD1      HIS  10 -19.177  41.883  13.619
  591    HD2  HIS  10           HD2      HIS  10 -21.596  45.223  14.136
  592    HE1  HIS  10           HE1      HIS  10 -21.405  41.251  12.671
  593    HE2  HIS  10           HE2      HIS  10 -22.847  43.281  12.998
  594    H    MET  11           H        MET  11 -20.949  43.482  17.468
  595    HA   MET  11           HA       MET  11 -19.800  40.937  18.333
  596    HB2  MET  11           HB2      MET  11 -21.192  42.250  19.906
  597    HB3  MET  11           HB3      MET  11 -22.558  42.157  18.806
  598    HG2  MET  11           HG2      MET  11 -22.632  39.702  19.118
  599    HG3  MET  11           HG3      MET  11 -21.277  39.812  20.241
  600    HE1  MET  11           HE1      MET  11 -22.920  41.818  23.227
  601    HE2  MET  11           HE2      MET  11 -21.993  42.492  21.887
  602    HE3  MET  11           HE3      MET  11 -21.461  41.002  22.671
  603    H    GLY  12           H        GLY  12 -20.010  39.100  17.199
  604    HA2  GLY  12           HA2      GLY  12 -22.100  38.784  15.110
  605    HA3  GLY  12           HA3      GLY  12 -20.586  37.895  15.197
  606    H    GLY  13           H        GLY  13 -23.819  38.203  16.556
  607    HA2  GLY  13           HA2      GLY  13 -23.571  36.024  18.461
  608    HA3  GLY  13           HA3      GLY  13 -25.013  36.952  18.103
  609    H    GLY  14           H        GLY  14 -22.922  34.377  16.793
  610    HA2  GLY  14           HA2      GLY  14 -23.379  32.375  15.774
  611    HA3  GLY  14           HA3      GLY  14 -25.038  32.543  16.320
  612    H    LYS  15           H        LYS  15 -26.552  33.552  14.969
  613    HA   LYS  15           HA       LYS  15 -27.682  34.152  13.137
  614    HB2  LYS  15           HB2      LYS  15 -25.955  35.979  13.030
  615    HB3  LYS  15           HB3      LYS  15 -25.012  34.983  11.931
  616    HG2  LYS  15           HG2      LYS  15 -26.206  36.610  10.623
  617    HG3  LYS  15           HG3      LYS  15 -26.941  35.035  10.320
  618    HD2  LYS  15           HD2      LYS  15 -28.765  35.592  11.931
  619    HD3  LYS  15           HD3      LYS  15 -28.026  37.173  12.197
  620    HE2  LYS  15           HE2      LYS  15 -29.897  37.376  10.643
  621    HE3  LYS  15           HE3      LYS  15 -28.383  37.721   9.802
  622    HZ1  LYS  15           HZ1      LYS  15 -29.858  35.147   9.722
  623    HZ2  LYS  15           HZ2      LYS  15 -28.423  35.486   8.893
  624    HZ3  LYS  15           HZ3      LYS  15 -29.842  36.313   8.500
  625    H    GLY  16           H        GLY  16 -24.705  32.979  11.461
  626    HA2  GLY  16           HA2      GLY  16 -26.108  31.600   9.419
  627    HA3  GLY  16           HA3      GLY  16 -24.395  31.463   9.766
  628    HA   PRO  17           HA       PRO  17 -27.038  27.710  11.548
  629    HB2  PRO  17           HB2      PRO  17 -27.655  26.138   9.382
  630    HB3  PRO  17           HB3      PRO  17 -28.725  27.415   9.976
  631    HG2  PRO  17           HG2      PRO  17 -26.741  27.530   7.701
  632    HG3  PRO  17           HG3      PRO  17 -28.435  28.072   7.732
  633    HD2  PRO  17           HD2      PRO  17 -26.387  29.813   8.049
  634    HD3  PRO  17           HD3      PRO  17 -27.923  30.024   8.919
  635    H    ALA  18           H        ALA  18 -26.066  25.716  12.049
  636    HA   ALA  18           HA       ALA  18 -23.248  25.550  11.526
  637    HB1  ALA  18           HB1      ALA  18 -25.018  23.655  13.102
  638    HB2  ALA  18           HB2      ALA  18 -24.195  25.075  13.747
  639    HB3  ALA  18           HB3      ALA  18 -23.252  23.713  13.142
  640    H    ALA  19           H        ALA  19 -23.050  25.124   9.316
  641    HA   ALA  19           HA       ALA  19 -23.877  22.511   8.225
  642    HB1  ALA  19           HB1      ALA  19 -23.099  23.425   6.075
  643    HB2  ALA  19           HB2      ALA  19 -22.496  24.867   6.892
  644    HB3  ALA  19           HB3      ALA  19 -24.228  24.538   6.853
  645    H    GLU  20           H        GLU  20 -21.802  22.786  10.353
  646    HA   GLU  20           HA       GLU  20 -19.183  22.347   9.205
  647    HB2  GLU  20           HB2      GLU  20 -20.145  21.976  12.080
  648    HB3  GLU  20           HB3      GLU  20 -18.468  22.135  11.562
  649    HG2  GLU  20           HG2      GLU  20 -18.866  24.454  10.863
  650    HG3  GLU  20           HG3      GLU  20 -20.577  24.304  11.263
  651    H    GLU  21           H        GLU  21 -19.419  20.472   7.916
  652    HA   GLU  21           HA       GLU  21 -20.032  17.901   9.283
  653    HB2  GLU  21           HB2      GLU  21 -21.102  17.140   7.178
  654    HB3  GLU  21           HB3      GLU  21 -21.900  18.558   7.842
  655    HG2  GLU  21           HG2      GLU  21 -20.687  19.987   6.193
  656    HG3  GLU  21           HG3      GLU  21 -19.975  18.536   5.488
  657    HA   PRO  22           HA       PRO  22 -16.127  16.385   7.580
  658    HB2  PRO  22           HB2      PRO  22 -16.461  13.708   7.764
  659    HB3  PRO  22           HB3      PRO  22 -16.397  14.720   9.213
  660    HG2  PRO  22           HG2      PRO  22 -18.824  13.644   7.776
  661    HG3  PRO  22           HG3      PRO  22 -18.451  13.599   9.515
  662    HD2  PRO  22           HD2      PRO  22 -20.079  15.494   8.397
  663    HD3  PRO  22           HD3      PRO  22 -19.083  15.824   9.831
  664    H    LEU  23           H        LEU  23 -15.491  14.347   6.054
  665    HA   LEU  23           HA       LEU  23 -15.365  13.347   4.062
  666    HB2  LEU  23           HB2      LEU  23 -18.285  14.089   3.700
  667    HB3  LEU  23           HB3      LEU  23 -17.392  12.955   2.696
  668    HG   LEU  23           HG       LEU  23 -17.969  12.598   5.666
  669   HD11  LEU  23          HD11      LEU  23 -20.015  12.364   4.351
  670   HD12  LEU  23          HD12      LEU  23 -19.512  10.797   4.978
  671   HD13  LEU  23          HD13      LEU  23 -19.228  11.196   3.283
  672   HD21  LEU  23          HD21      LEU  23 -15.861  11.509   5.075
  673   HD22  LEU  23          HD22      LEU  23 -16.620  10.692   3.707
  674   HD23  LEU  23          HD23      LEU  23 -17.098  10.287   5.357
  675    H    SER  24           H        SER  24 -14.086  14.239   2.641
  676    HA   SER  24           HA       SER  24 -14.488  16.898   1.515
  677    HB2  SER  24           HB2      SER  24 -12.226  16.165   2.255
  678    HB3  SER  24           HB3      SER  24 -12.253  14.862   1.065
  679    HG   SER  24           HG       SER  24 -11.400  17.322   0.712
  680    H    LEU  25           H        LEU  25 -16.581  15.960   0.594
  681    HA   LEU  25           HA       LEU  25 -17.905  15.706  -1.175
  682    HB2  LEU  25           HB2      LEU  25 -15.380  15.910  -2.844
  683    HB3  LEU  25           HB3      LEU  25 -17.012  15.956  -3.494
  684    HG   LEU  25           HG       LEU  25 -15.785  18.018  -1.617
  685   HD11  LEU  25          HD11      LEU  25 -14.891  18.187  -3.884
  686   HD12  LEU  25          HD12      LEU  25 -15.928  19.565  -3.522
  687   HD13  LEU  25          HD13      LEU  25 -16.527  18.258  -4.545
  688   HD21  LEU  25          HD21      LEU  25 -18.572  17.987  -2.842
  689   HD22  LEU  25          HD22      LEU  25 -17.863  19.332  -1.948
  690   HD23  LEU  25          HD23      LEU  25 -18.179  17.807  -1.129
  691    H    LEU  26           H        LEU  26 -15.085  13.753  -2.271
  692    HA   LEU  26           HA       LEU  26 -16.817  11.344  -2.371
  693    HB2  LEU  26           HB2      LEU  26 -16.123  12.376  -4.612
  694    HB3  LEU  26           HB3      LEU  26 -14.477  11.915  -4.242
  695    HG   LEU  26           HG       LEU  26 -16.698   9.835  -4.391
  696   HD11  LEU  26          HD11      LEU  26 -16.750  11.051  -6.520
  697   HD12  LEU  26          HD12      LEU  26 -16.146   9.413  -6.751
  698   HD13  LEU  26          HD13      LEU  26 -15.020  10.775  -6.741
  699   HD21  LEU  26          HD21      LEU  26 -13.691   9.568  -4.800
  700   HD22  LEU  26          HD22      LEU  26 -14.869   8.260  -4.958
  701   HD23  LEU  26          HD23      LEU  26 -14.609   9.021  -3.392
  702    H    ASP  27           H        ASP  27 -13.638  12.681  -1.665
  703    HA   ASP  27           HA       ASP  27 -11.819  12.035  -0.494
  704    HB2  ASP  27           HB2      ASP  27 -13.733   9.999   0.737
  705    HB3  ASP  27           HB3      ASP  27 -12.116  10.326   1.337
  706    H    ASP  28           H        ASP  28 -11.155  11.297  -2.782
  707    HA   ASP  28           HA       ASP  28 -11.244   8.520  -3.473
  708    HB2  ASP  28           HB2      ASP  28 -11.104  10.305  -5.182
  709    HB3  ASP  28           HB3      ASP  28  -9.494  10.739  -4.612
  710    H    MET  29           H        MET  29  -8.461  10.561  -2.436
  711    HA   MET  29           HA       MET  29  -6.553   8.528  -2.069
  712    HB2  MET  29           HB2      MET  29  -5.733  10.763  -2.071
  713    HB3  MET  29           HB3      MET  29  -6.870  11.288  -0.839
  714    HG2  MET  29           HG2      MET  29  -5.633  10.175   0.889
  715    HG3  MET  29           HG3      MET  29  -4.615   9.348  -0.285
  716    HE1  MET  29           HE1      MET  29  -3.713  11.328  -2.338
  717    HE2  MET  29           HE2      MET  29  -2.542  10.369  -1.429
  718    HE3  MET  29           HE3      MET  29  -2.301  12.108  -1.617
  719    H    ASN  30           H        ASN  30  -8.877   9.892   0.253
  720    HA   ASN  30           HA       ASN  30  -8.113   8.421   2.546
  721    HB2  ASN  30           HB2      ASN  30  -9.445  10.495   2.636
  722    HB3  ASN  30           HB3      ASN  30 -10.774   9.699   1.811
  723   HD21  ASN  30          HD21      ASN  30 -12.192  10.180   3.512
  724   HD22  ASN  30          HD22      ASN  30 -12.123   9.345   5.024
  725    H    HIS  31           H        HIS  31 -10.421   7.709  -0.066
  726    HA   HIS  31           HA       HIS  31 -11.559   5.345   1.080
  727    HB2  HIS  31           HB2      HIS  31 -12.566   6.758  -0.815
  728    HB3  HIS  31           HB3      HIS  31 -11.415   5.992  -1.901
  729    HD2  HIS  31           HD2      HIS  31 -14.910   5.441  -0.577
  730    HE1  HIS  31           HE1      HIS  31 -13.586   1.692  -2.009
  731    HE2  HIS  31           HE2      HIS  31 -15.504   2.949  -0.955
  732    H    CYS  32           H        CYS  32  -8.937   5.906  -1.277
  733    HA   CYS  32           HA       CYS  32  -8.244   3.212  -1.776
  734    HB2  CYS  32           HB2      CYS  32  -6.604   5.754  -2.054
  735    HB3  CYS  32           HB3      CYS  32  -6.055   4.173  -2.604
  736    HG   CYS  32           HG       CYS  32  -8.518   6.126  -3.922
  737    H    TYR  33           H        TYR  33  -7.084   5.503   0.657
  738    HA   TYR  33           HA       TYR  33  -5.086   3.870   1.844
  739    HB2  TYR  33           HB2      TYR  33  -6.505   6.410   2.561
  740    HB3  TYR  33           HB3      TYR  33  -5.830   5.525   3.922
  741    HD1  TYR  33           HD1      TYR  33  -3.317   4.505   3.129
  742    HD2  TYR  33           HD2      TYR  33  -5.055   8.219   1.957
  743    HE1  TYR  33           HE1      TYR  33  -1.084   5.438   2.830
  744    HE2  TYR  33           HE2      TYR  33  -2.815   9.165   1.628
  745    HH   TYR  33           HH       TYR  33  -0.054   7.367   1.413
  746    H    SER  34           H        SER  34  -8.536   4.316   2.584
  747    HA   SER  34           HA       SER  34  -8.705   2.506   4.772
  748    HB2  SER  34           HB2      SER  34 -10.450   4.201   4.307
  749    HB3  SER  34           HB3      SER  34 -10.886   3.363   2.820
  750    HG   SER  34           HG       SER  34 -12.211   2.298   4.059
  751    H    ARG  35           H        ARG  35  -8.992   2.104   1.294
  752    HA   ARG  35           HA       ARG  35 -10.012  -0.538   1.198
  753    HB2  ARG  35           HB2      ARG  35  -9.996   1.391  -0.576
  754    HB3  ARG  35           HB3      ARG  35  -8.424   0.751  -1.037
  755    HG2  ARG  35           HG2      ARG  35  -9.333  -1.265  -1.821
  756    HG3  ARG  35           HG3      ARG  35 -10.802  -1.089  -0.855
  757    HD2  ARG  35           HD2      ARG  35 -11.376  -0.716  -3.138
  758    HD3  ARG  35           HD3      ARG  35 -11.464   0.836  -2.317
  759    HE   ARG  35           HE       ARG  35  -9.239   0.002  -4.092
  760   HH11  ARG  35          HH11      ARG  35 -11.174   2.562  -2.786
  761   HH12  ARG  35          HH12      ARG  35 -10.567   3.722  -3.915
  762   HH21  ARG  35          HH21      ARG  35  -8.467   1.534  -5.478
  763   HH22  ARG  35          HH22      ARG  35  -9.051   3.162  -5.388
  764    H    LEU  36           H        LEU  36  -6.705   0.798   1.247
  765    HA   LEU  36           HA       LEU  36  -5.203  -1.585   1.077
  766    HB2  LEU  36           HB2      LEU  36  -4.736   0.921   2.758
  767    HB3  LEU  36           HB3      LEU  36  -3.546  -0.353   2.572
  768    HG   LEU  36           HG       LEU  36  -4.591   1.385   0.303
  769   HD11  LEU  36          HD11      LEU  36  -2.388   2.469   0.312
  770   HD12  LEU  36          HD12      LEU  36  -1.917   1.525   1.728
  771   HD13  LEU  36          HD13      LEU  36  -3.222   2.707   1.848
  772   HD21  LEU  36          HD21      LEU  36  -3.915  -0.837  -0.502
  773   HD22  LEU  36          HD22      LEU  36  -2.353  -0.674   0.301
  774   HD23  LEU  36          HD23      LEU  36  -2.772   0.392  -1.042
  775    H    ARG  37           H        ARG  37  -6.546   0.082   3.924
  776    HA   ARG  37           HA       ARG  37  -5.725  -1.746   5.913
  777    HB2  ARG  37           HB2      ARG  37  -7.881   0.390   5.900
  778    HB3  ARG  37           HB3      ARG  37  -7.469  -0.531   7.339
  779    HG2  ARG  37           HG2      ARG  37  -5.584   1.289   5.802
  780    HG3  ARG  37           HG3      ARG  37  -6.374   1.665   7.336
  781    HD2  ARG  37           HD2      ARG  37  -5.191  -0.340   8.329
  782    HD3  ARG  37           HD3      ARG  37  -4.270  -0.465   6.828
  783    HE   ARG  37           HE       ARG  37  -3.836   2.067   7.530
  784   HH11  ARG  37          HH11      ARG  37  -3.566  -0.810   9.428
  785   HH12  ARG  37          HH12      ARG  37  -2.363  -0.128  10.453
  786   HH21  ARG  37          HH21      ARG  37  -2.288   2.898   8.900
  787   HH22  ARG  37          HH22      ARG  37  -1.646   1.918  10.154
  788    H    GLU  38           H        GLU  38  -8.382  -1.989   3.724
  789    HA   GLU  38           HA       GLU  38 -10.127  -3.636   5.281
  790    HB2  GLU  38           HB2      GLU  38  -9.861  -3.445   2.242
  791    HB3  GLU  38           HB3      GLU  38 -11.174  -4.254   3.084
  792    HG2  GLU  38           HG2      GLU  38 -10.573  -1.291   3.098
  793    HG3  GLU  38           HG3      GLU  38 -11.911  -2.091   2.278
  794    H    LEU  39           H        LEU  39  -7.553  -4.280   2.951
  795    HA   LEU  39           HA       LEU  39  -7.725  -7.186   3.207
  796    HB2  LEU  39           HB2      LEU  39  -5.902  -5.425   1.530
  797    HB3  LEU  39           HB3      LEU  39  -5.969  -7.179   1.434
  798    HG   LEU  39           HG       LEU  39  -8.320  -5.343   0.793
  799   HD11  LEU  39          HD11      LEU  39  -7.943  -5.854  -1.569
  800   HD12  LEU  39          HD12      LEU  39  -6.499  -6.781  -1.156
  801   HD13  LEU  39          HD13      LEU  39  -6.542  -5.040  -0.872
  802   HD21  LEU  39          HD21      LEU  39  -9.065  -7.557   1.557
  803   HD22  LEU  39          HD22      LEU  39  -8.007  -8.344   0.381
  804   HD23  LEU  39          HD23      LEU  39  -9.371  -7.366  -0.169
  805    H    VAL  40           H        VAL  40  -5.848  -4.606   4.563
  806    HA   VAL  40           HA       VAL  40  -3.742  -6.355   5.605
  807    HB   VAL  40           HB       VAL  40  -4.236  -3.388   6.189
  808   HG11  VAL  40          HG11      VAL  40  -2.895  -4.451   7.970
  809   HG12  VAL  40          HG12      VAL  40  -1.902  -3.335   7.031
  810   HG13  VAL  40          HG13      VAL  40  -1.763  -5.077   6.769
  811   HG21  VAL  40          HG21      VAL  40  -2.322  -4.671   4.195
  812   HG22  VAL  40          HG22      VAL  40  -2.384  -2.950   4.590
  813   HG23  VAL  40          HG23      VAL  40  -3.766  -3.723   3.813
  814    HA   PRO  41           HA       PRO  41  -6.535  -7.195   9.183
  815    HB2  PRO  41           HB2      PRO  41  -5.002  -9.119  10.399
  816    HB3  PRO  41           HB3      PRO  41  -5.958  -9.447   8.948
  817    HG2  PRO  41           HG2      PRO  41  -3.018  -8.771   9.153
  818    HG3  PRO  41           HG3      PRO  41  -3.795 -10.086   8.243
  819    HD2  PRO  41           HD2      PRO  41  -3.053  -7.784   7.029
  820    HD3  PRO  41           HD3      PRO  41  -4.527  -8.644   6.538
  821    H    GLY  42           H        GLY  42  -3.374  -5.842   9.216
  822    HA2  GLY  42           HA2      GLY  42  -3.060  -5.457  12.057
  823    HA3  GLY  42           HA3      GLY  42  -2.086  -4.751  10.782
  824    H    VAL  43           H        VAL  43  -5.381  -4.495  12.159
  825    HA   VAL  43           HA       VAL  43  -5.052  -1.565  12.376
  826    HB   VAL  43           HB       VAL  43  -7.706  -2.772  11.430
  827   HG11  VAL  43          HG11      VAL  43  -7.922  -0.652  12.673
  828   HG12  VAL  43          HG12      VAL  43  -8.356  -0.428  10.976
  829   HG13  VAL  43          HG13      VAL  43  -6.789   0.133  11.568
  830   HG21  VAL  43          HG21      VAL  43  -6.093  -3.077   9.609
  831   HG22  VAL  43          HG22      VAL  43  -5.632  -1.377   9.692
  832   HG23  VAL  43          HG23      VAL  43  -7.264  -1.826   9.182
  833    HA   PRO  44           HA       PRO  44  -6.748  -2.961  16.441
  834    HB2  PRO  44           HB2      PRO  44  -5.860  -0.342  17.488
  835    HB3  PRO  44           HB3      PRO  44  -5.304  -1.960  17.930
  836    HG2  PRO  44           HG2      PRO  44  -3.736  -0.203  16.551
  837    HG3  PRO  44           HG3      PRO  44  -3.609  -1.962  16.341
  838    HD2  PRO  44           HD2      PRO  44  -5.051   0.055  14.604
  839    HD3  PRO  44           HD3      PRO  44  -3.991  -1.293  14.121
  840    H    ARG  45           H        ARG  45  -8.801  -2.599  17.260
  841    HA   ARG  45           HA       ARG  45 -10.559  -0.771  15.940
  842    HB2  ARG  45           HB2      ARG  45 -12.314  -1.610  17.542
  843    HB3  ARG  45           HB3      ARG  45 -11.489  -2.864  16.638
  844    HG2  ARG  45           HG2      ARG  45 -11.654  -3.817  18.758
  845    HG3  ARG  45           HG3      ARG  45 -10.024  -3.152  18.780
  846    HD2  ARG  45           HD2      ARG  45 -10.855  -1.190  20.051
  847    HD3  ARG  45           HD3      ARG  45 -12.484  -1.876  20.030
  848    HE   ARG  45           HE       ARG  45 -10.881  -3.828  21.130
  849   HH11  ARG  45          HH11      ARG  45 -11.632  -0.559  21.990
  850   HH12  ARG  45          HH12      ARG  45 -11.454  -0.862  23.682
  851   HH21  ARG  45          HH21      ARG  45 -10.658  -4.178  23.295
  852   HH22  ARG  45          HH22      ARG  45 -10.904  -2.883  24.411
  853    H    GLY  46           H        GLY  46 -11.493   1.145  16.611
  854    HA2  GLY  46           HA2      GLY  46 -11.819   3.077  17.865
  855    HA3  GLY  46           HA3      GLY  46 -10.873   2.388  19.176
  856    H    THR  47           H        THR  47  -8.588   1.809  17.302
  857    HA   THR  47           HA       THR  47  -7.181   4.308  17.564
  858    HB   THR  47           HB       THR  47  -6.197   1.703  16.289
  859    HG1  THR  47           HG1      THR  47  -5.396   1.281  18.442
  860   HG21  THR  47          HG21      THR  47  -3.960   2.503  16.978
  861   HG22  THR  47          HG22      THR  47  -4.668   3.983  17.630
  862   HG23  THR  47          HG23      THR  47  -4.720   3.666  15.895
  863    H    GLN  48           H        GLN  48  -7.405   5.872  16.076
  864    HA   GLN  48           HA       GLN  48  -8.682   5.410  13.536
  865    HB2  GLN  48           HB2      GLN  48  -7.506   7.990  14.659
  866    HB3  GLN  48           HB3      GLN  48  -8.623   7.868  13.303
  867    HG2  GLN  48           HG2      GLN  48  -9.253   7.105  16.177
  868    HG3  GLN  48           HG3      GLN  48  -9.764   8.584  15.371
  869   HE21  GLN  48          HE21      GLN  48 -11.346   6.365  16.575
  870   HE22  GLN  48          HE22      GLN  48 -12.419   5.849  15.325
  871    H    LEU  49           H        LEU  49  -5.367   6.133  14.538
  872    HA   LEU  49           HA       LEU  49  -3.353   6.057  13.520
  873    HB2  LEU  49           HB2      LEU  49  -4.859   4.472  11.407
  874    HB3  LEU  49           HB3      LEU  49  -3.108   4.603  11.469
  875    HG   LEU  49           HG       LEU  49  -4.794   3.399  13.705
  876   HD11  LEU  49          HD11      LEU  49  -3.208   1.927  11.590
  877   HD12  LEU  49          HD12      LEU  49  -4.967   1.985  11.715
  878   HD13  LEU  49          HD13      LEU  49  -4.022   1.199  12.977
  879   HD21  LEU  49          HD21      LEU  49  -2.674   4.321  14.506
  880   HD22  LEU  49          HD22      LEU  49  -1.786   3.409  13.283
  881   HD23  LEU  49          HD23      LEU  49  -2.641   2.559  14.571
  882    H    SER  50           H        SER  50  -2.294   6.413  11.045
  883    HA   SER  50           HA       SER  50  -3.527   8.803   9.850
  884    HB2  SER  50           HB2      SER  50  -0.764   8.815  11.133
  885    HB3  SER  50           HB3      SER  50  -1.352  10.088  10.065
  886    HG   SER  50           HG       SER  50  -3.131   9.558  12.049
  887    H    GLN  51           H        GLN  51  -2.026   9.700   8.062
  888    HA   GLN  51           HA       GLN  51  -2.313   7.988   5.913
  889    HB2  GLN  51           HB2      GLN  51  -0.475  10.415   6.078
  890    HB3  GLN  51           HB3      GLN  51  -1.066   9.693   4.587
  891    HG2  GLN  51           HG2      GLN  51  -2.834  10.936   6.712
  892    HG3  GLN  51           HG3      GLN  51  -2.277  11.769   5.265
  893   HE21  GLN  51          HE21      GLN  51  -3.205  11.244   3.282
  894   HE22  GLN  51          HE22      GLN  51  -4.635  10.297   3.142
  895    H    VAL  52           H        VAL  52   0.835   8.885   7.403
  896    HA   VAL  52           HA       VAL  52   2.388   7.243   5.636
  897    HB   VAL  52           HB       VAL  52   3.339   8.385   8.309
  898   HG11  VAL  52          HG11      VAL  52   5.575   8.345   7.264
  899   HG12  VAL  52          HG12      VAL  52   4.885   7.659   5.792
  900   HG13  VAL  52          HG13      VAL  52   4.861   6.732   7.296
  901   HG21  VAL  52          HG21      VAL  52   4.125  10.376   7.056
  902   HG22  VAL  52          HG22      VAL  52   2.367  10.222   7.006
  903   HG23  VAL  52          HG23      VAL  52   3.331   9.770   5.599
  904    H    GLU  53           H        GLU  53   1.092   6.796   8.933
  905    HA   GLU  53           HA       GLU  53   2.372   4.413   9.692
  906    HB2  GLU  53           HB2      GLU  53   0.634   6.042  10.947
  907    HB3  GLU  53           HB3      GLU  53  -0.546   4.861  10.414
  908    HG2  GLU  53           HG2      GLU  53   1.831   4.364  12.231
  909    HG3  GLU  53           HG3      GLU  53   0.145   4.449  12.713
  910    H    ILE  54           H        ILE  54  -0.477   4.955   7.631
  911    HA   ILE  54           HA       ILE  54  -1.233   2.254   7.257
  912    HB   ILE  54           HB       ILE  54  -1.625   4.572   5.309
  913   HG12  ILE  54          HG12      ILE  54  -3.357   3.562   7.618
  914   HG13  ILE  54          HG13      ILE  54  -2.644   5.158   7.443
  915   HG21  ILE  54          HG21      ILE  54  -1.945   2.400   4.200
  916   HG22  ILE  54          HG22      ILE  54  -3.490   3.225   4.379
  917   HG23  ILE  54          HG23      ILE  54  -3.076   1.892   5.464
  918   HD11  ILE  54          HD11      ILE  54  -4.998   5.273   7.062
  919   HD12  ILE  54          HD12      ILE  54  -4.918   4.001   5.843
  920   HD13  ILE  54          HD13      ILE  54  -4.172   5.575   5.532
  921    H    LEU  55           H        LEU  55   0.829   4.385   5.239
  922    HA   LEU  55           HA       LEU  55   1.587   2.578   3.262
  923    HB2  LEU  55           HB2      LEU  55   3.220   4.824   4.492
  924    HB3  LEU  55           HB3      LEU  55   3.616   4.017   2.984
  925    HG   LEU  55           HG       LEU  55   1.124   5.693   3.479
  926   HD11  LEU  55          HD11      LEU  55   2.134   7.320   1.937
  927   HD12  LEU  55          HD12      LEU  55   3.589   6.329   1.828
  928   HD13  LEU  55          HD13      LEU  55   3.145   7.077   3.363
  929   HD21  LEU  55          HD21      LEU  55   0.693   5.441   1.058
  930   HD22  LEU  55          HD22      LEU  55   0.657   3.883   1.878
  931   HD23  LEU  55          HD23      LEU  55   2.067   4.340   0.920
  932    H    GLN  56           H        GLN  56   3.224   3.223   6.351
  933    HA   GLN  56           HA       GLN  56   5.376   1.479   6.277
  934    HB2  GLN  56           HB2      GLN  56   3.614   2.330   8.614
  935    HB3  GLN  56           HB3      GLN  56   5.125   1.448   8.823
  936    HG2  GLN  56           HG2      GLN  56   6.407   3.284   7.934
  937    HG3  GLN  56           HG3      GLN  56   4.940   4.142   7.460
  938   HE21  GLN  56          HE21      GLN  56   5.674   5.936   8.673
  939   HE22  GLN  56          HE22      GLN  56   5.542   5.975  10.395
  940    H    ARG  57           H        ARG  57   2.121   0.831   7.597
  941    HA   ARG  57           HA       ARG  57   2.734  -1.848   8.423
  942    HB2  ARG  57           HB2      ARG  57   1.128  -0.189   9.510
  943    HB3  ARG  57           HB3      ARG  57  -0.016  -0.552   8.225
  944    HG2  ARG  57           HG2      ARG  57  -0.464  -2.698   9.043
  945    HG3  ARG  57           HG3      ARG  57   1.100  -2.833   9.848
  946    HD2  ARG  57           HD2      ARG  57  -1.232  -1.114  10.758
  947    HD3  ARG  57           HD3      ARG  57  -0.685  -2.609  11.518
  948    HE   ARG  57           HE       ARG  57   0.794  -0.047  11.466
  949   HH11  ARG  57          HH11      ARG  57   0.263  -3.111  13.005
  950   HH12  ARG  57          HH12      ARG  57   1.436  -2.788  14.229
  951   HH21  ARG  57          HH21      ARG  57   2.260   0.302  13.022
  952   HH22  ARG  57          HH22      ARG  57   2.541  -0.892  14.245
  953    H    VAL  58           H        VAL  58   1.335  -0.457   5.537
  954    HA   VAL  58           HA       VAL  58   0.392  -2.904   4.377
  955    HB   VAL  58           HB       VAL  58   1.099  -0.223   3.090
  956   HG11  VAL  58          HG11      VAL  58  -0.040  -1.036   1.023
  957   HG12  VAL  58          HG12      VAL  58  -0.160  -2.650   1.735
  958   HG13  VAL  58          HG13      VAL  58   1.422  -1.959   1.380
  959   HG21  VAL  58          HG21      VAL  58  -0.899  -0.201   4.548
  960   HG22  VAL  58          HG22      VAL  58  -1.602  -1.535   3.631
  961   HG23  VAL  58          HG23      VAL  58  -1.350   0.034   2.860
  962    H    ILE  59           H        ILE  59   3.519  -1.102   4.175
  963    HA   ILE  59           HA       ILE  59   4.838  -2.835   2.368
  964    HB   ILE  59           HB       ILE  59   6.037  -1.150   4.613
  965   HG12  ILE  59          HG12      ILE  59   5.841  -0.636   1.602
  966   HG13  ILE  59          HG13      ILE  59   4.901   0.173   2.849
  967   HG21  ILE  59          HG21      ILE  59   7.622  -2.959   4.039
  968   HG22  ILE  59          HG22      ILE  59   8.240  -1.406   3.486
  969   HG23  ILE  59          HG23      ILE  59   7.522  -2.528   2.329
  970   HD11  ILE  59          HD11      ILE  59   6.675   1.582   2.047
  971   HD12  ILE  59          HD12      ILE  59   7.880   0.368   2.466
  972   HD13  ILE  59          HD13      ILE  59   6.952   1.170   3.738
  973    H    ASP  60           H        ASP  60   4.820  -2.879   5.969
  974    HA   ASP  60           HA       ASP  60   6.314  -5.184   6.445
  975    HB2  ASP  60           HB2      ASP  60   3.887  -4.218   8.018
  976    HB3  ASP  60           HB3      ASP  60   5.109  -5.337   8.617
  977    H    TYR  61           H        TYR  61   2.828  -4.892   5.923
  978    HA   TYR  61           HA       TYR  61   1.941  -7.522   6.090
  979    HB2  TYR  61           HB2      TYR  61   0.367  -5.719   5.973
  980    HB3  TYR  61           HB3      TYR  61   1.055  -5.101   4.484
  981    HD1  TYR  61           HD1      TYR  61  -1.052  -7.842   5.896
  982    HD2  TYR  61           HD2      TYR  61   0.219  -5.831   2.330
  983    HE1  TYR  61           HE1      TYR  61  -2.824  -8.958   4.627
  984    HE2  TYR  61           HE2      TYR  61  -1.566  -6.953   1.072
  985    HH   TYR  61           HH       TYR  61  -4.129  -8.588   2.593
  986    H    ILE  62           H        ILE  62   3.108  -5.771   3.226
  987    HA   ILE  62           HA       ILE  62   2.921  -7.859   1.333
  988    HB   ILE  62           HB       ILE  62   4.599  -5.309   1.401
  989   HG12  ILE  62          HG12      ILE  62   2.060  -5.939  -0.197
  990   HG13  ILE  62          HG13      ILE  62   2.083  -5.046   1.319
  991   HG21  ILE  62          HG21      ILE  62   4.218  -7.168  -0.973
  992   HG22  ILE  62          HG22      ILE  62   5.729  -6.873  -0.113
  993   HG23  ILE  62          HG23      ILE  62   4.977  -5.574  -1.036
  994   HD11  ILE  62          HD11      ILE  62   3.400  -4.179  -1.257
  995   HD12  ILE  62          HD12      ILE  62   3.399  -3.276   0.262
  996   HD13  ILE  62          HD13      ILE  62   1.884  -3.565  -0.593
  997    H    LEU  63           H        LEU  63   5.571  -6.895   3.530
  998    HA   LEU  63           HA       LEU  63   7.650  -8.443   2.357
  999    HB2  LEU  63           HB2      LEU  63   7.353  -7.423   5.205
 1000    HB3  LEU  63           HB3      LEU  63   8.829  -8.115   4.550
 1001    HG   LEU  63           HG       LEU  63   7.513  -5.550   3.581
 1002   HD11  LEU  63          HD11      LEU  63  10.022  -5.898   5.240
 1003   HD12  LEU  63          HD12      LEU  63   8.472  -5.277   5.809
 1004   HD13  LEU  63          HD13      LEU  63   9.392  -4.372   4.612
 1005   HD21  LEU  63          HD21      LEU  63   8.680  -6.659   1.734
 1006   HD22  LEU  63          HD22      LEU  63  10.146  -6.788   2.707
 1007   HD23  LEU  63          HD23      LEU  63   9.542  -5.202   2.224
 1008    H    ASP  64           H        ASP  64   5.324  -9.203   4.960
 1009    HA   ASP  64           HA       ASP  64   6.285 -11.748   5.682
 1010    HB2  ASP  64           HB2      ASP  64   3.418 -10.693   5.658
 1011    HB3  ASP  64           HB3      ASP  64   3.914 -12.193   6.427
 1012    H    LEU  65           H        LEU  65   3.987 -10.763   3.160
 1013    HA   LEU  65           HA       LEU  65   3.257 -13.383   2.283
 1014    HB2  LEU  65           HB2      LEU  65   3.031 -10.744   0.792
 1015    HB3  LEU  65           HB3      LEU  65   2.125 -12.212   0.452
 1016    HG   LEU  65           HG       LEU  65   1.871 -10.521   2.968
 1017   HD11  LEU  65          HD11      LEU  65   0.911  -9.411   1.013
 1018   HD12  LEU  65          HD12      LEU  65  -0.339  -9.899   2.158
 1019   HD13  LEU  65          HD13      LEU  65  -0.085 -10.833   0.682
 1020   HD21  LEU  65          HD21      LEU  65   0.300 -12.989   2.183
 1021   HD22  LEU  65          HD22      LEU  65  -0.032 -11.949   3.570
 1022   HD23  LEU  65          HD23      LEU  65   1.471 -12.865   3.501
 1023    H    GLN  66           H        GLN  66   5.583 -11.015   1.122
 1024    HA   GLN  66           HA       GLN  66   6.503 -12.412  -1.188
 1025    HB2  GLN  66           HB2      GLN  66   7.547 -10.071   0.432
 1026    HB3  GLN  66           HB3      GLN  66   8.520 -10.739  -0.871
 1027    HG2  GLN  66           HG2      GLN  66   5.668  -9.757  -1.290
 1028    HG3  GLN  66           HG3      GLN  66   7.088  -8.722  -1.477
 1029   HE21  GLN  66          HE21      GLN  66   5.121  -9.596  -3.505
 1030   HE22  GLN  66          HE22      GLN  66   6.036 -10.345  -4.753
 1031    H    VAL  67           H        VAL  67   7.349 -12.514   2.205
 1032    HA   VAL  67           HA       VAL  67   8.748 -13.694   3.500
 1033    HB   VAL  67           HB       VAL  67   8.943 -15.650   1.163
 1034   HG11  VAL  67          HG11      VAL  67   9.458 -16.119   4.125
 1035   HG12  VAL  67          HG12      VAL  67  10.675 -16.076   2.849
 1036   HG13  VAL  67          HG13      VAL  67   9.473 -17.364   2.870
 1037   HG21  VAL  67          HG21      VAL  67   6.589 -15.271   1.760
 1038   HG22  VAL  67          HG22      VAL  67   6.933 -15.631   3.451
 1039   HG23  VAL  67          HG23      VAL  67   7.085 -16.898   2.230
 1040    H    VAL  68           H        VAL  68  10.338 -12.159   3.624
 1041    HA   VAL  68           HA       VAL  68  12.403 -11.821   1.619
 1042    HB   VAL  68           HB       VAL  68  12.049 -10.472   4.338
 1043   HG11  VAL  68          HG11      VAL  68  13.906  -9.716   2.049
 1044   HG12  VAL  68          HG12      VAL  68  14.389 -10.341   3.626
 1045   HG13  VAL  68          HG13      VAL  68  13.633  -8.754   3.505
 1046   HG21  VAL  68          HG21      VAL  68  11.307  -9.474   1.550
 1047   HG22  VAL  68          HG22      VAL  68  11.144  -8.555   3.049
 1048   HG23  VAL  68          HG23      VAL  68  10.175 -10.005   2.797
  Start of MODEL   14
    1    H1   MET   1           H1       MET   1 -39.373  11.004  24.048
    2    H2   MET   1           H2       MET   1 -38.399   9.656  24.337
    3    H3   MET   1           H3       MET   1 -39.423   9.685  22.995
    4    HA   MET   1           HA       MET   1 -38.180  11.469  22.009
    5    HB2  MET   1           HB2      MET   1 -36.434  11.190  24.495
    6    HB3  MET   1           HB3      MET   1 -35.995  12.148  23.086
    7    HG2  MET   1           HG2      MET   1 -37.917  13.622  23.475
    8    HG3  MET   1           HG3      MET   1 -38.388  12.654  24.875
    9    HE1  MET   1           HE1      MET   1 -37.027  15.987  26.488
   10    HE2  MET   1           HE2      MET   1 -38.420  14.919  26.330
   11    HE3  MET   1           HE3      MET   1 -37.879  15.879  24.950
   12    H    GLY   2           H        GLY   2 -37.045  10.639  20.330
   13    HA2  GLY   2           HA2      GLY   2 -34.894   8.844  20.372
   14    HA3  GLY   2           HA3      GLY   2 -36.366   7.895  20.176
   15    H    HIS   3           H        HIS   3 -34.623  10.670  18.839
   16    HA   HIS   3           HA       HIS   3 -36.050  10.671  16.311
   17    HB2  HIS   3           HB2      HIS   3 -34.597  12.588  15.744
   18    HB3  HIS   3           HB3      HIS   3 -35.300  12.800  17.343
   19    HD2  HIS   3           HD2      HIS   3 -33.444  12.448  19.513
   20    HE1  HIS   3           HE1      HIS   3 -30.065  12.826  17.002
   21    HE2  HIS   3           HE2      HIS   3 -30.867  12.647  19.391
   22    H    HIS   4           H        HIS   4 -34.920  10.546  14.208
   23    HA   HIS   4           HA       HIS   4 -32.313   9.351  13.987
   24    HB2  HIS   4           HB2      HIS   4 -33.060   7.286  12.767
   25    HB3  HIS   4           HB3      HIS   4 -33.514   7.288  14.463
   26    HD2  HIS   4           HD2      HIS   4 -35.164   7.104  10.967
   27    HE1  HIS   4           HE1      HIS   4 -38.214   7.054  13.898
   28    HE2  HIS   4           HE2      HIS   4 -37.695   6.805  11.434
   29    H    HIS   5           H        HIS   5 -31.451   9.511  11.929
   30    HA   HIS   5           HA       HIS   5 -33.009  10.893   9.825
   31    HB2  HIS   5           HB2      HIS   5 -30.993  12.411   9.504
   32    HB3  HIS   5           HB3      HIS   5 -31.848  12.655  11.022
   33    HD2  HIS   5           HD2      HIS   5 -28.418  11.239   9.752
   34    HE1  HIS   5           HE1      HIS   5 -28.254  11.769  13.942
   35    HE2  HIS   5           HE2      HIS   5 -26.975  11.026  11.891
   36    H    HIS   6           H        HIS   6 -31.343  11.156   7.821
   37    HA   HIS   6           HA       HIS   6 -29.544   8.888   7.445
   38    HB2  HIS   6           HB2      HIS   6 -31.641   7.887   6.684
   39    HB3  HIS   6           HB3      HIS   6 -32.012   9.293   5.695
   40    HD2  HIS   6           HD2      HIS   6 -31.340   8.944   3.100
   41    HE1  HIS   6           HE1      HIS   6 -28.391   5.966   3.670
   42    HE2  HIS   6           HE2      HIS   6 -29.794   7.205   1.967
   43    H    HIS   7           H        HIS   7 -27.758   9.644   6.489
   44    HA   HIS   7           HA       HIS   7 -27.835  12.030   4.738
   45    HB2  HIS   7           HB2      HIS   7 -25.492  10.626   6.105
   46    HB3  HIS   7           HB3      HIS   7 -25.344  12.045   5.068
   47    HD2  HIS   7           HD2      HIS   7 -26.830  14.365   6.148
   48    HE1  HIS   7           HE1      HIS   7 -26.262  12.984  10.102
   49    HE2  HIS   7           HE2      HIS   7 -26.676  15.007   8.652
   50    H    HIS   8           H        HIS   8 -27.916  11.672   2.621
   51    HA   HIS   8           HA       HIS   8 -27.467   9.047   1.463
   52    HB2  HIS   8           HB2      HIS   8 -29.399  10.637   0.895
   53    HB3  HIS   8           HB3      HIS   8 -28.234  11.622   0.026
   54    HD2  HIS   8           HD2      HIS   8 -30.342   8.432  -0.425
   55    HE1  HIS   8           HE1      HIS   8 -28.003   8.984  -3.900
   56    HE2  HIS   8           HE2      HIS   8 -30.039   7.856  -2.926
   57    H    SER   9           H        SER   9 -26.148   8.808  -0.590
   58    HA   SER   9           HA       SER   9 -23.424   9.517  -0.073
   59    HB2  SER   9           HB2      SER   9 -24.077   7.349  -1.095
   60    HB3  SER   9           HB3      SER   9 -24.617   8.192  -2.547
   61    HG   SER   9           HG       SER   9 -22.399   7.253  -2.524
   62    H    HIS  10           H        HIS  10 -21.911  10.499  -1.626
   63    HA   HIS  10           HA       HIS  10 -23.017  12.701  -3.280
   64    HB2  HIS  10           HB2      HIS  10 -20.751  13.046  -1.253
   65    HB3  HIS  10           HB3      HIS  10 -21.382  14.296  -2.323
   66    HD1  HIS  10           HD1      HIS  10 -23.958  14.994  -1.836
   67    HD2  HIS  10           HD2      HIS  10 -22.003  12.900   1.166
   68    HE1  HIS  10           HE1      HIS  10 -25.349  15.319   0.224
   69    HE2  HIS  10           HE2      HIS  10 -24.062  14.168   2.052
   70    H    MET  11           H        MET  11 -21.680  13.410  -4.981
   71    HA   MET  11           HA       MET  11 -19.621  11.640  -5.999
   72    HB2  MET  11           HB2      MET  11 -20.470  14.408  -6.981
   73    HB3  MET  11           HB3      MET  11 -19.437  13.286  -7.862
   74    HG2  MET  11           HG2      MET  11 -22.339  12.824  -7.159
   75    HG3  MET  11           HG3      MET  11 -21.730  13.320  -8.738
   76    HE1  MET  11           HE1      MET  11 -23.672  10.876  -8.551
   77    HE2  MET  11           HE2      MET  11 -22.838   9.668  -9.527
   78    HE3  MET  11           HE3      MET  11 -22.880  11.349 -10.056
   79    H    GLY  12           H        GLY  12 -17.373  12.317  -6.433
   80    HA2  GLY  12           HA2      GLY  12 -16.219  14.740  -5.566
   81    HA3  GLY  12           HA3      GLY  12 -16.060  13.575  -4.261
   82    H    GLY  13           H        GLY  13 -14.380  14.926  -6.676
   83    HA2  GLY  13           HA2      GLY  13 -12.633  12.557  -7.143
   84    HA3  GLY  13           HA3      GLY  13 -12.900  13.816  -8.341
   85    H    GLY  14           H        GLY  14 -11.833  13.482  -4.954
   86    HA2  GLY  14           HA2      GLY  14  -9.949  15.727  -5.190
   87    HA3  GLY  14           HA3      GLY  14 -10.376  14.866  -3.720
   88    H    LYS  15           H        LYS  15  -7.746  15.413  -4.152
   89    HA   LYS  15           HA       LYS  15  -6.520  12.789  -4.356
   90    HB2  LYS  15           HB2      LYS  15  -4.915  13.394  -6.147
   91    HB3  LYS  15           HB3      LYS  15  -6.573  13.435  -6.735
   92    HG2  LYS  15           HG2      LYS  15  -6.589  15.903  -6.525
   93    HG3  LYS  15           HG3      LYS  15  -4.918  15.863  -5.959
   94    HD2  LYS  15           HD2      LYS  15  -5.873  14.917  -8.696
   95    HD3  LYS  15           HD3      LYS  15  -5.096  16.467  -8.368
   96    HE2  LYS  15           HE2      LYS  15  -3.045  15.315  -7.667
   97    HE3  LYS  15           HE3      LYS  15  -3.812  13.745  -7.927
   98    HZ1  LYS  15           HZ1      LYS  15  -2.417  14.371  -9.788
   99    HZ2  LYS  15           HZ2      LYS  15  -3.301  15.789 -10.017
  100    HZ3  LYS  15           HZ3      LYS  15  -4.033  14.289 -10.270
  101    H    GLY  16           H        GLY  16  -4.248  12.779  -3.709
  102    HA2  GLY  16           HA2      GLY  16  -3.497  14.683  -1.687
  103    HA3  GLY  16           HA3      GLY  16  -2.566  13.299  -2.229
  104    HA   PRO  17           HA       PRO  17  -1.439  17.531  -4.652
  105    HB2  PRO  17           HB2      PRO  17  -0.287  18.713  -2.134
  106    HB3  PRO  17           HB3      PRO  17  -1.203  19.500  -3.430
  107    HG2  PRO  17           HG2      PRO  17  -2.352  19.018  -1.066
  108    HG3  PRO  17           HG3      PRO  17  -3.272  18.791  -2.572
  109    HD2  PRO  17           HD2      PRO  17  -1.928  16.711  -0.833
  110    HD3  PRO  17           HD3      PRO  17  -3.549  16.684  -1.571
  111    H    ALA  18           H        ALA  18   0.398  17.099  -5.756
  112    HA   ALA  18           HA       ALA  18   2.762  15.915  -4.390
  113    HB1  ALA  18           HB1      ALA  18   3.281  14.811  -6.523
  114    HB2  ALA  18           HB2      ALA  18   1.878  15.573  -7.277
  115    HB3  ALA  18           HB3      ALA  18   1.652  14.395  -5.984
  116    H    ALA  19           H        ALA  19   4.320  17.383  -4.114
  117    HA   ALA  19           HA       ALA  19   4.793  19.660  -5.872
  118    HB1  ALA  19           HB1      ALA  19   6.358  18.724  -3.433
  119    HB2  ALA  19           HB2      ALA  19   5.045  19.902  -3.420
  120    HB3  ALA  19           HB3      ALA  19   6.547  20.273  -4.265
  121    H    GLU  20           H        GLU  20   6.514  16.685  -4.913
  122    HA   GLU  20           HA       GLU  20   8.061  15.346  -5.867
  123    HB2  GLU  20           HB2      GLU  20   7.210  16.685  -8.476
  124    HB3  GLU  20           HB3      GLU  20   8.094  15.163  -8.355
  125    HG2  GLU  20           HG2      GLU  20   6.182  14.103  -7.261
  126    HG3  GLU  20           HG3      GLU  20   5.298  15.628  -7.261
  127    H    GLU  21           H        GLU  21   9.855  15.803  -8.098
  128    HA   GLU  21           HA       GLU  21  11.819  16.668  -8.737
  129    HB2  GLU  21           HB2      GLU  21  11.056  19.141  -7.134
  130    HB3  GLU  21           HB3      GLU  21  12.491  19.033  -8.150
  131    HG2  GLU  21           HG2      GLU  21  11.083  18.690 -10.135
  132    HG3  GLU  21           HG3      GLU  21   9.635  18.749  -9.133
  133    HA   PRO  22           HA       PRO  22  14.425  14.953  -5.533
  134    HB2  PRO  22           HB2      PRO  22  16.780  15.865  -7.139
  135    HB3  PRO  22           HB3      PRO  22  16.303  14.228  -6.666
  136    HG2  PRO  22           HG2      PRO  22  16.027  15.070  -9.208
  137    HG3  PRO  22           HG3      PRO  22  14.823  13.996  -8.460
  138    HD2  PRO  22           HD2      PRO  22  14.689  16.986  -8.888
  139    HD3  PRO  22           HD3      PRO  22  13.437  15.753  -9.169
  140    H    LEU  23           H        LEU  23  14.082  16.356  -3.797
  141    HA   LEU  23           HA       LEU  23  15.950  18.644  -3.457
  142    HB2  LEU  23           HB2      LEU  23  13.155  18.241  -2.322
  143    HB3  LEU  23           HB3      LEU  23  14.223  19.554  -1.858
  144    HG   LEU  23           HG       LEU  23  13.122  19.121  -4.664
  145   HD11  LEU  23          HD11      LEU  23  12.290  21.168  -2.582
  146   HD12  LEU  23          HD12      LEU  23  11.334  19.787  -3.130
  147   HD13  LEU  23          HD13      LEU  23  11.716  21.093  -4.251
  148   HD21  LEU  23          HD21      LEU  23  14.768  21.434  -3.560
  149   HD22  LEU  23          HD22      LEU  23  14.040  21.360  -5.165
  150   HD23  LEU  23          HD23      LEU  23  15.315  20.228  -4.733
  151    H    SER  24           H        SER  24  16.814  19.008  -1.341
  152    HA   SER  24           HA       SER  24  17.513  16.644   0.172
  153    HB2  SER  24           HB2      SER  24  19.128  18.506  -0.260
  154    HB3  SER  24           HB3      SER  24  18.145  19.576   0.740
  155    HG   SER  24           HG       SER  24  18.700  18.421   2.530
  156    H    LEU  25           H        LEU  25  14.818  18.534   0.243
  157    HA   LEU  25           HA       LEU  25  14.116  19.104   2.856
  158    HB2  LEU  25           HB2      LEU  25  12.945  19.564   0.551
  159    HB3  LEU  25           HB3      LEU  25  12.119  18.045   0.815
  160    HG   LEU  25           HG       LEU  25  11.922  20.445   2.690
  161   HD11  LEU  25          HD11      LEU  25   9.699  20.865   1.705
  162   HD12  LEU  25          HD12      LEU  25   9.979  19.582   0.521
  163   HD13  LEU  25          HD13      LEU  25  10.986  21.032   0.513
  164   HD21  LEU  25          HD21      LEU  25  10.220  17.929   2.576
  165   HD22  LEU  25          HD22      LEU  25   9.929  19.321   3.624
  166   HD23  LEU  25          HD23      LEU  25  11.381  18.349   3.840
  167    H    LEU  26           H        LEU  26  13.631  16.041   1.079
  168    HA   LEU  26           HA       LEU  26  13.048  13.932   1.597
  169    HB2  LEU  26           HB2      LEU  26  14.140  14.698   4.316
  170    HB3  LEU  26           HB3      LEU  26  13.552  13.078   3.971
  171    HG   LEU  26           HG       LEU  26  15.875  14.430   2.526
  172   HD11  LEU  26          HD11      LEU  26  16.476  13.919   4.848
  173   HD12  LEU  26          HD12      LEU  26  17.331  12.855   3.735
  174   HD13  LEU  26          HD13      LEU  26  15.941  12.248   4.639
  175   HD21  LEU  26          HD21      LEU  26  16.294  12.191   1.542
  176   HD22  LEU  26          HD22      LEU  26  14.727  12.828   1.060
  177   HD23  LEU  26          HD23      LEU  26  14.821  11.578   2.303
  178    H    ASP  27           H        ASP  27  11.572  12.522   2.809
  179    HA   ASP  27           HA       ASP  27   9.628  13.530   4.618
  180    HB2  ASP  27           HB2      ASP  27   8.818  14.636   2.524
  181    HB3  ASP  27           HB3      ASP  27   8.656  13.059   1.759
  182    H    ASP  28           H        ASP  28   9.001  11.837   5.798
  183    HA   ASP  28           HA       ASP  28   9.839   9.208   5.444
  184    HB2  ASP  28           HB2      ASP  28   9.134  10.322   7.600
  185    HB3  ASP  28           HB3      ASP  28   7.455  10.126   7.107
  186    H    MET  29           H        MET  29   6.612  10.592   4.750
  187    HA   MET  29           HA       MET  29   5.337   8.257   3.786
  188    HB2  MET  29           HB2      MET  29   3.826   9.945   4.323
  189    HB3  MET  29           HB3      MET  29   4.803  11.214   3.605
  190    HG2  MET  29           HG2      MET  29   4.060  10.643   1.396
  191    HG3  MET  29           HG3      MET  29   3.276   9.176   1.973
  192    HE1  MET  29           HE1      MET  29   0.211  10.514   3.916
  193    HE2  MET  29           HE2      MET  29   1.777   9.975   4.534
  194    HE3  MET  29           HE3      MET  29   0.998   9.100   3.215
  195    H    ASN  30           H        ASN  30   7.216  10.747   2.034
  196    HA   ASN  30           HA       ASN  30   6.813   9.836  -0.614
  197    HB2  ASN  30           HB2      ASN  30   7.823  12.047  -0.006
  198    HB3  ASN  30           HB3      ASN  30   9.276  11.219   0.540
  199   HD21  ASN  30          HD21      ASN  30  10.670  12.153  -0.940
  200   HD22  ASN  30          HD22      ASN  30  10.581  11.874  -2.638
  201    H    HIS  31           H        HIS  31   9.250   8.963   1.803
  202    HA   HIS  31           HA       HIS  31  10.791   7.142   0.253
  203    HB2  HIS  31           HB2      HIS  31  11.499   8.264   2.417
  204    HB3  HIS  31           HB3      HIS  31  10.428   7.171   3.287
  205    HD2  HIS  31           HD2      HIS  31  13.920   7.212   1.601
  206    HE1  HIS  31           HE1      HIS  31  13.294   3.388   3.298
  207    HE2  HIS  31           HE2      HIS  31  14.897   4.842   1.998
  208    H    CYS  32           H        CYS  32   7.937   6.742   2.324
  209    HA   CYS  32           HA       CYS  32   7.714   3.908   2.267
  210    HB2  CYS  32           HB2      CYS  32   5.528   5.997   2.630
  211    HB3  CYS  32           HB3      CYS  32   5.361   4.277   2.990
  212    HG   CYS  32           HG       CYS  32   7.897   5.824   4.541
  213    H    TYR  33           H        TYR  33   6.370   6.435   0.163
  214    HA   TYR  33           HA       TYR  33   4.769   4.779  -1.503
  215    HB2  TYR  33           HB2      TYR  33   5.776   7.613  -1.654
  216    HB3  TYR  33           HB3      TYR  33   5.178   6.896  -3.147
  217    HD1  TYR  33           HD1      TYR  33   2.893   5.473  -2.713
  218    HD2  TYR  33           HD2      TYR  33   4.109   8.915  -0.491
  219    HE1  TYR  33           HE1      TYR  33   0.573   5.912  -2.131
  220    HE2  TYR  33           HE2      TYR  33   1.766   9.351   0.095
  221    HH   TYR  33           HH       TYR  33  -0.404   8.841  -0.536
  222    H    SER  34           H        SER  34   8.124   5.870  -1.776
  223    HA   SER  34           HA       SER  34   8.815   4.712  -4.246
  224    HB2  SER  34           HB2      SER  34  10.319   6.242  -3.030
  225    HB3  SER  34           HB3      SER  34  10.529   5.056  -1.741
  226    HG   SER  34           HG       SER  34  11.633   5.147  -4.290
  227    H    ARG  35           H        ARG  35   8.990   3.346  -0.955
  228    HA   ARG  35           HA       ARG  35   9.939   0.781  -1.556
  229    HB2  ARG  35           HB2      ARG  35   8.487   1.941   0.791
  230    HB3  ARG  35           HB3      ARG  35   8.837   0.207   0.729
  231    HG2  ARG  35           HG2      ARG  35  11.174   0.558   0.613
  232    HG3  ARG  35           HG3      ARG  35  10.988   2.279   0.258
  233    HD2  ARG  35           HD2      ARG  35  11.718   1.993   2.507
  234    HD3  ARG  35           HD3      ARG  35  10.082   2.618   2.501
  235    HE   ARG  35           HE       ARG  35   9.300   0.599   3.391
  236   HH11  ARG  35          HH11      ARG  35  12.706   0.328   2.834
  237   HH12  ARG  35          HH12      ARG  35  12.868  -0.992   3.931
  238   HH21  ARG  35          HH21      ARG  35   9.571  -1.083   4.774
  239   HH22  ARG  35          HH22      ARG  35  11.133  -1.786   4.992
  240    H    LEU  36           H        LEU  36   6.571   1.956  -1.377
  241    HA   LEU  36           HA       LEU  36   5.213  -0.472  -1.782
  242    HB2  LEU  36           HB2      LEU  36   4.500   2.329  -2.734
  243    HB3  LEU  36           HB3      LEU  36   3.413   0.954  -2.873
  244    HG   LEU  36           HG       LEU  36   4.416   2.171  -0.275
  245   HD11  LEU  36          HD11      LEU  36   2.774   3.588  -1.382
  246   HD12  LEU  36          HD12      LEU  36   2.078   2.850   0.058
  247   HD13  LEU  36          HD13      LEU  36   1.660   2.222  -1.537
  248   HD21  LEU  36          HD21      LEU  36   4.126  -0.264  -0.009
  249   HD22  LEU  36          HD22      LEU  36   2.492  -0.159  -0.667
  250   HD23  LEU  36          HD23      LEU  36   2.880   0.613   0.873
  251    H    ARG  37           H        ARG  37   6.308   1.919  -4.224
  252    HA   ARG  37           HA       ARG  37   5.541   0.480  -6.526
  253    HB2  ARG  37           HB2      ARG  37   6.080   2.963  -6.297
  254    HB3  ARG  37           HB3      ARG  37   7.782   2.528  -6.373
  255    HG2  ARG  37           HG2      ARG  37   7.566   1.715  -8.616
  256    HG3  ARG  37           HG3      ARG  37   5.806   1.783  -8.548
  257    HD2  ARG  37           HD2      ARG  37   6.682   3.622  -9.887
  258    HD3  ARG  37           HD3      ARG  37   5.901   4.251  -8.439
  259    HE   ARG  37           HE       ARG  37   8.311   4.328  -7.530
  260   HH11  ARG  37          HH11      ARG  37   7.558   4.922 -10.862
  261   HH12  ARG  37          HH12      ARG  37   8.878   6.017 -11.060
  262   HH21  ARG  37          HH21      ARG  37   9.971   5.714  -7.828
  263   HH22  ARG  37          HH22      ARG  37  10.232   6.443  -9.375
  264    H    GLU  38           H        GLU  38   8.285   0.086  -4.444
  265    HA   GLU  38           HA       GLU  38   9.933  -1.432  -6.304
  266    HB2  GLU  38           HB2      GLU  38  10.107  -1.127  -3.275
  267    HB3  GLU  38           HB3      GLU  38  11.282  -2.003  -4.250
  268    HG2  GLU  38           HG2      GLU  38  10.692   0.963  -4.352
  269    HG3  GLU  38           HG3      GLU  38  12.142   0.191  -3.718
  270    H    LEU  39           H        LEU  39   7.558  -2.129  -3.812
  271    HA   LEU  39           HA       LEU  39   7.885  -5.028  -3.958
  272    HB2  LEU  39           HB2      LEU  39   5.976  -3.277  -2.377
  273    HB3  LEU  39           HB3      LEU  39   6.072  -5.024  -2.234
  274    HG   LEU  39           HG       LEU  39   8.287  -3.067  -1.512
  275   HD11  LEU  39          HD11      LEU  39   7.876  -3.740   0.810
  276   HD12  LEU  39          HD12      LEU  39   6.538  -4.767   0.289
  277   HD13  LEU  39          HD13      LEU  39   6.437  -3.016   0.093
  278   HD21  LEU  39          HD21      LEU  39   8.264  -6.099  -1.246
  279   HD22  LEU  39          HD22      LEU  39   9.511  -5.019  -0.624
  280   HD23  LEU  39          HD23      LEU  39   9.262  -5.158  -2.360
  281    H    VAL  40           H        VAL  40   6.014  -2.677  -5.597
  282    HA   VAL  40           HA       VAL  40   3.994  -4.647  -6.508
  283    HB   VAL  40           HB       VAL  40   4.047  -1.623  -7.010
  284   HG11  VAL  40          HG11      VAL  40   1.686  -1.913  -7.738
  285   HG12  VAL  40          HG12      VAL  40   1.848  -3.661  -7.552
  286   HG13  VAL  40          HG13      VAL  40   2.808  -2.811  -8.762
  287   HG21  VAL  40          HG21      VAL  40   2.428  -3.211  -4.975
  288   HG22  VAL  40          HG22      VAL  40   2.232  -1.488  -5.320
  289   HG23  VAL  40          HG23      VAL  40   3.745  -2.082  -4.627
  290    HA   PRO  41           HA       PRO  41   6.671  -4.712 -10.304
  291    HB2  PRO  41           HB2      PRO  41   6.151  -7.260 -11.066
  292    HB3  PRO  41           HB3      PRO  41   7.268  -6.906  -9.739
  293    HG2  PRO  41           HG2      PRO  41   4.374  -7.743  -9.606
  294    HG3  PRO  41           HG3      PRO  41   5.755  -8.350  -8.667
  295    HD2  PRO  41           HD2      PRO  41   3.993  -6.469  -7.711
  296    HD3  PRO  41           HD3      PRO  41   5.684  -6.569  -7.179
  297    H    GLY  42           H        GLY  42   3.266  -5.033  -9.775
  298    HA2  GLY  42           HA2      GLY  42   2.447  -5.235 -12.573
  299    HA3  GLY  42           HA3      GLY  42   1.397  -5.108 -11.171
  300    H    VAL  43           H        VAL  43   3.972  -3.044 -12.546
  301    HA   VAL  43           HA       VAL  43   2.097  -0.741 -12.639
  302    HB   VAL  43           HB       VAL  43   5.100  -0.675 -12.031
  303   HG11  VAL  43          HG11      VAL  43   4.485   1.274 -13.371
  304   HG12  VAL  43          HG12      VAL  43   4.819   1.769 -11.713
  305   HG13  VAL  43          HG13      VAL  43   3.149   1.651 -12.276
  306   HG21  VAL  43          HG21      VAL  43   3.797  -1.416 -10.086
  307   HG22  VAL  43          HG22      VAL  43   2.736  -0.011 -10.221
  308   HG23  VAL  43          HG23      VAL  43   4.440   0.203  -9.809
  309    HA   PRO  44           HA       PRO  44   3.206  -0.860 -17.117
  310    HB2  PRO  44           HB2      PRO  44   1.638   1.704 -17.073
  311    HB3  PRO  44           HB3      PRO  44   1.465   0.296 -18.133
  312    HG2  PRO  44           HG2      PRO  44  -0.314   0.746 -16.185
  313    HG3  PRO  44           HG3      PRO  44   0.225  -0.912 -16.542
  314    HD2  PRO  44           HD2      PRO  44   1.108   0.939 -14.319
  315    HD3  PRO  44           HD3      PRO  44   0.713  -0.795 -14.248
  316    H    ARG  45           H        ARG  45   5.196  -0.227 -17.701
  317    HA   ARG  45           HA       ARG  45   6.770   1.696 -16.344
  318    HB2  ARG  45           HB2      ARG  45   7.277   0.423 -19.054
  319    HB3  ARG  45           HB3      ARG  45   8.483   1.243 -18.061
  320    HG2  ARG  45           HG2      ARG  45   8.228  -0.478 -16.309
  321    HG3  ARG  45           HG3      ARG  45   6.998  -1.292 -17.280
  322    HD2  ARG  45           HD2      ARG  45   9.129  -2.430 -17.525
  323    HD3  ARG  45           HD3      ARG  45   8.690  -1.670 -19.061
  324    HE   ARG  45           HE       ARG  45  10.509  -0.289 -17.206
  325   HH11  ARG  45          HH11      ARG  45  10.059  -1.728 -20.321
  326   HH12  ARG  45          HH12      ARG  45  11.608  -1.215 -20.884
  327   HH21  ARG  45          HH21      ARG  45  12.462   0.346 -17.944
  328   HH22  ARG  45          HH22      ARG  45  12.953  -0.057 -19.554
  329    H    GLY  46           H        GLY  46   4.915   1.875 -19.352
  330    HA2  GLY  46           HA2      GLY  46   5.864   4.483 -20.172
  331    HA3  GLY  46           HA3      GLY  46   4.546   3.565 -20.880
  332    H    THR  47           H        THR  47   4.067   3.896 -17.523
  333    HA   THR  47           HA       THR  47   2.157   6.126 -17.902
  334    HB   THR  47           HB       THR  47   2.286   4.014 -15.705
  335    HG1  THR  47           HG1      THR  47   0.804   4.302 -18.089
  336   HG21  THR  47          HG21      THR  47   0.193   6.192 -16.140
  337   HG22  THR  47          HG22      THR  47   1.332   6.107 -14.795
  338   HG23  THR  47          HG23      THR  47   0.079   4.880 -14.964
  339    H    GLN  48           H        GLN  48   4.537   4.955 -15.458
  340    HA   GLN  48           HA       GLN  48   5.594   5.894 -13.704
  341    HB2  GLN  48           HB2      GLN  48   6.779   7.257 -15.314
  342    HB3  GLN  48           HB3      GLN  48   5.449   8.396 -15.430
  343    HG2  GLN  48           HG2      GLN  48   7.410   9.264 -14.147
  344    HG3  GLN  48           HG3      GLN  48   5.907   9.285 -13.237
  345   HE21  GLN  48          HE21      GLN  48   5.758   8.066 -11.371
  346   HE22  GLN  48          HE22      GLN  48   7.087   7.214 -10.678
  347    H    LEU  49           H        LEU  49   4.524   5.857 -11.874
  348    HA   LEU  49           HA       LEU  49   1.879   7.036 -11.550
  349    HB2  LEU  49           HB2      LEU  49   3.530   5.489  -9.519
  350    HB3  LEU  49           HB3      LEU  49   1.798   5.783  -9.460
  351    HG   LEU  49           HG       LEU  49   3.236   4.018 -11.470
  352   HD11  LEU  49          HD11      LEU  49   2.175   2.148 -10.288
  353   HD12  LEU  49          HD12      LEU  49   1.474   3.265  -9.116
  354   HD13  LEU  49          HD13      LEU  49   3.226   3.065  -9.211
  355   HD21  LEU  49          HD21      LEU  49   0.986   3.304 -12.205
  356   HD22  LEU  49          HD22      LEU  49   1.250   5.020 -12.505
  357   HD23  LEU  49          HD23      LEU  49   0.251   4.508 -11.142
  358    H    SER  50           H        SER  50   1.375   8.868 -10.388
  359    HA   SER  50           HA       SER  50   3.329  10.000  -8.472
  360    HB2  SER  50           HB2      SER  50   2.183  11.550 -10.094
  361    HB3  SER  50           HB3      SER  50   0.641  11.156  -9.338
  362    HG   SER  50           HG       SER  50   2.383  13.011  -8.616
  363    H    GLN  51           H        GLN  51   1.708  11.035  -6.500
  364    HA   GLN  51           HA       GLN  51   1.897   9.035  -4.637
  365    HB2  GLN  51           HB2      GLN  51   0.125  11.498  -4.514
  366    HB3  GLN  51           HB3      GLN  51   0.597  10.533  -3.116
  367    HG2  GLN  51           HG2      GLN  51   2.953  11.119  -3.487
  368    HG3  GLN  51           HG3      GLN  51   2.510  12.042  -4.921
  369   HE21  GLN  51          HE21      GLN  51   0.123  13.253  -3.730
  370   HE22  GLN  51          HE22      GLN  51   0.694  14.407  -2.584
  371    H    VAL  52           H        VAL  52  -1.251  10.098  -6.063
  372    HA   VAL  52           HA       VAL  52  -2.834   8.240  -4.540
  373    HB   VAL  52           HB       VAL  52  -3.670   9.700  -7.095
  374   HG11  VAL  52          HG11      VAL  52  -5.222   7.883  -6.486
  375   HG12  VAL  52          HG12      VAL  52  -5.985   9.451  -6.220
  376   HG13  VAL  52          HG13      VAL  52  -5.367   8.528  -4.847
  377   HG21  VAL  52          HG21      VAL  52  -2.865  11.329  -5.463
  378   HG22  VAL  52          HG22      VAL  52  -3.882  10.624  -4.205
  379   HG23  VAL  52          HG23      VAL  52  -4.624  11.434  -5.588
  380    H    GLU  53           H        GLU  53  -1.527   8.227  -7.849
  381    HA   GLU  53           HA       GLU  53  -2.895   5.920  -8.814
  382    HB2  GLU  53           HB2      GLU  53  -0.261   7.077  -9.830
  383    HB3  GLU  53           HB3      GLU  53  -1.271   5.910 -10.675
  384    HG2  GLU  53           HG2      GLU  53  -1.935   7.824 -11.747
  385    HG3  GLU  53           HG3      GLU  53  -3.123   7.796 -10.452
  386    H    ILE  54           H        ILE  54   0.116   6.315  -7.020
  387    HA   ILE  54           HA       ILE  54   1.094   3.669  -7.209
  388    HB   ILE  54           HB       ILE  54   1.373   5.676  -4.917
  389   HG12  ILE  54          HG12      ILE  54   3.318   4.909  -7.159
  390   HG13  ILE  54          HG13      ILE  54   2.402   6.406  -7.067
  391   HG21  ILE  54          HG21      ILE  54   1.740   3.445  -3.992
  392   HG22  ILE  54          HG22      ILE  54   3.283   4.283  -4.109
  393   HG23  ILE  54          HG23      ILE  54   2.866   3.043  -5.296
  394   HD11  ILE  54          HD11      ILE  54   4.591   5.540  -5.184
  395   HD12  ILE  54          HD12      ILE  54   3.658   7.033  -5.049
  396   HD13  ILE  54          HD13      ILE  54   4.702   6.766  -6.445
  397    H    LEU  55           H        LEU  55  -1.064   5.148  -4.721
  398    HA   LEU  55           HA       LEU  55  -1.632   2.929  -3.135
  399    HB2  LEU  55           HB2      LEU  55  -3.501   5.196  -3.918
  400    HB3  LEU  55           HB3      LEU  55  -3.822   4.065  -2.612
  401    HG   LEU  55           HG       LEU  55  -1.531   6.062  -2.698
  402   HD11  LEU  55          HD11      LEU  55  -3.704   7.149  -2.346
  403   HD12  LEU  55          HD12      LEU  55  -2.723   7.214  -0.885
  404   HD13  LEU  55          HD13      LEU  55  -4.051   6.056  -1.001
  405   HD21  LEU  55          HD21      LEU  55  -0.857   4.034  -1.495
  406   HD22  LEU  55          HD22      LEU  55  -2.310   4.119  -0.496
  407   HD23  LEU  55          HD23      LEU  55  -1.077   5.374  -0.373
  408    H    GLN  56           H        GLN  56  -3.329   3.989  -6.059
  409    HA   GLN  56           HA       GLN  56  -5.348   2.059  -6.222
  410    HB2  GLN  56           HB2      GLN  56  -3.883   3.608  -8.395
  411    HB3  GLN  56           HB3      GLN  56  -5.321   2.640  -8.704
  412    HG2  GLN  56           HG2      GLN  56  -6.668   4.082  -7.277
  413    HG3  GLN  56           HG3      GLN  56  -5.237   4.978  -6.769
  414   HE21  GLN  56          HE21      GLN  56  -6.301   6.899  -7.479
  415   HE22  GLN  56          HE22      GLN  56  -6.352   7.319  -9.152
  416    H    ARG  57           H        ARG  57  -2.108   2.031  -7.784
  417    HA   ARG  57           HA       ARG  57  -2.320  -0.559  -8.963
  418    HB2  ARG  57           HB2      ARG  57   0.066   1.206  -8.340
  419    HB3  ARG  57           HB3      ARG  57   0.224  -0.328  -9.188
  420    HG2  ARG  57           HG2      ARG  57  -1.635   1.806 -10.248
  421    HG3  ARG  57           HG3      ARG  57   0.095   1.911 -10.538
  422    HD2  ARG  57           HD2      ARG  57  -0.865   0.888 -12.458
  423    HD3  ARG  57           HD3      ARG  57  -0.013  -0.383 -11.583
  424    HE   ARG  57           HE       ARG  57  -2.797  -0.274 -10.902
  425   HH11  ARG  57          HH11      ARG  57  -0.552  -1.574 -13.196
  426   HH12  ARG  57          HH12      ARG  57  -1.693  -2.707 -13.816
  427   HH21  ARG  57          HH21      ARG  57  -4.204  -1.750 -11.725
  428   HH22  ARG  57          HH22      ARG  57  -3.725  -2.782 -13.027
  429    H    VAL  58           H        VAL  58  -1.327   0.455  -5.740
  430    HA   VAL  58           HA       VAL  58  -0.144  -2.010  -4.908
  431    HB   VAL  58           HB       VAL  58  -1.474   0.179  -3.230
  432   HG11  VAL  58          HG11      VAL  58  -1.553  -1.934  -1.978
  433   HG12  VAL  58          HG12      VAL  58  -0.374  -0.846  -1.251
  434   HG13  VAL  58          HG13      VAL  58   0.171  -2.194  -2.255
  435   HG21  VAL  58          HG21      VAL  58   0.842   0.841  -2.656
  436   HG22  VAL  58          HG22      VAL  58   0.579   0.909  -4.396
  437   HG23  VAL  58          HG23      VAL  58   1.476  -0.437  -3.697
  438    H    ILE  59           H        ILE  59  -3.487  -0.707  -4.640
  439    HA   ILE  59           HA       ILE  59  -4.708  -2.939  -3.408
  440    HB   ILE  59           HB       ILE  59  -5.964  -0.942  -5.355
  441   HG12  ILE  59          HG12      ILE  59  -5.898  -0.921  -2.293
  442   HG13  ILE  59          HG13      ILE  59  -4.949   0.128  -3.337
  443   HG21  ILE  59          HG21      ILE  59  -7.387  -2.945  -5.152
  444   HG22  ILE  59          HG22      ILE  59  -8.149  -1.571  -4.358
  445   HG23  ILE  59          HG23      ILE  59  -7.355  -2.813  -3.390
  446   HD11  ILE  59          HD11      ILE  59  -7.956   0.126  -3.092
  447   HD12  ILE  59          HD12      ILE  59  -7.006   1.183  -4.140
  448   HD13  ILE  59          HD13      ILE  59  -6.841   1.297  -2.389
  449    H    ASP  60           H        ASP  60  -4.275  -2.132  -6.859
  450    HA   ASP  60           HA       ASP  60  -5.491  -4.357  -8.065
  451    HB2  ASP  60           HB2      ASP  60  -3.143  -2.692  -9.062
  452    HB3  ASP  60           HB3      ASP  60  -4.069  -3.811 -10.059
  453    H    TYR  61           H        TYR  61  -2.113  -3.905  -7.029
  454    HA   TYR  61           HA       TYR  61  -1.017  -6.370  -7.774
  455    HB2  TYR  61           HB2      TYR  61   0.513  -4.699  -7.056
  456    HB3  TYR  61           HB3      TYR  61  -0.369  -4.387  -5.569
  457    HD1  TYR  61           HD1      TYR  61   1.799  -6.929  -7.266
  458    HD2  TYR  61           HD2      TYR  61   0.252  -5.512  -3.534
  459    HE1  TYR  61           HE1      TYR  61   3.265  -8.488  -6.054
  460    HE2  TYR  61           HE2      TYR  61   1.731  -7.061  -2.342
  461    HH   TYR  61           HH       TYR  61   2.839  -9.198  -2.765
  462    H    ILE  62           H        ILE  62  -2.647  -5.451  -4.744
  463    HA   ILE  62           HA       ILE  62  -2.395  -7.962  -3.433
  464    HB   ILE  62           HB       ILE  62  -4.458  -5.757  -2.925
  465   HG12  ILE  62          HG12      ILE  62  -1.789  -6.234  -1.492
  466   HG13  ILE  62          HG13      ILE  62  -2.036  -5.013  -2.730
  467   HG21  ILE  62          HG21      ILE  62  -3.576  -8.027  -1.090
  468   HG22  ILE  62          HG22      ILE  62  -5.148  -7.883  -1.880
  469   HG23  ILE  62          HG23      ILE  62  -4.675  -6.715  -0.649
  470   HD11  ILE  62          HD11      ILE  62  -3.657  -3.875  -1.279
  471   HD12  ILE  62          HD12      ILE  62  -2.076  -4.039  -0.516
  472   HD13  ILE  62          HD13      ILE  62  -3.397  -5.104  -0.036
  473    H    LEU  63           H        LEU  63  -4.892  -6.619  -5.611
  474    HA   LEU  63           HA       LEU  63  -6.876  -8.603  -5.377
  475    HB2  LEU  63           HB2      LEU  63  -6.112  -6.902  -7.776
  476    HB3  LEU  63           HB3      LEU  63  -7.537  -7.928  -7.737
  477    HG   LEU  63           HG       LEU  63  -7.031  -5.529  -5.935
  478   HD11  LEU  63          HD11      LEU  63  -8.877  -4.455  -7.164
  479   HD12  LEU  63          HD12      LEU  63  -8.970  -5.848  -8.244
  480   HD13  LEU  63          HD13      LEU  63  -7.520  -4.842  -8.223
  481   HD21  LEU  63          HD21      LEU  63  -9.350  -5.852  -5.136
  482   HD22  LEU  63          HD22      LEU  63  -8.315  -7.211  -4.717
  483   HD23  LEU  63          HD23      LEU  63  -9.455  -7.358  -6.056
  484    H    ASP  64           H        ASP  64  -4.021  -8.478  -7.530
  485    HA   ASP  64           HA       ASP  64  -4.328 -10.851  -8.960
  486    HB2  ASP  64           HB2      ASP  64  -1.785  -9.482  -7.983
  487    HB3  ASP  64           HB3      ASP  64  -1.798 -10.807  -9.141
  488    H    LEU  65           H        LEU  65  -3.169 -10.359  -5.683
  489    HA   LEU  65           HA       LEU  65  -2.287 -13.104  -5.261
  490    HB2  LEU  65           HB2      LEU  65  -2.649 -10.868  -3.232
  491    HB3  LEU  65           HB3      LEU  65  -1.744 -12.359  -2.998
  492    HG   LEU  65           HG       LEU  65  -1.004 -10.091  -4.890
  493   HD11  LEU  65          HD11      LEU  65   0.312 -11.003  -2.316
  494   HD12  LEU  65          HD12      LEU  65  -0.598  -9.510  -2.559
  495   HD13  LEU  65          HD13      LEU  65   0.928  -9.757  -3.402
  496   HD21  LEU  65          HD21      LEU  65  -0.352 -12.240  -5.876
  497   HD22  LEU  65          HD22      LEU  65   0.479 -12.695  -4.387
  498   HD23  LEU  65          HD23      LEU  65   1.072 -11.342  -5.352
  499    H    GLN  66           H        GLN  66  -5.153 -11.186  -4.535
  500    HA   GLN  66           HA       GLN  66  -6.283 -13.129  -2.667
  501    HB2  GLN  66           HB2      GLN  66  -7.508 -10.546  -3.734
  502    HB3  GLN  66           HB3      GLN  66  -8.185 -11.542  -2.451
  503    HG2  GLN  66           HG2      GLN  66  -5.601  -9.964  -2.352
  504    HG3  GLN  66           HG3      GLN  66  -7.096  -9.596  -1.503
  505   HE21  GLN  66          HE21      GLN  66  -4.417 -10.006  -0.425
  506   HE22  GLN  66          HE22      GLN  66  -4.551 -11.291   0.713
  507    H    VAL  67           H        VAL  67  -7.693 -11.579  -5.605
  508    HA   VAL  67           HA       VAL  67  -9.573 -13.802  -5.889
  509    HB   VAL  67           HB       VAL  67 -10.724 -12.393  -7.568
  510   HG11  VAL  67          HG11      VAL  67 -11.464 -10.574  -6.067
  511   HG12  VAL  67          HG12      VAL  67 -10.074 -10.863  -5.017
  512   HG13  VAL  67          HG13      VAL  67 -11.314 -12.105  -5.201
  513   HG21  VAL  67          HG21      VAL  67  -8.527 -10.332  -7.095
  514   HG22  VAL  67          HG22      VAL  67  -9.987 -10.082  -8.055
  515   HG23  VAL  67          HG23      VAL  67  -8.779 -11.253  -8.580
  516    H    VAL  68           H        VAL  68  -9.846 -15.041  -7.771
  517    HA   VAL  68           HA       VAL  68  -7.792 -14.915  -9.907
  518    HB   VAL  68           HB       VAL  68  -8.742 -17.528  -8.593
  519   HG11  VAL  68          HG11      VAL  68  -7.089 -18.659 -10.052
  520   HG12  VAL  68          HG12      VAL  68  -6.717 -17.120 -10.833
  521   HG13  VAL  68          HG13      VAL  68  -8.326 -17.825 -10.992
  522   HG21  VAL  68          HG21      VAL  68  -7.164 -16.348  -7.120
  523   HG22  VAL  68          HG22      VAL  68  -5.994 -16.212  -8.434
  524   HG23  VAL  68          HG23      VAL  68  -6.413 -17.800  -7.785
  525    H1   MET   1           H1       MET   1   9.296   2.790  32.106
  526    H2   MET   1           H2       MET   1  10.030   4.307  32.021
  527    H3   MET   1           H3       MET   1   8.772   3.917  30.966
  528    HA   MET   1           HA       MET   1   8.017   5.391  32.692
  529    HB2  MET   1           HB2      MET   1   6.395   3.795  31.747
  530    HB3  MET   1           HB3      MET   1   6.895   2.556  32.888
  531    HG2  MET   1           HG2      MET   1   6.062   4.016  34.749
  532    HG3  MET   1           HG3      MET   1   5.449   5.140  33.531
  533    HE1  MET   1           HE1      MET   1   2.235   3.344  35.037
  534    HE2  MET   1           HE2      MET   1   3.030   4.899  34.804
  535    HE3  MET   1           HE3      MET   1   3.720   3.714  35.915
  536    H    GLY   2           H        GLY   2   8.441   6.153  34.701
  537    HA2  GLY   2           HA2      GLY   2   9.740   4.684  36.785
  538    HA3  GLY   2           HA3      GLY   2   8.949   6.243  36.944
  539    H    HIS   3           H        HIS   3   8.857   3.397  38.370
  540    HA   HIS   3           HA       HIS   3   6.181   2.470  38.138
  541    HB2  HIS   3           HB2      HIS   3   7.985   0.986  38.885
  542    HB3  HIS   3           HB3      HIS   3   8.254   1.981  40.313
  543    HD2  HIS   3           HD2      HIS   3   5.096  -0.011  38.928
  544    HE1  HIS   3           HE1      HIS   3   5.388  -0.460  43.127
  545    HE2  HIS   3           HE2      HIS   3   4.086  -1.087  41.054
  546    H    HIS   4           H        HIS   4   4.745   4.156  38.456
  547    HA   HIS   4           HA       HIS   4   4.311   4.929  41.285
  548    HB2  HIS   4           HB2      HIS   4   3.080   6.948  40.406
  549    HB3  HIS   4           HB3      HIS   4   4.807   6.961  40.091
  550    HD2  HIS   4           HD2      HIS   4   1.450   6.476  38.066
  551    HE1  HIS   4           HE1      HIS   4   4.589   7.547  35.444
  552    HE2  HIS   4           HE2      HIS   4   2.156   6.893  35.607
  553    H    HIS   5           H        HIS   5   2.463   4.217  42.175
  554    HA   HIS   5           HA       HIS   5   0.541   2.649  40.681
  555    HB2  HIS   5           HB2      HIS   5  -0.542   2.262  42.876
  556    HB3  HIS   5           HB3      HIS   5   1.190   1.980  42.966
  557    HD2  HIS   5           HD2      HIS   5   2.639   3.823  44.548
  558    HE1  HIS   5           HE1      HIS   5  -0.818   5.619  46.189
  559    HE2  HIS   5           HE2      HIS   5   1.708   5.530  46.257
  560    H    HIS   6           H        HIS   6   0.819   5.964  41.410
  561    HA   HIS   6           HA       HIS   6  -1.863   6.802  41.690
  562    HB2  HIS   6           HB2      HIS   6   0.027   8.254  42.310
  563    HB3  HIS   6           HB3      HIS   6   0.547   8.340  40.628
  564    HD2  HIS   6           HD2      HIS   6  -0.219  10.726  39.586
  565    HE1  HIS   6           HE1      HIS   6  -3.874  11.099  41.679
  566    HE2  HIS   6           HE2      HIS   6  -2.435  12.047  39.838
  567    H    HIS   7           H        HIS   7  -3.418   7.434  40.244
  568    HA   HIS   7           HA       HIS   7  -4.747   7.268  38.446
  569    HB2  HIS   7           HB2      HIS   7  -2.257   8.506  37.298
  570    HB3  HIS   7           HB3      HIS   7  -3.489   7.990  36.157
  571    HD2  HIS   7           HD2      HIS   7  -2.562  11.188  37.461
  572    HE1  HIS   7           HE1      HIS   7  -6.787  11.223  37.642
  573    HE2  HIS   7           HE2      HIS   7  -4.708  12.637  37.396
  574    H    HIS   8           H        HIS   8  -5.085   4.997  38.574
  575    HA   HIS   8           HA       HIS   8  -3.787   3.340  36.534
  576    HB2  HIS   8           HB2      HIS   8  -4.381   2.305  38.737
  577    HB3  HIS   8           HB3      HIS   8  -6.087   2.617  38.413
  578    HD2  HIS   8           HD2      HIS   8  -3.198   0.264  37.152
  579    HE1  HIS   8           HE1      HIS   8  -6.890  -1.139  35.644
  580    HE2  HIS   8           HE2      HIS   8  -4.458  -1.695  36.025
  581    H    SER   9           H        SER   9  -4.428   3.777  34.503
  582    HA   SER   9           HA       SER   9  -6.888   4.976  33.743
  583    HB2  SER   9           HB2      SER   9  -4.844   5.217  32.383
  584    HB3  SER   9           HB3      SER   9  -4.851   3.491  32.030
  585    HG   SER   9           HG       SER   9  -6.121   3.936  30.415
  586    H    HIS  10           H        HIS  10  -8.737   4.127  32.883
  587    HA   HIS  10           HA       HIS  10  -9.099   1.252  32.504
  588    HB2  HIS  10           HB2      HIS  10 -11.127   1.249  34.029
  589    HB3  HIS  10           HB3      HIS  10  -9.582   1.388  34.851
  590    HD1  HIS  10           HD1      HIS  10 -12.838   2.693  35.077
  591    HD2  HIS  10           HD2      HIS  10  -9.063   4.396  35.392
  592    HE1  HIS  10           HE1      HIS  10 -13.155   4.797  36.385
  593    HE2  HIS  10           HE2      HIS  10 -10.852   5.749  36.662
  594    H    MET  11           H        MET  11 -10.531   0.808  30.895
  595    HA   MET  11           HA       MET  11 -11.165   3.021  29.158
  596    HB2  MET  11           HB2      MET  11 -10.204   0.926  28.274
  597    HB3  MET  11           HB3      MET  11 -11.614   0.022  28.812
  598    HG2  MET  11           HG2      MET  11 -11.685   0.417  26.402
  599    HG3  MET  11           HG3      MET  11 -13.019   1.250  27.207
  600    HE1  MET  11           HE1      MET  11 -12.188   1.958  24.221
  601    HE2  MET  11           HE2      MET  11 -12.197   3.719  24.273
  602    HE3  MET  11           HE3      MET  11 -13.466   2.809  25.092
  603    H    GLY  12           H        GLY  12 -13.139   3.743  28.457
  604    HA2  GLY  12           HA2      GLY  12 -15.661   2.569  29.490
  605    HA3  GLY  12           HA3      GLY  12 -15.351   4.298  29.627
  606    H    GLY  13           H        GLY  13 -16.732   5.242  28.205
  607    HA2  GLY  13           HA2      GLY  13 -17.420   6.062  26.156
  608    HA3  GLY  13           HA3      GLY  13 -16.288   4.979  25.359
  609    H    GLY  14           H        GLY  14 -19.238   4.590  27.382
  610    HA2  GLY  14           HA2      GLY  14 -20.177   2.334  25.770
  611    HA3  GLY  14           HA3      GLY  14 -20.871   2.922  27.269
  612    H    LYS  15           H        LYS  15 -20.452   5.523  25.180
  613    HA   LYS  15           HA       LYS  15 -23.313   5.572  24.460
  614    HB2  LYS  15           HB2      LYS  15 -22.360   7.450  25.796
  615    HB3  LYS  15           HB3      LYS  15 -21.225   7.812  24.510
  616    HG2  LYS  15           HG2      LYS  15 -24.188   7.895  23.935
  617    HG3  LYS  15           HG3      LYS  15 -23.450   9.227  24.818
  618    HD2  LYS  15           HD2      LYS  15 -21.910   9.648  22.930
  619    HD3  LYS  15           HD3      LYS  15 -22.592   8.282  22.047
  620    HE2  LYS  15           HE2      LYS  15 -23.513  10.377  21.186
  621    HE3  LYS  15           HE3      LYS  15 -24.793   9.459  21.982
  622    HZ1  LYS  15           HZ1      LYS  15 -24.876  11.782  22.575
  623    HZ2  LYS  15           HZ2      LYS  15 -23.291  11.725  23.157
  624    HZ3  LYS  15           HZ3      LYS  15 -24.503  10.852  23.936
  625    H    GLY  16           H        GLY  16 -24.002   5.506  22.366
  626    HA2  GLY  16           HA2      GLY  16 -22.046   5.188  20.161
  627    HA3  GLY  16           HA3      GLY  16 -23.712   4.658  20.164
  628    HA   PRO  17           HA       PRO  17 -23.653   9.375  18.932
  629    HB2  PRO  17           HB2      PRO  17 -21.457  10.294  17.656
  630    HB3  PRO  17           HB3      PRO  17 -21.505  10.185  19.422
  631    HG2  PRO  17           HG2      PRO  17 -20.251   8.289  17.442
  632    HG3  PRO  17           HG3      PRO  17 -19.577   8.927  18.957
  633    HD2  PRO  17           HD2      PRO  17 -20.769   6.440  18.730
  634    HD3  PRO  17           HD3      PRO  17 -20.700   7.360  20.254
  635    H    ALA  18           H        ALA  18 -24.197  10.346  16.844
  636    HA   ALA  18           HA       ALA  18 -23.993   8.593  14.455
  637    HB1  ALA  18           HB1      ALA  18 -26.354   8.994  13.901
  638    HB2  ALA  18           HB2      ALA  18 -26.558   9.942  15.376
  639    HB3  ALA  18           HB3      ALA  18 -26.209   8.217  15.483
  640    H    ALA  19           H        ALA  19 -22.293  10.071  13.856
  641    HA   ALA  19           HA       ALA  19 -23.226  12.604  12.649
  642    HB1  ALA  19           HB1      ALA  19 -22.233  13.180  14.840
  643    HB2  ALA  19           HB2      ALA  19 -21.254  13.807  13.512
  644    HB3  ALA  19           HB3      ALA  19 -20.738  12.361  14.384
  645    H    GLU  20           H        GLU  20 -22.367  13.009  10.668
  646    HA   GLU  20           HA       GLU  20 -20.694  10.944   9.414
  647    HB2  GLU  20           HB2      GLU  20 -21.527  12.021   7.259
  648    HB3  GLU  20           HB3      GLU  20 -22.766  11.303   8.274
  649    HG2  GLU  20           HG2      GLU  20 -23.711  13.311   7.492
  650    HG3  GLU  20           HG3      GLU  20 -23.259  13.633   9.159
  651    H    GLU  21           H        GLU  21 -19.497  12.040   7.363
  652    HA   GLU  21           HA       GLU  21 -17.751  14.206   8.369
  653    HB2  GLU  21           HB2      GLU  21 -16.054  13.356   6.732
  654    HB3  GLU  21           HB3      GLU  21 -16.484  12.184   7.970
  655    HG2  GLU  21           HG2      GLU  21 -18.016  11.082   6.311
  656    HG3  GLU  21           HG3      GLU  21 -17.393  12.170   5.074
  657    HA   PRO  22           HA       PRO  22 -19.971  16.778   5.318
  658    HB2  PRO  22           HB2      PRO  22 -17.642  18.615   5.873
  659    HB3  PRO  22           HB3      PRO  22 -19.378  18.966   5.883
  660    HG2  PRO  22           HG2      PRO  22 -18.069  18.702   8.186
  661    HG3  PRO  22           HG3      PRO  22 -19.691  17.989   8.008
  662    HD2  PRO  22           HD2      PRO  22 -16.991  16.629   7.870
  663    HD3  PRO  22           HD3      PRO  22 -18.481  16.090   8.679
  664    H    LEU  23           H        LEU  23 -19.593  15.509   3.464
  665    HA   LEU  23           HA       LEU  23 -17.067  15.429   2.083
  666    HB2  LEU  23           HB2      LEU  23 -19.833  14.496   1.242
  667    HB3  LEU  23           HB3      LEU  23 -18.379  14.223   0.297
  668    HG   LEU  23           HG       LEU  23 -18.918  13.094   3.075
  669   HD11  LEU  23          HD11      LEU  23 -18.857  11.682   0.388
  670   HD12  LEU  23          HD12      LEU  23 -20.294  12.014   1.356
  671   HD13  LEU  23          HD13      LEU  23 -19.063  10.908   1.962
  672   HD21  LEU  23          HD21      LEU  23 -16.513  13.538   2.766
  673   HD22  LEU  23          HD22      LEU  23 -16.523  12.630   1.251
  674   HD23  LEU  23          HD23      LEU  23 -16.831  11.805   2.781
  675    H    SER  24           H        SER  24 -16.288  17.039   0.885
  676    HA   SER  24           HA       SER  24 -18.054  18.453  -1.040
  677    HB2  SER  24           HB2      SER  24 -17.289  20.072   0.668
  678    HB3  SER  24           HB3      SER  24 -15.614  19.600   0.392
  679    HG   SER  24           HG       SER  24 -17.359  20.793  -1.509
  680    H    LEU  25           H        LEU  25 -14.545  17.982  -0.435
  681    HA   LEU  25           HA       LEU  25 -14.229  16.803  -3.133
  682    HB2  LEU  25           HB2      LEU  25 -12.150  18.036  -1.282
  683    HB3  LEU  25           HB3      LEU  25 -11.747  17.135  -2.735
  684    HG   LEU  25           HG       LEU  25 -13.243  18.898  -3.979
  685   HD11  LEU  25          HD11      LEU  25 -12.645  20.503  -1.480
  686   HD12  LEU  25          HD12      LEU  25 -14.236  19.984  -2.035
  687   HD13  LEU  25          HD13      LEU  25 -13.309  21.137  -2.992
  688   HD21  LEU  25          HD21      LEU  25 -10.843  18.660  -4.302
  689   HD22  LEU  25          HD22      LEU  25 -10.525  19.683  -2.896
  690   HD23  LEU  25          HD23      LEU  25 -11.315  20.359  -4.325
  691    H    LEU  26           H        LEU  26 -14.460  14.659  -3.045
  692    HA   LEU  26           HA       LEU  26 -13.722  13.117  -0.653
  693    HB2  LEU  26           HB2      LEU  26 -15.862  12.811  -2.176
  694    HB3  LEU  26           HB3      LEU  26 -14.791  11.900  -3.221
  695    HG   LEU  26           HG       LEU  26 -15.373  11.186  -0.307
  696   HD11  LEU  26          HD11      LEU  26 -16.799   9.378  -1.182
  697   HD12  LEU  26          HD12      LEU  26 -16.552   9.967  -2.829
  698   HD13  LEU  26          HD13      LEU  26 -17.405  10.967  -1.649
  699   HD21  LEU  26          HD21      LEU  26 -13.197  10.297  -1.028
  700   HD22  LEU  26          HD22      LEU  26 -13.943   9.557  -2.446
  701   HD23  LEU  26          HD23      LEU  26 -14.360   8.988  -0.827
  702    H    ASP  27           H        ASP  27 -11.496  13.130  -0.618
  703    HA   ASP  27           HA       ASP  27  -9.753  12.799  -2.755
  704    HB2  ASP  27           HB2      ASP  27  -9.289  12.070   0.163
  705    HB3  ASP  27           HB3      ASP  27  -8.027  12.215  -1.059
  706    H    ASP  28           H        ASP  28  -9.955  11.178  -4.129
  707    HA   ASP  28           HA       ASP  28 -10.497   8.497  -3.836
  708    HB2  ASP  28           HB2      ASP  28  -9.984   9.741  -5.994
  709    HB3  ASP  28           HB3      ASP  28  -8.267   9.625  -5.607
  710    H    MET  29           H        MET  29  -7.409  10.122  -3.247
  711    HA   MET  29           HA       MET  29  -5.751   8.074  -2.401
  712    HB2  MET  29           HB2      MET  29  -4.757  10.200  -2.640
  713    HB3  MET  29           HB3      MET  29  -5.980  11.004  -1.669
  714    HG2  MET  29           HG2      MET  29  -4.997  10.297   0.358
  715    HG3  MET  29           HG3      MET  29  -4.042   9.048  -0.431
  716    HE1  MET  29           HE1      MET  29  -1.803   9.390  -1.566
  717    HE2  MET  29           HE2      MET  29  -1.153  10.954  -2.060
  718    HE3  MET  29           HE3      MET  29  -2.619  10.330  -2.818
  719    H    ASN  30           H        ASN  30  -8.070   9.930  -0.376
  720    HA   ASN  30           HA       ASN  30  -7.432   8.679   2.107
  721    HB2  ASN  30           HB2      ASN  30  -8.566  10.951   1.744
  722    HB3  ASN  30           HB3      ASN  30 -10.051  10.079   1.395
  723   HD21  ASN  30          HD21      ASN  30  -9.577  11.987   3.490
  724   HD22  ASN  30          HD22      ASN  30  -9.869  11.176   4.984
  725    H    HIS  31           H        HIS  31  -9.962   8.065  -0.318
  726    HA   HIS  31           HA       HIS  31 -11.404   6.064   1.111
  727    HB2  HIS  31           HB2      HIS  31 -12.163   7.476  -0.928
  728    HB3  HIS  31           HB3      HIS  31 -11.309   6.302  -1.927
  729    HD2  HIS  31           HD2      HIS  31 -14.486   6.522   0.367
  730    HE1  HIS  31           HE1      HIS  31 -14.644   2.931  -1.855
  731    HE2  HIS  31           HE2      HIS  31 -15.945   4.516  -0.381
  732    H    CYS  32           H        CYS  32  -8.805   5.889  -1.309
  733    HA   CYS  32           HA       CYS  32  -8.495   3.082  -1.461
  734    HB2  CYS  32           HB2      CYS  32  -6.501   5.320  -1.989
  735    HB3  CYS  32           HB3      CYS  32  -6.162   3.622  -2.319
  736    HG   CYS  32           HG       CYS  32  -7.596   5.800  -4.255
  737    H    TYR  33           H        TYR  33  -6.994   5.496   0.692
  738    HA   TYR  33           HA       TYR  33  -5.160   3.885   2.082
  739    HB2  TYR  33           HB2      TYR  33  -6.515   6.496   2.599
  740    HB3  TYR  33           HB3      TYR  33  -5.922   5.689   4.042
  741    HD1  TYR  33           HD1      TYR  33  -3.426   4.570   3.525
  742    HD2  TYR  33           HD2      TYR  33  -4.997   8.169   1.834
  743    HE1  TYR  33           HE1      TYR  33  -1.157   5.419   3.219
  744    HE2  TYR  33           HE2      TYR  33  -2.715   9.014   1.523
  745    HH   TYR  33           HH       TYR  33  -0.046   7.174   1.590
  746    H    SER  34           H        SER  34  -8.560   4.548   2.789
  747    HA   SER  34           HA       SER  34  -8.885   3.085   5.157
  748    HB2  SER  34           HB2      SER  34 -10.934   3.547   2.942
  749    HB3  SER  34           HB3      SER  34 -11.307   3.084   4.606
  750    HG   SER  34           HG       SER  34 -10.365   5.530   3.590
  751    H    ARG  35           H        ARG  35  -9.176   2.052   1.751
  752    HA   ARG  35           HA       ARG  35 -10.023  -0.622   2.287
  753    HB2  ARG  35           HB2      ARG  35 -10.086   0.960   0.069
  754    HB3  ARG  35           HB3      ARG  35  -8.661   0.014  -0.333
  755    HG2  ARG  35           HG2      ARG  35 -11.289  -1.260   0.454
  756    HG3  ARG  35           HG3      ARG  35 -10.929  -0.809  -1.211
  757    HD2  ARG  35           HD2      ARG  35  -9.097  -2.379  -1.307
  758    HD3  ARG  35           HD3      ARG  35  -9.206  -2.686   0.429
  759    HE   ARG  35           HE       ARG  35 -11.355  -3.757   0.038
  760   HH11  ARG  35          HH11      ARG  35  -9.368  -3.388  -2.784
  761   HH12  ARG  35          HH12      ARG  35 -10.162  -4.672  -3.623
  762   HH21  ARG  35          HH21      ARG  35 -12.317  -5.408  -1.058
  763   HH22  ARG  35          HH22      ARG  35 -11.802  -5.795  -2.664
  764    H    LEU  36           H        LEU  36  -6.809   0.839   1.784
  765    HA   LEU  36           HA       LEU  36  -5.219  -1.470   1.654
  766    HB2  LEU  36           HB2      LEU  36  -4.587   1.179   3.017
  767    HB3  LEU  36           HB3      LEU  36  -3.402  -0.078   2.695
  768    HG   LEU  36           HG       LEU  36  -4.879   1.587   0.630
  769   HD11  LEU  36          HD11      LEU  36  -3.109   2.817   1.757
  770   HD12  LEU  36          HD12      LEU  36  -2.660   2.482   0.087
  771   HD13  LEU  36          HD13      LEU  36  -1.949   1.534   1.394
  772   HD21  LEU  36          HD21      LEU  36  -3.530   0.442  -1.091
  773   HD22  LEU  36          HD22      LEU  36  -4.591  -0.688  -0.257
  774   HD23  LEU  36          HD23      LEU  36  -2.871  -0.647   0.136
  775    H    ARG  37           H        ARG  37  -6.210   0.428   4.495
  776    HA   ARG  37           HA       ARG  37  -5.141  -1.017   6.604
  777    HB2  ARG  37           HB2      ARG  37  -6.281   1.220   6.666
  778    HB3  ARG  37           HB3      ARG  37  -7.828   0.381   6.592
  779    HG2  ARG  37           HG2      ARG  37  -7.133  -0.841   8.716
  780    HG3  ARG  37           HG3      ARG  37  -5.764   0.269   8.810
  781    HD2  ARG  37           HD2      ARG  37  -7.588   1.040  10.207
  782    HD3  ARG  37           HD3      ARG  37  -7.336   2.172   8.877
  783    HE   ARG  37           HE       ARG  37  -9.297   0.196   8.235
  784   HH11  ARG  37          HH11      ARG  37  -8.962   3.179   9.958
  785   HH12  ARG  37          HH12      ARG  37 -10.634   3.564   9.794
  786   HH21  ARG  37          HH21      ARG  37 -11.388   0.720   8.035
  787   HH22  ARG  37          HH22      ARG  37 -11.992   2.188   8.721
  788    H    GLU  38           H        GLU  38  -7.982  -1.775   4.666
  789    HA   GLU  38           HA       GLU  38  -9.146  -3.693   6.518
  790    HB2  GLU  38           HB2      GLU  38  -9.808  -3.243   3.570
  791    HB3  GLU  38           HB3      GLU  38 -10.789  -4.122   4.738
  792    HG2  GLU  38           HG2      GLU  38 -10.232  -1.154   4.685
  793    HG3  GLU  38           HG3      GLU  38 -11.757  -1.953   4.334
  794    H    LEU  39           H        LEU  39  -7.199  -3.792   3.565
  795    HA   LEU  39           HA       LEU  39  -7.183  -6.672   3.315
  796    HB2  LEU  39           HB2      LEU  39  -5.527  -4.526   1.933
  797    HB3  LEU  39           HB3      LEU  39  -5.510  -6.229   1.494
  798    HG   LEU  39           HG       LEU  39  -7.944  -4.398   1.311
  799   HD11  LEU  39          HD11      LEU  39  -6.268  -3.790  -0.366
  800   HD12  LEU  39          HD12      LEU  39  -7.677  -4.526  -1.127
  801   HD13  LEU  39          HD13      LEU  39  -6.196  -5.462  -0.928
  802   HD21  LEU  39          HD21      LEU  39  -7.634  -7.288   0.399
  803   HD22  LEU  39          HD22      LEU  39  -9.036  -6.256   0.098
  804   HD23  LEU  39          HD23      LEU  39  -8.626  -6.718   1.747
  805    H    VAL  40           H        VAL  40  -5.343  -4.396   5.131
  806    HA   VAL  40           HA       VAL  40  -3.080  -6.240   5.569
  807    HB   VAL  40           HB       VAL  40  -3.447  -3.381   6.600
  808   HG11  VAL  40          HG11      VAL  40  -1.917  -4.666   8.031
  809   HG12  VAL  40          HG12      VAL  40  -1.018  -3.461   7.111
  810   HG13  VAL  40          HG13      VAL  40  -0.970  -5.159   6.624
  811   HG21  VAL  40          HG21      VAL  40  -1.829  -4.390   4.224
  812   HG22  VAL  40          HG22      VAL  40  -1.827  -2.733   4.837
  813   HG23  VAL  40          HG23      VAL  40  -3.305  -3.416   4.157
  814    HA   PRO  41           HA       PRO  41  -5.286  -7.447   9.475
  815    HB2  PRO  41           HB2      PRO  41  -3.871  -9.737   9.938
  816    HB3  PRO  41           HB3      PRO  41  -5.166  -9.662   8.732
  817    HG2  PRO  41           HG2      PRO  41  -2.184  -9.416   8.317
  818    HG3  PRO  41           HG3      PRO  41  -3.354 -10.419   7.426
  819    HD2  PRO  41           HD2      PRO  41  -2.504  -8.028   6.469
  820    HD3  PRO  41           HD3      PRO  41  -4.155  -8.608   6.186
  821    H    GLY  42           H        GLY  42  -1.988  -6.649   8.805
  822    HA2  GLY  42           HA2      GLY  42  -0.768  -6.921  11.346
  823    HA3  GLY  42           HA3      GLY  42  -0.208  -5.890  10.042
  824    H    VAL  43           H        VAL  43  -2.889  -4.450  10.106
  825    HA   VAL  43           HA       VAL  43  -2.261  -2.339  11.916
  826    HB   VAL  43           HB       VAL  43  -4.904  -2.912  10.480
  827   HG11  VAL  43          HG11      VAL  43  -5.441  -0.513  10.829
  828   HG12  VAL  43          HG12      VAL  43  -3.982  -0.327  11.807
  829   HG13  VAL  43          HG13      VAL  43  -5.284  -1.381  12.356
  830   HG21  VAL  43          HG21      VAL  43  -3.022  -2.637   8.917
  831   HG22  VAL  43          HG22      VAL  43  -2.602  -1.089   9.654
  832   HG23  VAL  43          HG23      VAL  43  -4.136  -1.273   8.796
  833    HA   PRO  44           HA       PRO  44  -3.971  -4.321  15.665
  834    HB2  PRO  44           HB2      PRO  44  -3.680  -1.616  16.906
  835    HB3  PRO  44           HB3      PRO  44  -2.962  -3.156  17.392
  836    HG2  PRO  44           HG2      PRO  44  -1.475  -1.218  16.243
  837    HG3  PRO  44           HG3      PRO  44  -1.162  -2.937  15.911
  838    HD2  PRO  44           HD2      PRO  44  -2.633  -0.908  14.224
  839    HD3  PRO  44           HD3      PRO  44  -1.448  -2.140  13.726
  840    H    ARG  45           H        ARG  45  -6.109  -4.670  15.058
  841    HA   ARG  45           HA       ARG  45  -8.345  -4.445  14.827
  842    HB2  ARG  45           HB2      ARG  45  -8.016  -2.293  16.973
  843    HB3  ARG  45           HB3      ARG  45  -9.562  -2.941  16.449
  844    HG2  ARG  45           HG2      ARG  45  -9.203  -4.174  18.370
  845    HG3  ARG  45           HG3      ARG  45  -8.547  -5.259  17.149
  846    HD2  ARG  45           HD2      ARG  45  -7.024  -5.247  18.995
  847    HD3  ARG  45           HD3      ARG  45  -6.250  -4.340  17.693
  848    HE   ARG  45           HE       ARG  45  -7.721  -2.677  19.525
  849   HH11  ARG  45          HH11      ARG  45  -4.615  -4.161  19.021
  850   HH12  ARG  45          HH12      ARG  45  -3.832  -3.105  20.142
  851   HH21  ARG  45          HH21      ARG  45  -6.697  -1.381  20.947
  852   HH22  ARG  45          HH22      ARG  45  -4.995  -1.537  21.203
  853    H    GLY  46           H        GLY  46 -10.116  -2.195  14.836
  854    HA2  GLY  46           HA2      GLY  46  -9.476  -0.881  12.320
  855    HA3  GLY  46           HA3      GLY  46 -10.954  -0.717  13.253
  856    H    THR  47           H        THR  47  -7.526  -0.048  14.115
  857    HA   THR  47           HA       THR  47  -8.204   2.484  15.355
  858    HB   THR  47           HB       THR  47  -5.468   1.185  14.928
  859    HG1  THR  47           HG1      THR  47  -5.827   0.187  16.765
  860   HG21  THR  47          HG21      THR  47  -4.646   2.729  16.680
  861   HG22  THR  47          HG22      THR  47  -6.223   3.521  16.735
  862   HG23  THR  47          HG23      THR  47  -5.231   3.626  15.279
  863    H    GLN  48           H        GLN  48  -7.893   4.503  14.554
  864    HA   GLN  48           HA       GLN  48  -7.188   4.934  11.777
  865    HB2  GLN  48           HB2      GLN  48  -7.870   6.934  13.989
  866    HB3  GLN  48           HB3      GLN  48  -7.600   7.367  12.307
  867    HG2  GLN  48           HG2      GLN  48  -9.961   7.343  12.647
  868    HG3  GLN  48           HG3      GLN  48  -9.571   5.917  11.690
  869   HE21  GLN  48          HE21      GLN  48 -11.474   4.854  12.309
  870   HE22  GLN  48          HE22      GLN  48 -11.719   4.224  13.898
  871    H    LEU  49           H        LEU  49  -5.023   4.092  11.881
  872    HA   LEU  49           HA       LEU  49  -2.888   5.385  13.304
  873    HB2  LEU  49           HB2      LEU  49  -2.747   3.715  10.754
  874    HB3  LEU  49           HB3      LEU  49  -1.381   4.142  11.772
  875    HG   LEU  49           HG       LEU  49  -3.678   2.297  12.551
  876   HD11  LEU  49          HD11      LEU  49  -1.993   0.504  12.538
  877   HD12  LEU  49          HD12      LEU  49  -0.766   1.642  11.976
  878   HD13  LEU  49          HD13      LEU  49  -2.148   1.250  10.949
  879   HD21  LEU  49          HD21      LEU  49  -1.228   3.061  14.186
  880   HD22  LEU  49          HD22      LEU  49  -2.413   1.828  14.620
  881   HD23  LEU  49          HD23      LEU  49  -2.899   3.518  14.533
  882    H    SER  50           H        SER  50  -1.116   6.660  12.269
  883    HA   SER  50           HA       SER  50  -1.941   8.807  10.616
  884    HB2  SER  50           HB2      SER  50   0.920   7.775  10.942
  885    HB3  SER  50           HB3      SER  50   0.446   9.383  10.397
  886    HG   SER  50           HG       SER  50   0.528   8.312  12.951
  887    H    GLN  51           H        GLN  51  -1.820   9.120   8.357
  888    HA   GLN  51           HA       GLN  51  -2.206   7.034   6.582
  889    HB2  GLN  51           HB2      GLN  51  -1.049   9.780   5.959
  890    HB3  GLN  51           HB3      GLN  51  -1.706   8.677   4.753
  891    HG2  GLN  51           HG2      GLN  51  -3.930   8.849   5.776
  892    HG3  GLN  51           HG3      GLN  51  -3.289   9.904   7.032
  893   HE21  GLN  51          HE21      GLN  51  -4.191   9.686   3.673
  894   HE22  GLN  51          HE22      GLN  51  -4.132  11.374   3.338
  895    H    VAL  52           H        VAL  52   0.859   8.451   7.554
  896    HA   VAL  52           HA       VAL  52   2.544   7.156   5.636
  897    HB   VAL  52           HB       VAL  52   3.407   8.145   8.399
  898   HG11  VAL  52          HG11      VAL  52   4.933   7.931   5.776
  899   HG12  VAL  52          HG12      VAL  52   5.111   6.865   7.172
  900   HG13  VAL  52          HG13      VAL  52   5.578   8.560   7.297
  901   HG21  VAL  52          HG21      VAL  52   3.818  10.366   7.394
  902   HG22  VAL  52          HG22      VAL  52   2.108   9.940   7.334
  903   HG23  VAL  52          HG23      VAL  52   3.095   9.818   5.877
  904    H    GLU  53           H        GLU  53   1.667   6.410   9.035
  905    HA   GLU  53           HA       GLU  53   3.180   4.017   9.331
  906    HB2  GLU  53           HB2      GLU  53   0.623   4.846  10.777
  907    HB3  GLU  53           HB3      GLU  53   1.708   3.552  11.285
  908    HG2  GLU  53           HG2      GLU  53   3.518   5.220  11.615
  909    HG3  GLU  53           HG3      GLU  53   2.402   6.504  11.155
  910    H    ILE  54           H        ILE  54  -0.034   4.652   8.023
  911    HA   ILE  54           HA       ILE  54  -0.928   1.984   7.696
  912    HB   ILE  54           HB       ILE  54  -1.625   4.523   6.147
  913   HG12  ILE  54          HG12      ILE  54  -3.170   3.003   8.313
  914   HG13  ILE  54          HG13      ILE  54  -2.302   4.515   8.545
  915   HG21  ILE  54          HG21      ILE  54  -2.975   1.801   5.902
  916   HG22  ILE  54          HG22      ILE  54  -2.092   2.668   4.640
  917   HG23  ILE  54          HG23      ILE  54  -3.617   3.311   5.242
  918   HD11  ILE  54          HD11      ILE  54  -4.745   4.114   6.824
  919   HD12  ILE  54          HD12      ILE  54  -3.866   5.634   7.021
  920   HD13  ILE  54          HD13      ILE  54  -4.677   4.897   8.403
  921    H    LEU  55           H        LEU  55   0.773   4.197   5.413
  922    HA   LEU  55           HA       LEU  55   1.213   2.494   3.259
  923    HB2  LEU  55           HB2      LEU  55   3.076   4.607   4.407
  924    HB3  LEU  55           HB3      LEU  55   3.317   3.846   2.842
  925    HG   LEU  55           HG       LEU  55   0.926   5.567   3.581
  926   HD11  LEU  55          HD11      LEU  55   2.982   6.905   3.478
  927   HD12  LEU  55          HD12      LEU  55   1.908   7.283   2.133
  928   HD13  LEU  55          HD13      LEU  55   3.330   6.270   1.866
  929   HD21  LEU  55          HD21      LEU  55   0.385   5.490   1.184
  930   HD22  LEU  55          HD22      LEU  55   0.363   3.878   1.891
  931   HD23  LEU  55          HD23      LEU  55   1.735   4.386   0.904
  932    H    GLN  56           H        GLN  56   3.286   2.964   6.100
  933    HA   GLN  56           HA       GLN  56   5.290   1.073   5.487
  934    HB2  GLN  56           HB2      GLN  56   4.459   2.375   8.106
  935    HB3  GLN  56           HB3      GLN  56   5.866   1.319   7.965
  936    HG2  GLN  56           HG2      GLN  56   6.898   2.833   6.350
  937    HG3  GLN  56           HG3      GLN  56   5.464   3.856   6.357
  938   HE21  GLN  56          HE21      GLN  56   6.784   5.628   6.915
  939   HE22  GLN  56          HE22      GLN  56   7.396   5.844   8.512
  940    H    ARG  57           H        ARG  57   2.209   0.741   7.177
  941    HA   ARG  57           HA       ARG  57   2.665  -1.946   8.117
  942    HB2  ARG  57           HB2      ARG  57   0.807  -0.014   8.778
  943    HB3  ARG  57           HB3      ARG  57  -0.179  -1.042   7.750
  944    HG2  ARG  57           HG2      ARG  57  -0.459  -1.718  10.064
  945    HG3  ARG  57           HG3      ARG  57   0.395  -2.996   9.194
  946    HD2  ARG  57           HD2      ARG  57   2.546  -2.202  10.118
  947    HD3  ARG  57           HD3      ARG  57   1.703  -0.902  10.973
  948    HE   ARG  57           HE       ARG  57   0.566  -3.341  11.730
  949   HH11  ARG  57          HH11      ARG  57   3.583  -1.708  12.148
  950   HH12  ARG  57          HH12      ARG  57   3.905  -2.471  13.658
  951   HH21  ARG  57          HH21      ARG  57   0.995  -4.309  13.643
  952   HH22  ARG  57          HH22      ARG  57   2.446  -3.932  14.505
  953    H    VAL  58           H        VAL  58   1.343  -0.538   5.162
  954    HA   VAL  58           HA       VAL  58   0.462  -2.989   3.958
  955    HB   VAL  58           HB       VAL  58   1.256  -0.360   2.601
  956   HG11  VAL  58          HG11      VAL  58  -0.034  -1.179   0.646
  957   HG12  VAL  58          HG12      VAL  58  -0.292  -2.727   1.460
  958   HG13  VAL  58          HG13      VAL  58   1.338  -2.228   1.005
  959   HG21  VAL  58          HG21      VAL  58  -1.521  -1.384   3.345
  960   HG22  VAL  58          HG22      VAL  58  -1.158   0.124   2.497
  961   HG23  VAL  58          HG23      VAL  58  -0.643  -0.094   4.167
  962    H    ILE  59           H        ILE  59   3.508  -1.117   3.815
  963    HA   ILE  59           HA       ILE  59   5.017  -2.747   2.083
  964    HB   ILE  59           HB       ILE  59   5.953  -1.087   4.479
  965   HG12  ILE  59          HG12      ILE  59   6.001  -0.334   1.511
  966   HG13  ILE  59          HG13      ILE  59   4.726   0.150   2.621
  967   HG21  ILE  59          HG21      ILE  59   7.646  -2.184   2.195
  968   HG22  ILE  59          HG22      ILE  59   7.704  -2.713   3.875
  969   HG23  ILE  59          HG23      ILE  59   8.210  -1.079   3.451
  970   HD11  ILE  59          HD11      ILE  59   6.335   1.420   3.937
  971   HD12  ILE  59          HD12      ILE  59   6.316   1.932   2.249
  972   HD13  ILE  59          HD13      ILE  59   7.629   0.918   2.845
  973    H    ASP  60           H        ASP  60   4.620  -2.887   5.623
  974    HA   ASP  60           HA       ASP  60   6.136  -5.145   6.278
  975    HB2  ASP  60           HB2      ASP  60   5.221  -3.644   7.975
  976    HB3  ASP  60           HB3      ASP  60   3.573  -4.032   7.499
  977    H    TYR  61           H        TYR  61   2.697  -4.914   5.423
  978    HA   TYR  61           HA       TYR  61   1.881  -7.577   5.538
  979    HB2  TYR  61           HB2      TYR  61   0.251  -5.816   5.370
  980    HB3  TYR  61           HB3      TYR  61   0.959  -5.194   3.890
  981    HD1  TYR  61           HD1      TYR  61  -0.786  -8.262   5.203
  982    HD2  TYR  61           HD2      TYR  61  -0.079  -5.725   1.827
  983    HE1  TYR  61           HE1      TYR  61  -2.472  -9.495   3.912
  984    HE2  TYR  61           HE2      TYR  61  -1.779  -6.962   0.551
  985    HH   TYR  61           HH       TYR  61  -3.969  -9.083   1.996
  986    H    ILE  62           H        ILE  62   3.201  -5.777   2.752
  987    HA   ILE  62           HA       ILE  62   2.925  -7.929   0.881
  988    HB   ILE  62           HB       ILE  62   4.567  -5.364   0.649
  989   HG12  ILE  62          HG12      ILE  62   1.779  -6.002  -0.467
  990   HG13  ILE  62          HG13      ILE  62   2.090  -4.984   0.935
  991   HG21  ILE  62          HG21      ILE  62   3.748  -7.346  -1.512
  992   HG22  ILE  62          HG22      ILE  62   5.389  -7.047  -0.933
  993   HG23  ILE  62          HG23      ILE  62   4.522  -5.786  -1.801
  994   HD11  ILE  62          HD11      ILE  62   1.610  -3.655  -1.030
  995   HD12  ILE  62          HD12      ILE  62   2.949  -4.401  -1.901
  996   HD13  ILE  62          HD13      ILE  62   3.268  -3.378  -0.497
  997    H    LEU  63           H        LEU  63   5.698  -6.698   2.811
  998    HA   LEU  63           HA       LEU  63   7.698  -8.478   1.863
  999    HB2  LEU  63           HB2      LEU  63   7.363  -7.077   4.543
 1000    HB3  LEU  63           HB3      LEU  63   8.789  -8.020   4.140
 1001    HG   LEU  63           HG       LEU  63   7.883  -5.529   2.639
 1002   HD11  LEU  63          HD11      LEU  63  10.138  -5.842   4.650
 1003   HD12  LEU  63          HD12      LEU  63   8.631  -4.959   4.905
 1004   HD13  LEU  63          HD13      LEU  63   9.788  -4.390   3.704
 1005   HD21  LEU  63          HD21      LEU  63  10.427  -7.169   2.357
 1006   HD22  LEU  63          HD22      LEU  63  10.080  -5.650   1.525
 1007   HD23  LEU  63          HD23      LEU  63   9.107  -7.078   1.186
 1008    H    ASP  64           H        ASP  64   5.193  -8.831   4.307
 1009    HA   ASP  64           HA       ASP  64   6.032 -11.321   5.424
 1010    HB2  ASP  64           HB2      ASP  64   4.477  -9.662   6.518
 1011    HB3  ASP  64           HB3      ASP  64   3.229 -10.106   5.362
 1012    H    LEU  65           H        LEU  65   4.029 -10.449   2.650
 1013    HA   LEU  65           HA       LEU  65   3.142 -13.139   2.031
 1014    HB2  LEU  65           HB2      LEU  65   3.126 -10.623   0.315
 1015    HB3  LEU  65           HB3      LEU  65   2.306 -12.129  -0.084
 1016    HG   LEU  65           HG       LEU  65   1.649 -10.318   2.271
 1017   HD11  LEU  65          HD11      LEU  65   0.946  -9.343   0.150
 1018   HD12  LEU  65          HD12      LEU  65  -0.449  -9.850   1.095
 1019   HD13  LEU  65          HD13      LEU  65   0.086 -10.828  -0.272
 1020   HD21  LEU  65          HD21      LEU  65   1.245 -12.651   2.877
 1021   HD22  LEU  65          HD22      LEU  65   0.285 -12.893   1.414
 1022   HD23  LEU  65          HD23      LEU  65  -0.282 -11.794   2.676
 1023    H    GLN  66           H        GLN  66   5.608 -10.943   0.785
 1024    HA   GLN  66           HA       GLN  66   6.685 -12.821  -1.174
 1025    HB2  GLN  66           HB2      GLN  66   7.554 -10.005  -0.346
 1026    HB3  GLN  66           HB3      GLN  66   8.360 -10.954  -1.591
 1027    HG2  GLN  66           HG2      GLN  66   6.187 -10.982  -2.873
 1028    HG3  GLN  66           HG3      GLN  66   5.536  -9.861  -1.674
 1029   HE21  GLN  66          HE21      GLN  66   5.269  -8.197  -3.241
 1030   HE22  GLN  66          HE22      GLN  66   6.597  -7.348  -3.929
 1031    H    VAL  67           H        VAL  67   9.403 -12.513  -1.075
 1032    HA   VAL  67           HA       VAL  67  10.407 -13.845   1.217
 1033    HB   VAL  67           HB       VAL  67  11.949 -12.132  -0.794
 1034   HG11  VAL  67          HG11      VAL  67  12.992 -14.262   1.118
 1035   HG12  VAL  67          HG12      VAL  67  13.274 -12.524   1.240
 1036   HG13  VAL  67          HG13      VAL  67  13.946 -13.430  -0.115
 1037   HG21  VAL  67          HG21      VAL  67  11.404 -15.132  -0.826
 1038   HG22  VAL  67          HG22      VAL  67  12.432 -14.265  -1.968
 1039   HG23  VAL  67          HG23      VAL  67  10.703 -13.933  -1.916
 1040    H    VAL  68           H        VAL  68  10.986 -13.073   3.178
 1041    HA   VAL  68           HA       VAL  68  10.243 -10.498   4.033
 1042    HB   VAL  68           HB       VAL  68  11.308 -11.110   6.247
 1043   HG11  VAL  68          HG11      VAL  68   9.682 -12.897   6.772
 1044   HG12  VAL  68          HG12      VAL  68   9.405 -13.159   5.049
 1045   HG13  VAL  68          HG13      VAL  68   8.960 -11.620   5.790
 1046   HG21  VAL  68          HG21      VAL  68  12.004 -13.726   4.835
 1047   HG22  VAL  68          HG22      VAL  68  12.122 -13.434   6.574
 1048   HG23  VAL  68          HG23      VAL  68  13.152 -12.537   5.459
  Start of MODEL   15
    1    H1   MET   1           H1       MET   1 -41.536  29.192  -3.534
    2    H2   MET   1           H2       MET   1 -42.298  28.191  -4.662
    3    H3   MET   1           H3       MET   1 -41.486  27.514  -3.348
    4    HA   MET   1           HA       MET   1 -43.875  29.237  -3.182
    5    HB2  MET   1           HB2      MET   1 -45.097  27.154  -2.546
    6    HB3  MET   1           HB3      MET   1 -44.475  27.104  -4.185
    7    HG2  MET   1           HG2      MET   1 -42.541  25.733  -3.307
    8    HG3  MET   1           HG3      MET   1 -43.402  25.633  -1.771
    9    HE1  MET   1           HE1      MET   1 -46.721  23.765  -2.976
   10    HE2  MET   1           HE2      MET   1 -46.484  25.512  -2.989
   11    HE3  MET   1           HE3      MET   1 -45.937  24.557  -1.611
   12    H    GLY   2           H        GLY   2 -44.233  30.112  -1.212
   13    HA2  GLY   2           HA2      GLY   2 -44.152  30.499   1.064
   14    HA3  GLY   2           HA3      GLY   2 -43.327  28.967   1.282
   15    H    HIS   3           H        HIS   3 -41.008  28.896   1.034
   16    HA   HIS   3           HA       HIS   3 -39.673  31.392   1.808
   17    HB2  HIS   3           HB2      HIS   3 -39.344  29.327   3.168
   18    HB3  HIS   3           HB3      HIS   3 -38.608  28.531   1.783
   19    HD2  HIS   3           HD2      HIS   3 -37.592  32.179   2.911
   20    HE1  HIS   3           HE1      HIS   3 -34.370  29.530   3.596
   21    HE2  HIS   3           HE2      HIS   3 -35.172  31.916   3.797
   22    H    HIS   4           H        HIS   4 -39.036  32.629   0.119
   23    HA   HIS   4           HA       HIS   4 -38.076  31.534  -2.401
   24    HB2  HIS   4           HB2      HIS   4 -39.494  33.589  -2.307
   25    HB3  HIS   4           HB3      HIS   4 -38.201  34.436  -1.467
   26    HD2  HIS   4           HD2      HIS   4 -37.589  36.248  -3.449
   27    HE1  HIS   4           HE1      HIS   4 -36.790  33.401  -6.474
   28    HE2  HIS   4           HE2      HIS   4 -36.957  35.862  -5.928
   29    H    HIS   5           H        HIS   5 -35.992  32.039  -3.331
   30    HA   HIS   5           HA       HIS   5 -33.783  32.289  -1.352
   31    HB2  HIS   5           HB2      HIS   5 -33.896  30.336  -3.700
   32    HB3  HIS   5           HB3      HIS   5 -32.566  30.503  -2.555
   33    HD2  HIS   5           HD2      HIS   5 -35.878  28.617  -2.926
   34    HE1  HIS   5           HE1      HIS   5 -34.601  28.152   1.072
   35    HE2  HIS   5           HE2      HIS   5 -36.421  27.632  -0.595
   36    H    HIS   6           H        HIS   6 -31.644  32.737  -2.401
   37    HA   HIS   6           HA       HIS   6 -31.676  34.153  -4.967
   38    HB2  HIS   6           HB2      HIS   6 -32.147  35.913  -3.256
   39    HB3  HIS   6           HB3      HIS   6 -30.692  35.451  -2.377
   40    HD2  HIS   6           HD2      HIS   6 -31.668  37.207  -5.766
   41    HE1  HIS   6           HE1      HIS   6 -27.638  38.084  -4.836
   42    HE2  HIS   6           HE2      HIS   6 -29.625  38.716  -6.263
   43    H    HIS   7           H        HIS   7 -29.905  33.619  -6.115
   44    HA   HIS   7           HA       HIS   7 -27.287  33.191  -4.984
   45    HB2  HIS   7           HB2      HIS   7 -28.428  30.975  -4.541
   46    HB3  HIS   7           HB3      HIS   7 -28.670  30.789  -6.274
   47    HD2  HIS   7           HD2      HIS   7 -26.752  29.214  -7.333
   48    HE1  HIS   7           HE1      HIS   7 -23.675  30.141  -4.583
   49    HE2  HIS   7           HE2      HIS   7 -24.252  28.951  -6.736
   50    H    HIS   8           H        HIS   8 -25.846  33.878  -6.468
   51    HA   HIS   8           HA       HIS   8 -26.735  34.359  -9.253
   52    HB2  HIS   8           HB2      HIS   8 -24.975  36.106  -9.295
   53    HB3  HIS   8           HB3      HIS   8 -26.099  36.362  -7.971
   54    HD2  HIS   8           HD2      HIS   8 -22.399  36.332  -8.520
   55    HE1  HIS   8           HE1      HIS   8 -22.950  35.392  -4.433
   56    HE2  HIS   8           HE2      HIS   8 -21.253  35.857  -6.247
   57    H    SER   9           H        SER   9 -24.112  32.870  -7.376
   58    HA   SER   9           HA       SER   9 -22.324  32.385  -9.556
   59    HB2  SER   9           HB2      SER   9 -22.449  31.047  -6.818
   60    HB3  SER   9           HB3      SER   9 -21.094  30.948  -7.947
   61    HG   SER   9           HG       SER   9 -20.426  32.691  -6.990
   62    H    HIS  10           H        HIS  10 -23.161  31.234 -11.239
   63    HA   HIS  10           HA       HIS  10 -24.492  28.623 -10.728
   64    HB2  HIS  10           HB2      HIS  10 -25.562  28.905 -12.930
   65    HB3  HIS  10           HB3      HIS  10 -25.887  30.289 -11.893
   66    HD1  HIS  10           HD1      HIS  10 -24.181  29.302 -15.030
   67    HD2  HIS  10           HD2      HIS  10 -24.685  32.729 -12.745
   68    HE1  HIS  10           HE1      HIS  10 -23.359  31.176 -16.456
   69    HE2  HIS  10           HE2      HIS  10 -23.916  33.245 -15.154
   70    H    MET  11           H        MET  11 -21.473  29.401 -11.150
   71    HA   MET  11           HA       MET  11 -20.809  27.175 -12.963
   72    HB2  MET  11           HB2      MET  11 -19.066  28.542 -14.114
   73    HB3  MET  11           HB3      MET  11 -20.693  29.127 -14.421
   74    HG2  MET  11           HG2      MET  11 -20.357  30.963 -12.825
   75    HG3  MET  11           HG3      MET  11 -18.745  30.355 -12.450
   76    HE1  MET  11           HE1      MET  11 -21.024  31.987 -15.271
   77    HE2  MET  11           HE2      MET  11 -20.454  30.508 -16.047
   78    HE3  MET  11           HE3      MET  11 -19.877  32.077 -16.607
   79    H    GLY  12           H        GLY  12 -18.957  26.060 -12.426
   80    HA2  GLY  12           HA2      GLY  12 -17.877  26.461  -9.745
   81    HA3  GLY  12           HA3      GLY  12 -17.630  25.076 -10.795
   82    H    GLY  13           H        GLY  13 -16.999  28.374 -11.862
   83    HA2  GLY  13           HA2      GLY  13 -14.165  27.866 -12.289
   84    HA3  GLY  13           HA3      GLY  13 -15.051  29.322 -12.708
   85    H    GLY  14           H        GLY  14 -16.153  29.478  -9.930
   86    HA2  GLY  14           HA2      GLY  14 -14.140  31.152  -8.737
   87    HA3  GLY  14           HA3      GLY  14 -15.731  30.787  -8.088
   88    H    LYS  15           H        LYS  15 -12.676  30.632  -7.208
   89    HA   LYS  15           HA       LYS  15 -12.915  28.333  -5.451
   90    HB2  LYS  15           HB2      LYS  15 -10.739  27.320  -6.280
   91    HB3  LYS  15           HB3      LYS  15 -12.098  27.157  -7.385
   92    HG2  LYS  15           HG2      LYS  15 -11.240  28.978  -8.779
   93    HG3  LYS  15           HG3      LYS  15  -9.917  29.258  -7.640
   94    HD2  LYS  15           HD2      LYS  15  -8.863  27.175  -8.190
   95    HD3  LYS  15           HD3      LYS  15 -10.298  26.586  -9.036
   96    HE2  LYS  15           HE2      LYS  15  -8.559  28.904  -9.950
   97    HE3  LYS  15           HE3      LYS  15  -8.510  27.266 -10.609
   98    HZ1  LYS  15           HZ1      LYS  15 -10.861  29.089 -10.679
   99    HZ2  LYS  15           HZ2      LYS  15 -10.820  27.518 -11.300
  100    HZ3  LYS  15           HZ3      LYS  15  -9.850  28.723 -11.983
  101    H    GLY  16           H        GLY  16 -10.659  28.016  -4.284
  102    HA2  GLY  16           HA2      GLY  16  -8.924  30.285  -3.971
  103    HA3  GLY  16           HA3      GLY  16 -10.065  30.146  -2.635
  104    HA   PRO  17           HA       PRO  17  -6.395  27.052  -2.151
  105    HB2  PRO  17           HB2      PRO  17  -4.547  28.463  -0.727
  106    HB3  PRO  17           HB3      PRO  17  -4.592  28.476  -2.495
  107    HG2  PRO  17           HG2      PRO  17  -5.639  30.533  -0.555
  108    HG3  PRO  17           HG3      PRO  17  -4.751  30.775  -2.074
  109    HD2  PRO  17           HD2      PRO  17  -7.494  31.012  -1.847
  110    HD3  PRO  17           HD3      PRO  17  -6.671  30.583  -3.361
  111    H    ALA  18           H        ALA  18  -8.051  26.091  -0.867
  112    HA   ALA  18           HA       ALA  18  -8.200  26.800   2.009
  113    HB1  ALA  18           HB1      ALA  18 -10.245  25.421   2.058
  114    HB2  ALA  18           HB2      ALA  18 -10.008  24.983   0.364
  115    HB3  ALA  18           HB3      ALA  18 -10.354  26.656   0.799
  116    H    ALA  19           H        ALA  19  -6.811  25.727   3.264
  117    HA   ALA  19           HA       ALA  19  -5.587  24.163   4.307
  118    HB1  ALA  19           HB1      ALA  19  -7.155  22.057   2.786
  119    HB2  ALA  19           HB2      ALA  19  -7.621  22.772   4.329
  120    HB3  ALA  19           HB3      ALA  19  -6.160  21.789   4.223
  121    H    GLU  20           H        GLU  20  -3.692  22.887   4.122
  122    HA   GLU  20           HA       GLU  20  -2.595  22.145   1.547
  123    HB2  GLU  20           HB2      GLU  20  -0.653  23.692   1.628
  124    HB3  GLU  20           HB3      GLU  20  -2.177  24.557   1.465
  125    HG2  GLU  20           HG2      GLU  20  -2.111  25.020   3.940
  126    HG3  GLU  20           HG3      GLU  20  -0.510  24.285   3.995
  127    H    GLU  21           H        GLU  21  -0.062  21.680   1.931
  128    HA   GLU  21           HA       GLU  21   0.009  19.623   3.991
  129    HB2  GLU  21           HB2      GLU  21   1.996  20.366   1.804
  130    HB3  GLU  21           HB3      GLU  21   2.233  19.028   2.918
  131    HG2  GLU  21           HG2      GLU  21   1.453  18.198   0.781
  132    HG3  GLU  21           HG3      GLU  21   0.229  17.910   2.013
  133    HA   PRO  22           HA       PRO  22   2.690  22.000   6.810
  134    HB2  PRO  22           HB2      PRO  22   3.608  20.025   8.408
  135    HB3  PRO  22           HB3      PRO  22   1.894  20.466   8.401
  136    HG2  PRO  22           HG2      PRO  22   3.267  18.182   6.978
  137    HG3  PRO  22           HG3      PRO  22   1.774  18.154   7.943
  138    HD2  PRO  22           HD2      PRO  22   1.794  18.303   5.196
  139    HD3  PRO  22           HD3      PRO  22   0.485  18.976   6.188
  140    H    LEU  23           H        LEU  23   5.142  21.480   7.830
  141    HA   LEU  23           HA       LEU  23   6.954  21.656   5.625
  142    HB2  LEU  23           HB2      LEU  23   7.599  21.182   8.564
  143    HB3  LEU  23           HB3      LEU  23   8.753  21.667   7.330
  144    HG   LEU  23           HG       LEU  23   6.448  23.343   8.406
  145   HD11  LEU  23          HD11      LEU  23   8.206  24.830   9.267
  146   HD12  LEU  23          HD12      LEU  23   9.447  23.731   8.663
  147   HD13  LEU  23          HD13      LEU  23   8.354  23.209   9.946
  148   HD21  LEU  23          HD21      LEU  23   7.279  25.166   6.963
  149   HD22  LEU  23          HD22      LEU  23   6.700  23.800   6.016
  150   HD23  LEU  23          HD23      LEU  23   8.435  24.055   6.218
  151    H    SER  24           H        SER  24   6.067  19.066   7.845
  152    HA   SER  24           HA       SER  24   6.414  16.851   7.984
  153    HB2  SER  24           HB2      SER  24   7.278  16.966   5.056
  154    HB3  SER  24           HB3      SER  24   6.799  15.519   5.945
  155    HG   SER  24           HG       SER  24   5.252  17.449   4.776
  156    H    LEU  25           H        LEU  25   7.994  16.545   9.445
  157    HA   LEU  25           HA       LEU  25  10.601  17.497   9.422
  158    HB2  LEU  25           HB2      LEU  25   9.223  16.684  11.391
  159    HB3  LEU  25           HB3      LEU  25   9.618  15.040  10.940
  160    HG   LEU  25           HG       LEU  25  11.776  17.066  11.682
  161   HD11  LEU  25          HD11      LEU  25  10.216  16.941  13.567
  162   HD12  LEU  25          HD12      LEU  25  11.754  16.193  13.976
  163   HD13  LEU  25          HD13      LEU  25  10.357  15.181  13.597
  164   HD21  LEU  25          HD21      LEU  25  12.637  15.061  10.559
  165   HD22  LEU  25          HD22      LEU  25  11.810  14.021  11.716
  166   HD23  LEU  25          HD23      LEU  25  13.131  15.067  12.250
  167    H    LEU  26           H        LEU  26   9.739  14.038   9.066
  168    HA   LEU  26           HA       LEU  26  12.236  13.556   7.528
  169    HB2  LEU  26           HB2      LEU  26  11.613  12.348   9.796
  170    HB3  LEU  26           HB3      LEU  26  10.542  11.381   8.810
  171    HG   LEU  26           HG       LEU  26  13.537  11.573   8.288
  172   HD11  LEU  26          HD11      LEU  26  13.795   9.429   9.479
  173   HD12  LEU  26          HD12      LEU  26  12.095   9.492   9.961
  174   HD13  LEU  26          HD13      LEU  26  13.226  10.712  10.545
  175   HD21  LEU  26          HD21      LEU  26  13.246   9.460   7.066
  176   HD22  LEU  26          HD22      LEU  26  12.259  10.742   6.371
  177   HD23  LEU  26          HD23      LEU  26  11.507   9.504   7.379
  178    H    ASP  27           H        ASP  27  12.107  12.668   5.481
  179    HA   ASP  27           HA       ASP  27   9.648  12.904   3.996
  180    HB2  ASP  27           HB2      ASP  27  12.444  11.949   3.222
  181    HB3  ASP  27           HB3      ASP  27  11.128  12.163   2.069
  182    H    ASP  28           H        ASP  28   9.560  10.736   6.029
  183    HA   ASP  28           HA       ASP  28  10.193   8.192   5.115
  184    HB2  ASP  28           HB2      ASP  28   9.569   8.891   7.488
  185    HB3  ASP  28           HB3      ASP  28   7.877   8.819   6.998
  186    H    MET  29           H        MET  29   7.162   9.998   4.751
  187    HA   MET  29           HA       MET  29   5.579   8.107   3.440
  188    HB2  MET  29           HB2      MET  29   4.521  10.084   4.250
  189    HB3  MET  29           HB3      MET  29   5.626  11.141   3.386
  190    HG2  MET  29           HG2      MET  29   4.546  10.754   1.315
  191    HG3  MET  29           HG3      MET  29   3.692   9.340   1.926
  192    HE1  MET  29           HE1      MET  29   2.313   9.995   4.508
  193    HE2  MET  29           HE2      MET  29   1.394   9.404   3.122
  194    HE3  MET  29           HE3      MET  29   0.825  10.808   4.026
  195    H    ASN  30           H        ASN  30   7.898  10.449   2.053
  196    HA   ASN  30           HA       ASN  30   7.412   9.911  -0.700
  197    HB2  ASN  30           HB2      ASN  30   9.944  11.016   0.602
  198    HB3  ASN  30           HB3      ASN  30   9.539  11.130  -1.113
  199   HD21  ASN  30          HD21      ASN  30  10.019  13.290   0.792
  200   HD22  ASN  30          HD22      ASN  30   8.589  14.255   0.790
  201    H    HIS  31           H        HIS  31   9.887   8.650   1.557
  202    HA   HIS  31           HA       HIS  31  11.189   6.858  -0.207
  203    HB2  HIS  31           HB2      HIS  31  10.921   6.768   2.826
  204    HB3  HIS  31           HB3      HIS  31  11.973   5.697   1.903
  205    HD2  HIS  31           HD2      HIS  31  11.935   9.259   3.347
  206    HE1  HIS  31           HE1      HIS  31  15.533   8.736   1.209
  207    HE2  HIS  31           HE2      HIS  31  14.339  10.104   2.954
  208    H    CYS  32           H        CYS  32   8.404   6.434   1.953
  209    HA   CYS  32           HA       CYS  32   8.000   3.665   1.657
  210    HB2  CYS  32           HB2      CYS  32   6.067   5.876   2.422
  211    HB3  CYS  32           HB3      CYS  32   5.593   4.179   2.379
  212    HG   CYS  32           HG       CYS  32   6.972   5.809   4.824
  213    H    TYR  33           H        TYR  33   6.688   6.398  -0.195
  214    HA   TYR  33           HA       TYR  33   4.966   4.866  -1.861
  215    HB2  TYR  33           HB2      TYR  33   5.912   7.713  -1.825
  216    HB3  TYR  33           HB3      TYR  33   5.207   7.122  -3.327
  217    HD1  TYR  33           HD1      TYR  33   2.997   5.662  -2.923
  218    HD2  TYR  33           HD2      TYR  33   4.344   8.759  -0.324
  219    HE1  TYR  33           HE1      TYR  33   0.730   5.924  -2.099
  220    HE2  TYR  33           HE2      TYR  33   2.050   9.029   0.522
  221    HH   TYR  33           HH       TYR  33  -0.173   8.536   0.025
  222    H    SER  34           H        SER  34   8.293   5.994  -2.305
  223    HA   SER  34           HA       SER  34   8.745   4.978  -4.916
  224    HB2  SER  34           HB2      SER  34  10.728   5.227  -2.607
  225    HB3  SER  34           HB3      SER  34  11.146   5.071  -4.316
  226    HG   SER  34           HG       SER  34  10.258   7.266  -2.893
  227    H    ARG  35           H        ARG  35   8.999   3.553  -1.714
  228    HA   ARG  35           HA       ARG  35  10.141   1.045  -2.417
  229    HB2  ARG  35           HB2      ARG  35   9.912   2.474  -0.122
  230    HB3  ARG  35           HB3      ARG  35   8.569   1.379   0.134
  231    HG2  ARG  35           HG2      ARG  35  11.355   0.405  -0.496
  232    HG3  ARG  35           HG3      ARG  35  10.854   0.800   1.145
  233    HD2  ARG  35           HD2      ARG  35   8.868  -0.906   0.543
  234    HD3  ARG  35           HD3      ARG  35  10.087  -1.531  -0.581
  235    HE   ARG  35           HE       ARG  35  10.570  -1.201   2.324
  236   HH11  ARG  35          HH11      ARG  35  10.826  -3.209  -0.478
  237   HH12  ARG  35          HH12      ARG  35  11.751  -4.397   0.368
  238   HH21  ARG  35          HH21      ARG  35  11.721  -2.714   3.337
  239   HH22  ARG  35          HH22      ARG  35  12.245  -4.124   2.488
  240    H    LEU  36           H        LEU  36   6.813   2.188  -2.032
  241    HA   LEU  36           HA       LEU  36   5.436  -0.270  -2.262
  242    HB2  LEU  36           HB2      LEU  36   4.612   2.545  -3.087
  243    HB3  LEU  36           HB3      LEU  36   3.530   1.166  -3.195
  244    HG   LEU  36           HG       LEU  36   4.713   2.296  -0.634
  245   HD11  LEU  36          HD11      LEU  36   2.426   2.970  -0.074
  246   HD12  LEU  36          HD12      LEU  36   1.866   2.402  -1.649
  247   HD13  LEU  36          HD13      LEU  36   2.994   3.755  -1.547
  248   HD21  LEU  36          HD21      LEU  36   4.456  -0.132  -0.428
  249   HD22  LEU  36          HD22      LEU  36   2.778  -0.022  -0.970
  250   HD23  LEU  36          HD23      LEU  36   3.265   0.704   0.564
  251    H    ARG  37           H        ARG  37   6.418   2.127  -4.734
  252    HA   ARG  37           HA       ARG  37   5.596   0.692  -7.013
  253    HB2  ARG  37           HB2      ARG  37   7.718   2.832  -6.686
  254    HB3  ARG  37           HB3      ARG  37   7.255   2.164  -8.252
  255    HG2  ARG  37           HG2      ARG  37   4.881   2.885  -7.773
  256    HG3  ARG  37           HG3      ARG  37   5.475   3.685  -6.317
  257    HD2  ARG  37           HD2      ARG  37   6.357   4.335  -9.150
  258    HD3  ARG  37           HD3      ARG  37   5.151   5.234  -8.227
  259    HE   ARG  37           HE       ARG  37   7.863   4.967  -7.126
  260   HH11  ARG  37          HH11      ARG  37   5.458   7.080  -8.485
  261   HH12  ARG  37          HH12      ARG  37   6.356   8.501  -8.091
  262   HH21  ARG  37          HH21      ARG  37   8.961   6.794  -6.655
  263   HH22  ARG  37          HH22      ARG  37   8.305   8.339  -7.063
  264    H    GLU  38           H        GLU  38   8.286   0.074  -4.920
  265    HA   GLU  38           HA       GLU  38   9.838  -1.423  -6.897
  266    HB2  GLU  38           HB2      GLU  38  10.188  -1.241  -3.871
  267    HB3  GLU  38           HB3      GLU  38  11.298  -2.059  -4.969
  268    HG2  GLU  38           HG2      GLU  38  11.746   0.144  -6.064
  269    HG3  GLU  38           HG3      GLU  38  10.731   0.919  -4.851
  270    H    LEU  39           H        LEU  39   7.641  -2.053  -4.178
  271    HA   LEU  39           HA       LEU  39   7.955  -4.929  -4.230
  272    HB2  LEU  39           HB2      LEU  39   5.990  -3.180  -2.711
  273    HB3  LEU  39           HB3      LEU  39   6.181  -4.911  -2.472
  274    HG   LEU  39           HG       LEU  39   8.298  -2.795  -1.900
  275   HD11  LEU  39          HD11      LEU  39   6.672  -4.475   0.032
  276   HD12  LEU  39          HD12      LEU  39   6.490  -2.744  -0.256
  277   HD13  LEU  39          HD13      LEU  39   7.974  -3.361   0.466
  278   HD21  LEU  39          HD21      LEU  39   8.441  -5.803  -1.486
  279   HD22  LEU  39          HD22      LEU  39   9.633  -4.630  -0.921
  280   HD23  LEU  39          HD23      LEU  39   9.377  -4.856  -2.648
  281    H    VAL  40           H        VAL  40   5.810  -2.661  -5.748
  282    HA   VAL  40           HA       VAL  40   3.807  -4.676  -6.490
  283    HB   VAL  40           HB       VAL  40   3.875  -1.688  -7.135
  284   HG11  VAL  40          HG11      VAL  40   1.618  -3.707  -7.480
  285   HG12  VAL  40          HG12      VAL  40   2.515  -2.906  -8.770
  286   HG13  VAL  40          HG13      VAL  40   1.465  -1.963  -7.713
  287   HG21  VAL  40          HG21      VAL  40   2.352  -3.164  -4.943
  288   HG22  VAL  40          HG22      VAL  40   2.158  -1.454  -5.343
  289   HG23  VAL  40          HG23      VAL  40   3.704  -2.044  -4.720
  290    HA   PRO  41           HA       PRO  41   5.935  -4.978 -10.575
  291    HB2  PRO  41           HB2      PRO  41   5.132  -7.477 -11.217
  292    HB3  PRO  41           HB3      PRO  41   6.417  -7.201 -10.031
  293    HG2  PRO  41           HG2      PRO  41   3.513  -7.849  -9.561
  294    HG3  PRO  41           HG3      PRO  41   4.952  -8.492  -8.741
  295    HD2  PRO  41           HD2      PRO  41   3.366  -6.441  -7.742
  296    HD3  PRO  41           HD3      PRO  41   5.061  -6.699  -7.286
  297    H    GLY  42           H        GLY  42   4.320  -3.194 -10.937
  298    HA2  GLY  42           HA2      GLY  42   2.688  -3.766 -13.205
  299    HA3  GLY  42           HA3      GLY  42   1.677  -3.513 -11.789
  300    H    VAL  43           H        VAL  43   4.536  -1.681 -11.679
  301    HA   VAL  43           HA       VAL  43   3.144   0.796 -12.437
  302    HB   VAL  43           HB       VAL  43   5.861   0.431 -11.076
  303   HG11  VAL  43          HG11      VAL  43   4.192   2.961 -11.410
  304   HG12  VAL  43          HG12      VAL  43   5.675   2.584 -12.284
  305   HG13  VAL  43          HG13      VAL  43   5.723   2.834 -10.537
  306   HG21  VAL  43          HG21      VAL  43   4.049  -0.410  -9.635
  307   HG22  VAL  43          HG22      VAL  43   3.157   1.101  -9.822
  308   HG23  VAL  43          HG23      VAL  43   4.705   1.088  -8.974
  309    HA   PRO  44           HA       PRO  44   5.171   0.340 -16.538
  310    HB2  PRO  44           HB2      PRO  44   4.294   3.213 -16.754
  311    HB3  PRO  44           HB3      PRO  44   4.073   1.881 -17.897
  312    HG2  PRO  44           HG2      PRO  44   2.026   2.706 -16.398
  313    HG3  PRO  44           HG3      PRO  44   2.274   0.969 -16.685
  314    HD2  PRO  44           HD2      PRO  44   2.907   2.598 -14.230
  315    HD3  PRO  44           HD3      PRO  44   2.243   0.953 -14.350
  316    H    ARG  45           H        ARG  45   7.041   1.133 -17.650
  317    HA   ARG  45           HA       ARG  45   9.131   2.067 -15.908
  318    HB2  ARG  45           HB2      ARG  45   9.206   1.488 -18.896
  319    HB3  ARG  45           HB3      ARG  45  10.621   1.790 -17.894
  320    HG2  ARG  45           HG2      ARG  45   8.731  -0.579 -17.711
  321    HG3  ARG  45           HG3      ARG  45  10.399  -0.586 -18.296
  322    HD2  ARG  45           HD2      ARG  45   9.480  -0.050 -15.449
  323    HD3  ARG  45           HD3      ARG  45  10.307  -1.495 -16.036
  324    HE   ARG  45           HE       ARG  45  12.043   0.502 -16.638
  325   HH11  ARG  45          HH11      ARG  45  10.496  -0.382 -13.665
  326   HH12  ARG  45          HH12      ARG  45  11.811   0.191 -12.702
  327   HH21  ARG  45          HH21      ARG  45  13.684   1.225 -15.379
  328   HH22  ARG  45          HH22      ARG  45  13.591   1.082 -13.658
  329    H    GLY  46           H        GLY  46   9.184   4.167 -15.348
  330    HA2  GLY  46           HA2      GLY  46   9.640   6.417 -15.534
  331    HA3  GLY  46           HA3      GLY  46   9.753   6.229 -17.278
  332    H    THR  47           H        THR  47   7.018   5.455 -15.168
  333    HA   THR  47           HA       THR  47   5.191   7.032 -16.813
  334    HB   THR  47           HB       THR  47   4.427   4.832 -16.106
  335    HG1  THR  47           HG1      THR  47   2.428   5.486 -15.650
  336   HG21  THR  47          HG21      THR  47   3.993   4.248 -13.771
  337   HG22  THR  47          HG22      THR  47   4.671   5.788 -13.238
  338   HG23  THR  47          HG23      THR  47   5.706   4.589 -14.020
  339    H    GLN  48           H        GLN  48   6.717   7.294 -13.661
  340    HA   GLN  48           HA       GLN  48   6.609   8.709 -11.910
  341    HB2  GLN  48           HB2      GLN  48   5.736  10.704 -14.048
  342    HB3  GLN  48           HB3      GLN  48   6.200  11.154 -12.410
  343    HG2  GLN  48           HG2      GLN  48   8.478  10.257 -12.819
  344    HG3  GLN  48           HG3      GLN  48   8.004   9.839 -14.467
  345   HE21  GLN  48          HE21      GLN  48   9.613  11.224 -15.351
  346   HE22  GLN  48          HE22      GLN  48   9.459  12.942 -15.316
  347    H    LEU  49           H        LEU  49   4.412   7.049 -11.949
  348    HA   LEU  49           HA       LEU  49   1.883   8.211 -11.683
  349    HB2  LEU  49           HB2      LEU  49   3.092   5.839 -10.209
  350    HB3  LEU  49           HB3      LEU  49   1.409   6.307 -10.021
  351    HG   LEU  49           HG       LEU  49   2.701   5.397 -12.612
  352   HD11  LEU  49          HD11      LEU  49   1.348   3.368 -12.390
  353   HD12  LEU  49          HD12      LEU  49   0.756   3.924 -10.823
  354   HD13  LEU  49          HD13      LEU  49   2.468   3.549 -11.041
  355   HD21  LEU  49          HD21      LEU  49   0.440   5.396 -13.572
  356   HD22  LEU  49          HD22      LEU  49   0.920   7.012 -13.069
  357   HD23  LEU  49          HD23      LEU  49  -0.203   6.081 -12.077
  358    H    SER  50           H        SER  50   1.078   9.692 -10.293
  359    HA   SER  50           HA       SER  50   2.703  10.752  -8.161
  360    HB2  SER  50           HB2      SER  50   1.289  12.208  -9.626
  361    HB3  SER  50           HB3      SER  50  -0.157  11.490  -8.924
  362    HG   SER  50           HG       SER  50   0.014  13.007  -7.480
  363    H    GLN  51           H        GLN  51   1.198  11.410  -6.110
  364    HA   GLN  51           HA       GLN  51   1.708   9.337  -4.411
  365    HB2  GLN  51           HB2      GLN  51   1.406  11.865  -4.001
  366    HB3  GLN  51           HB3      GLN  51  -0.308  11.527  -3.802
  367    HG2  GLN  51           HG2      GLN  51   0.209  10.046  -1.908
  368    HG3  GLN  51           HG3      GLN  51   1.929  10.349  -2.138
  369   HE21  GLN  51          HE21      GLN  51   2.168  11.184  -0.053
  370   HE22  GLN  51          HE22      GLN  51   1.552  12.724   0.411
  371    H    VAL  52           H        VAL  52  -1.556  10.209  -5.654
  372    HA   VAL  52           HA       VAL  52  -2.962   8.181  -4.174
  373    HB   VAL  52           HB       VAL  52  -3.965   9.605  -6.685
  374   HG11  VAL  52          HG11      VAL  52  -5.341   7.667  -6.016
  375   HG12  VAL  52          HG12      VAL  52  -6.223   9.169  -5.740
  376   HG13  VAL  52          HG13      VAL  52  -5.489   8.314  -4.380
  377   HG21  VAL  52          HG21      VAL  52  -3.221  11.285  -5.059
  378   HG22  VAL  52          HG22      VAL  52  -4.171  10.514  -3.791
  379   HG23  VAL  52          HG23      VAL  52  -4.985  11.276  -5.159
  380    H    GLU  53           H        GLU  53  -1.755   8.395  -7.534
  381    HA   GLU  53           HA       GLU  53  -2.992   6.067  -8.563
  382    HB2  GLU  53           HB2      GLU  53  -0.472   7.459  -9.554
  383    HB3  GLU  53           HB3      GLU  53  -1.310   6.181 -10.424
  384    HG2  GLU  53           HG2      GLU  53  -2.140   8.041 -11.493
  385    HG3  GLU  53           HG3      GLU  53  -3.384   7.780 -10.279
  386    H    ILE  54           H        ILE  54   0.024   6.484  -6.839
  387    HA   ILE  54           HA       ILE  54   1.111   3.893  -7.202
  388    HB   ILE  54           HB       ILE  54   1.379   5.792  -4.824
  389   HG12  ILE  54          HG12      ILE  54   3.232   5.407  -7.236
  390   HG13  ILE  54          HG13      ILE  54   2.129   6.761  -7.016
  391   HG21  ILE  54          HG21      ILE  54   2.030   3.553  -4.132
  392   HG22  ILE  54          HG22      ILE  54   3.475   4.545  -4.300
  393   HG23  ILE  54          HG23      ILE  54   3.070   3.364  -5.550
  394   HD11  ILE  54          HD11      ILE  54   4.517   6.110  -5.292
  395   HD12  ILE  54          HD12      ILE  54   3.398   7.452  -5.026
  396   HD13  ILE  54          HD13      ILE  54   4.389   7.401  -6.485
  397    H    LEU  55           H        LEU  55  -1.059   5.207  -4.638
  398    HA   LEU  55           HA       LEU  55  -1.455   2.905  -3.090
  399    HB2  LEU  55           HB2      LEU  55  -3.451   5.119  -3.704
  400    HB3  LEU  55           HB3      LEU  55  -3.655   3.929  -2.428
  401    HG   LEU  55           HG       LEU  55  -1.468   6.041  -2.542
  402   HD11  LEU  55          HD11      LEU  55  -3.666   7.014  -2.072
  403   HD12  LEU  55          HD12      LEU  55  -2.642   7.071  -0.640
  404   HD13  LEU  55          HD13      LEU  55  -3.922   5.860  -0.758
  405   HD21  LEU  55          HD21      LEU  55  -0.654   4.002  -1.441
  406   HD22  LEU  55          HD22      LEU  55  -2.060   3.990  -0.376
  407   HD23  LEU  55          HD23      LEU  55  -0.879   5.295  -0.268
  408    H    GLN  56           H        GLN  56  -3.119   3.936  -6.048
  409    HA   GLN  56           HA       GLN  56  -5.171   2.002  -6.152
  410    HB2  GLN  56           HB2      GLN  56  -3.764   3.315  -8.512
  411    HB3  GLN  56           HB3      GLN  56  -5.368   2.587  -8.533
  412    HG2  GLN  56           HG2      GLN  56  -6.216   4.346  -7.063
  413    HG3  GLN  56           HG3      GLN  56  -4.601   5.035  -6.911
  414   HE21  GLN  56          HE21      GLN  56  -6.907   6.434  -7.826
  415   HE22  GLN  56          HE22      GLN  56  -6.605   6.922  -9.452
  416    H    ARG  57           H        ARG  57  -1.857   1.967  -7.521
  417    HA   ARG  57           HA       ARG  57  -1.970  -0.626  -8.719
  418    HB2  ARG  57           HB2      ARG  57   0.220   1.334  -8.084
  419    HB3  ARG  57           HB3      ARG  57   0.705  -0.325  -8.382
  420    HG2  ARG  57           HG2      ARG  57   0.904   1.013 -10.403
  421    HG3  ARG  57           HG3      ARG  57  -0.287  -0.268 -10.613
  422    HD2  ARG  57           HD2      ARG  57  -1.085   2.572  -9.918
  423    HD3  ARG  57           HD3      ARG  57  -0.844   2.046 -11.584
  424    HE   ARG  57           HE       ARG  57  -2.644   0.306 -10.261
  425   HH11  ARG  57          HH11      ARG  57  -2.554   3.487 -11.640
  426   HH12  ARG  57          HH12      ARG  57  -4.258   3.510 -11.914
  427   HH21  ARG  57          HH21      ARG  57  -4.793   0.378 -10.615
  428   HH22  ARG  57          HH22      ARG  57  -5.505   1.773 -11.354
  429    H    VAL  58           H        VAL  58  -1.058   0.463  -5.480
  430    HA   VAL  58           HA       VAL  58  -0.110  -2.022  -4.481
  431    HB   VAL  58           HB       VAL  58  -1.403   0.305  -2.972
  432   HG11  VAL  58          HG11      VAL  58  -1.515  -1.751  -1.630
  433   HG12  VAL  58          HG12      VAL  58  -0.342  -0.632  -0.941
  434   HG13  VAL  58          HG13      VAL  58   0.213  -2.029  -1.869
  435   HG21  VAL  58          HG21      VAL  58   0.662   0.940  -4.180
  436   HG22  VAL  58          HG22      VAL  58   1.543  -0.368  -3.391
  437   HG23  VAL  58          HG23      VAL  58   0.918   0.980  -2.435
  438    H    ILE  59           H        ILE  59  -3.385  -0.560  -4.553
  439    HA   ILE  59           HA       ILE  59  -4.841  -2.616  -3.305
  440    HB   ILE  59           HB       ILE  59  -5.733  -0.731  -5.542
  441   HG12  ILE  59          HG12      ILE  59  -6.212  -0.556  -2.521
  442   HG13  ILE  59          HG13      ILE  59  -5.029   0.393  -3.409
  443   HG21  ILE  59          HG21      ILE  59  -7.241  -2.668  -5.502
  444   HG22  ILE  59          HG22      ILE  59  -8.074  -1.243  -4.881
  445   HG23  ILE  59          HG23      ILE  59  -7.483  -2.477  -3.764
  446   HD11  ILE  59          HD11      ILE  59  -8.028   0.544  -3.718
  447   HD12  ILE  59          HD12      ILE  59  -6.853   1.486  -4.643
  448   HD13  ILE  59          HD13      ILE  59  -6.986   1.709  -2.900
  449    H    ASP  60           H        ASP  60  -4.133  -2.157  -6.822
  450    HA   ASP  60           HA       ASP  60  -5.233  -4.450  -7.930
  451    HB2  ASP  60           HB2      ASP  60  -2.647  -3.026  -8.689
  452    HB3  ASP  60           HB3      ASP  60  -3.348  -4.307  -9.669
  453    H    TYR  61           H        TYR  61  -1.967  -4.095  -6.584
  454    HA   TYR  61           HA       TYR  61  -0.939  -6.627  -7.108
  455    HB2  TYR  61           HB2      TYR  61   0.496  -4.771  -6.477
  456    HB3  TYR  61           HB3      TYR  61  -0.281  -4.646  -4.903
  457    HD1  TYR  61           HD1      TYR  61   1.433  -7.320  -6.933
  458    HD2  TYR  61           HD2      TYR  61   1.002  -5.467  -3.105
  459    HE1  TYR  61           HE1      TYR  61   3.134  -8.833  -6.007
  460    HE2  TYR  61           HE2      TYR  61   2.705  -6.974  -2.195
  461    HH   TYR  61           HH       TYR  61   3.657  -9.184  -2.674
  462    H    ILE  62           H        ILE  62  -2.405  -5.465  -4.052
  463    HA   ILE  62           HA       ILE  62  -2.064  -7.948  -2.683
  464    HB   ILE  62           HB       ILE  62  -3.890  -5.632  -1.876
  465   HG12  ILE  62          HG12      ILE  62  -0.939  -6.083  -1.155
  466   HG13  ILE  62          HG13      ILE  62  -1.530  -4.851  -2.259
  467   HG21  ILE  62          HG21      ILE  62  -2.581  -7.796  -0.180
  468   HG22  ILE  62          HG22      ILE  62  -4.294  -7.711  -0.598
  469   HG23  ILE  62          HG23      ILE  62  -3.578  -6.469   0.424
  470   HD11  ILE  62          HD11      ILE  62  -0.982  -3.893  -0.107
  471   HD12  ILE  62          HD12      ILE  62  -2.091  -4.992   0.707
  472   HD13  ILE  62          HD13      ILE  62  -2.716  -3.762  -0.395
  473    H    LEU  63           H        LEU  63  -4.728  -6.640  -4.634
  474    HA   LEU  63           HA       LEU  63  -6.779  -8.469  -4.026
  475    HB2  LEU  63           HB2      LEU  63  -6.073  -7.080  -6.633
  476    HB3  LEU  63           HB3      LEU  63  -7.505  -8.085  -6.469
  477    HG   LEU  63           HG       LEU  63  -6.964  -5.555  -4.865
  478   HD11  LEU  63          HD11      LEU  63  -8.729  -4.512  -6.228
  479   HD12  LEU  63          HD12      LEU  63  -8.849  -5.977  -7.206
  480   HD13  LEU  63          HD13      LEU  63  -7.363  -5.025  -7.220
  481   HD21  LEU  63          HD21      LEU  63  -8.322  -7.144  -3.600
  482   HD22  LEU  63          HD22      LEU  63  -9.438  -7.316  -4.957
  483   HD23  LEU  63          HD23      LEU  63  -9.302  -5.774  -4.111
  484    H    ASP  64           H        ASP  64  -4.190  -8.762  -6.512
  485    HA   ASP  64           HA       ASP  64  -4.933 -11.285  -7.538
  486    HB2  ASP  64           HB2      ASP  64  -2.267  -9.818  -7.543
  487    HB3  ASP  64           HB3      ASP  64  -2.518 -11.333  -8.400
  488    H    LEU  65           H        LEU  65  -2.958 -10.441  -4.764
  489    HA   LEU  65           HA       LEU  65  -1.827 -13.029  -4.279
  490    HB2  LEU  65           HB2      LEU  65  -2.303 -10.790  -2.274
  491    HB3  LEU  65           HB3      LEU  65  -1.176 -12.130  -2.095
  492    HG   LEU  65           HG       LEU  65  -0.958  -9.857  -4.105
  493   HD11  LEU  65          HD11      LEU  65  -0.427  -9.144  -1.836
  494   HD12  LEU  65          HD12      LEU  65   1.013  -9.168  -2.845
  495   HD13  LEU  65          HD13      LEU  65   0.743 -10.460  -1.677
  496   HD21  LEU  65          HD21      LEU  65   0.931 -12.201  -3.696
  497   HD22  LEU  65          HD22      LEU  65   1.227 -10.803  -4.734
  498   HD23  LEU  65          HD23      LEU  65  -0.091 -11.909  -5.109
  499    H    GLN  66           H        GLN  66  -4.697 -11.343  -3.122
  500    HA   GLN  66           HA       GLN  66  -5.659 -13.692  -1.603
  501    HB2  GLN  66           HB2      GLN  66  -6.705 -10.824  -1.724
  502    HB3  GLN  66           HB3      GLN  66  -7.319 -12.094  -0.666
  503    HG2  GLN  66           HG2      GLN  66  -5.154 -12.172   0.508
  504    HG3  GLN  66           HG3      GLN  66  -4.519 -10.925  -0.564
  505   HE21  GLN  66          HE21      GLN  66  -5.491  -8.824  -0.448
  506   HE22  GLN  66          HE22      GLN  66  -6.206  -8.276   1.019
  507    H    VAL  67           H        VAL  67  -8.421 -13.319  -1.785
  508    HA   VAL  67           HA       VAL  67  -9.172 -13.858  -4.521
  509    HB   VAL  67           HB       VAL  67 -11.540 -13.808  -3.639
  510   HG11  VAL  67          HG11      VAL  67 -10.276 -15.912  -3.696
  511   HG12  VAL  67          HG12      VAL  67 -11.341 -15.886  -2.292
  512   HG13  VAL  67          HG13      VAL  67  -9.612 -15.593  -2.092
  513   HG21  VAL  67          HG21      VAL  67 -10.229 -13.288  -0.926
  514   HG22  VAL  67          HG22      VAL  67 -11.931 -13.677  -1.188
  515   HG23  VAL  67          HG23      VAL  67 -11.273 -12.165  -1.807
  516    H    VAL  68           H        VAL  68  -9.902 -12.450  -6.027
  517    HA   VAL  68           HA       VAL  68  -9.500  -9.614  -5.638
  518    HB   VAL  68           HB       VAL  68 -10.502 -11.088  -8.129
  519   HG11  VAL  68          HG11      VAL  68  -9.746  -9.074  -9.358
  520   HG12  VAL  68          HG12      VAL  68  -9.318  -8.295  -7.833
  521   HG13  VAL  68          HG13      VAL  68 -11.004  -8.679  -8.187
  522   HG21  VAL  68          HG21      VAL  68  -8.162 -11.012  -8.924
  523   HG22  VAL  68          HG22      VAL  68  -8.281 -11.921  -7.420
  524   HG23  VAL  68          HG23      VAL  68  -7.652 -10.274  -7.397
  525    H1   MET   1           H1       MET   1  -7.447  43.649  -8.364
  526    H2   MET   1           H2       MET   1  -6.487  45.042  -8.430
  527    H3   MET   1           H3       MET   1  -7.285  44.500  -9.815
  528    HA   MET   1           HA       MET   1  -8.608  45.436  -7.349
  529    HB2  MET   1           HB2      MET   1  -9.248  47.462  -8.755
  530    HB3  MET   1           HB3      MET   1  -7.555  47.356  -8.305
  531    HG2  MET   1           HG2      MET   1  -7.033  46.487 -10.575
  532    HG3  MET   1           HG3      MET   1  -8.729  46.694 -11.016
  533    HE1  MET   1           HE1      MET   1  -6.977  49.612 -12.983
  534    HE2  MET   1           HE2      MET   1  -8.087  48.251 -13.113
  535    HE3  MET   1           HE3      MET   1  -6.387  47.971 -12.727
  536    H    GLY   2           H        GLY   2 -10.204  43.924  -7.216
  537    HA2  GLY   2           HA2      GLY   2 -12.422  44.001  -9.063
  538    HA3  GLY   2           HA3      GLY   2 -11.520  42.489  -9.160
  539    H    HIS   3           H        HIS   3 -12.704  44.648  -6.592
  540    HA   HIS   3           HA       HIS   3 -13.336  42.406  -4.821
  541    HB2  HIS   3           HB2      HIS   3 -13.418  45.413  -4.309
  542    HB3  HIS   3           HB3      HIS   3 -13.580  44.155  -3.085
  543    HD2  HIS   3           HD2      HIS   3 -10.809  45.888  -5.223
  544    HE1  HIS   3           HE1      HIS   3  -8.972  43.292  -2.439
  545    HE2  HIS   3           HE2      HIS   3  -8.582  44.930  -4.329
  546    H    HIS   4           H        HIS   4 -15.068  45.243  -6.253
  547    HA   HIS   4           HA       HIS   4 -17.673  43.933  -5.980
  548    HB2  HIS   4           HB2      HIS   4 -18.661  45.697  -4.556
  549    HB3  HIS   4           HB3      HIS   4 -17.327  44.899  -3.731
  550    HD2  HIS   4           HD2      HIS   4 -15.003  46.478  -3.372
  551    HE1  HIS   4           HE1      HIS   4 -16.876  50.080  -4.552
  552    HE2  HIS   4           HE2      HIS   4 -14.806  49.051  -3.536
  553    H    HIS   5           H        HIS   5 -15.699  46.402  -7.382
  554    HA   HIS   5           HA       HIS   5 -17.635  48.260  -8.279
  555    HB2  HIS   5           HB2      HIS   5 -15.266  48.852  -8.055
  556    HB3  HIS   5           HB3      HIS   5 -14.825  47.693  -9.302
  557    HD2  HIS   5           HD2      HIS   5 -14.600  48.796 -11.770
  558    HE1  HIS   5           HE1      HIS   5 -16.799  52.325 -10.998
  559    HE2  HIS   5           HE2      HIS   5 -15.217  51.171 -12.592
  560    H    HIS   6           H        HIS   6 -16.644  45.205  -9.643
  561    HA   HIS   6           HA       HIS   6 -17.612  45.757 -12.338
  562    HB2  HIS   6           HB2      HIS   6 -16.524  43.203 -11.092
  563    HB3  HIS   6           HB3      HIS   6 -16.877  43.425 -12.806
  564    HD2  HIS   6           HD2      HIS   6 -15.032  44.935 -14.235
  565    HE1  HIS   6           HE1      HIS   6 -12.318  45.361 -11.024
  566    HE2  HIS   6           HE2      HIS   6 -12.585  45.389 -13.534
  567    H    HIS   7           H        HIS   7 -19.606  45.267 -13.107
  568    HA   HIS   7           HA       HIS   7 -21.471  43.635 -11.458
  569    HB2  HIS   7           HB2      HIS   7 -22.081  46.099 -13.153
  570    HB3  HIS   7           HB3      HIS   7 -23.304  45.099 -12.374
  571    HD2  HIS   7           HD2      HIS   7 -20.692  47.844 -11.472
  572    HE1  HIS   7           HE1      HIS   7 -23.013  46.987  -8.047
  573    HE2  HIS   7           HE2      HIS   7 -21.116  48.379  -8.979
  574    H    HIS   8           H        HIS   8 -21.219  41.692 -12.541
  575    HA   HIS   8           HA       HIS   8 -21.848  41.538 -15.441
  576    HB2  HIS   8           HB2      HIS   8 -20.530  39.487 -13.598
  577    HB3  HIS   8           HB3      HIS   8 -20.851  39.243 -15.315
  578    HD2  HIS   8           HD2      HIS   8 -18.951  40.238 -17.016
  579    HE1  HIS   8           HE1      HIS   8 -16.639  42.176 -14.059
  580    HE2  HIS   8           HE2      HIS   8 -16.659  41.274 -16.414
  581    H    SER   9           H        SER   9 -23.805  40.764 -16.043
  582    HA   SER   9           HA       SER   9 -25.312  38.874 -14.361
  583    HB2  SER   9           HB2      SER   9 -27.392  40.247 -14.488
  584    HB3  SER   9           HB3      SER   9 -26.116  41.090 -13.610
  585    HG   SER   9           HG       SER   9 -26.588  42.642 -14.969
  586    H    HIS  10           H        HIS  10 -26.671  37.531 -15.492
  587    HA   HIS  10           HA       HIS  10 -27.200  37.990 -18.357
  588    HB2  HIS  10           HB2      HIS  10 -25.919  35.480 -17.196
  589    HB3  HIS  10           HB3      HIS  10 -26.705  35.500 -18.772
  590    HD1  HIS  10           HD1      HIS  10 -23.536  36.321 -17.085
  591    HD2  HIS  10           HD2      HIS  10 -25.351  37.139 -20.729
  592    HE1  HIS  10           HE1      HIS  10 -21.703  37.122 -18.582
  593    HE2  HIS  10           HE2      HIS  10 -22.856  37.811 -20.697
  594    H    MET  11           H        MET  11 -29.361  37.963 -18.552
  595    HA   MET  11           HA       MET  11 -31.128  36.675 -16.680
  596    HB2  MET  11           HB2      MET  11 -31.701  38.017 -19.359
  597    HB3  MET  11           HB3      MET  11 -32.945  37.456 -18.246
  598    HG2  MET  11           HG2      MET  11 -32.096  39.029 -16.533
  599    HG3  MET  11           HG3      MET  11 -30.894  39.611 -17.688
  600    HE1  MET  11           HE1      MET  11 -33.038  41.488 -16.113
  601    HE2  MET  11           HE2      MET  11 -33.489  42.581 -17.421
  602    HE3  MET  11           HE3      MET  11 -31.803  42.117 -17.211
  603    H    GLY  12           H        GLY  12 -31.947  34.652 -16.747
  604    HA2  GLY  12           HA2      GLY  12 -32.565  32.557 -17.604
  605    HA3  GLY  12           HA3      GLY  12 -31.886  32.981 -19.162
  606    H    GLY  13           H        GLY  13 -29.326  33.623 -18.660
  607    HA2  GLY  13           HA2      GLY  13 -27.957  31.183 -18.214
  608    HA3  GLY  13           HA3      GLY  13 -27.223  32.764 -18.386
  609    H    GLY  14           H        GLY  14 -28.840  33.733 -15.999
  610    HA2  GLY  14           HA2      GLY  14 -26.920  33.227 -13.943
  611    HA3  GLY  14           HA3      GLY  14 -28.419  34.120 -13.775
  612    H    LYS  15           H        LYS  15 -29.872  31.604 -14.798
  613    HA   LYS  15           HA       LYS  15 -30.620  30.579 -12.232
  614    HB2  LYS  15           HB2      LYS  15 -32.214  30.796 -14.101
  615    HB3  LYS  15           HB3      LYS  15 -31.311  29.611 -15.040
  616    HG2  LYS  15           HG2      LYS  15 -31.848  27.896 -13.273
  617    HG3  LYS  15           HG3      LYS  15 -32.873  29.097 -12.479
  618    HD2  LYS  15           HD2      LYS  15 -34.265  29.238 -14.543
  619    HD3  LYS  15           HD3      LYS  15 -33.245  28.017 -15.308
  620    HE2  LYS  15           HE2      LYS  15 -35.279  26.970 -14.499
  621    HE3  LYS  15           HE3      LYS  15 -33.923  26.402 -13.524
  622    HZ1  LYS  15           HZ1      LYS  15 -35.804  26.936 -12.143
  623    HZ2  LYS  15           HZ2      LYS  15 -35.869  28.508 -12.758
  624    HZ3  LYS  15           HZ3      LYS  15 -34.550  28.023 -11.820
  625    H    GLY  16           H        GLY  16 -29.044  29.404 -11.144
  626    HA2  GLY  16           HA2      GLY  16 -28.863  26.693 -11.425
  627    HA3  GLY  16           HA3      GLY  16 -27.506  27.277 -12.377
  628    HA   PRO  17           HA       PRO  17 -26.063  27.278  -7.857
  629    HB2  PRO  17           HB2      PRO  17 -25.613  24.738  -7.150
  630    HB3  PRO  17           HB3      PRO  17 -27.258  25.392  -7.114
  631    HG2  PRO  17           HG2      PRO  17 -25.966  23.624  -9.184
  632    HG3  PRO  17           HG3      PRO  17 -27.599  23.529  -8.491
  633    HD2  PRO  17           HD2      PRO  17 -26.951  24.751 -10.941
  634    HD3  PRO  17           HD3      PRO  17 -28.444  25.033 -10.023
  635    H    ALA  18           H        ALA  18 -23.852  26.270  -7.019
  636    HA   ALA  18           HA       ALA  18 -21.935  25.432  -9.041
  637    HB1  ALA  18           HB1      ALA  18 -21.545  28.143  -7.707
  638    HB2  ALA  18           HB2      ALA  18 -21.937  27.877  -9.407
  639    HB3  ALA  18           HB3      ALA  18 -20.388  27.329  -8.767
  640    H    ALA  19           H        ALA  19 -19.682  25.267  -8.083
  641    HA   ALA  19           HA       ALA  19 -18.149  24.569  -6.589
  642    HB1  ALA  19           HB1      ALA  19 -19.965  25.727  -4.443
  643    HB2  ALA  19           HB2      ALA  19 -18.721  26.614  -5.324
  644    HB3  ALA  19           HB3      ALA  19 -18.262  25.296  -4.245
  645    H    GLU  20           H        GLU  20 -18.013  23.235  -4.311
  646    HA   GLU  20           HA       GLU  20 -19.458  20.719  -4.795
  647    HB2  GLU  20           HB2      GLU  20 -17.137  21.373  -2.929
  648    HB3  GLU  20           HB3      GLU  20 -17.766  19.756  -3.237
  649    HG2  GLU  20           HG2      GLU  20 -17.052  19.902  -5.586
  650    HG3  GLU  20           HG3      GLU  20 -16.495  21.556  -5.329
  651    H    GLU  21           H        GLU  21 -19.575  19.508  -2.403
  652    HA   GLU  21           HA       GLU  21 -21.781  20.691  -1.046
  653    HB2  GLU  21           HB2      GLU  21 -21.619  18.753   0.526
  654    HB3  GLU  21           HB3      GLU  21 -21.706  18.287  -1.162
  655    HG2  GLU  21           HG2      GLU  21 -18.971  18.477   0.071
  656    HG3  GLU  21           HG3      GLU  21 -19.997  17.144   0.576
  657    HA   PRO  22           HA       PRO  22 -19.379  23.103   2.055
  658    HB2  PRO  22           HB2      PRO  22 -22.070  23.395   3.342
  659    HB3  PRO  22           HB3      PRO  22 -20.924  24.649   2.843
  660    HG2  PRO  22           HG2      PRO  22 -23.182  24.234   1.454
  661    HG3  PRO  22           HG3      PRO  22 -21.663  24.625   0.617
  662    HD2  PRO  22           HD2      PRO  22 -22.986  21.928   0.982
  663    HD3  PRO  22           HD3      PRO  22 -22.253  22.632  -0.480
  664    H    LEU  23           H        LEU  23 -18.489  22.456   3.998
  665    HA   LEU  23           HA       LEU  23 -17.775  21.075   5.637
  666    HB2  LEU  23           HB2      LEU  23 -20.627  20.014   5.737
  667    HB3  LEU  23           HB3      LEU  23 -19.382  19.674   6.931
  668    HG   LEU  23           HG       LEU  23 -20.504  22.452   6.352
  669   HD11  LEU  23          HD11      LEU  23 -21.693  22.274   8.496
  670   HD12  LEU  23          HD12      LEU  23 -21.141  20.607   8.675
  671   HD13  LEU  23          HD13      LEU  23 -22.231  21.041   7.357
  672   HD21  LEU  23          HD21      LEU  23 -18.194  22.528   7.186
  673   HD22  LEU  23          HD22      LEU  23 -18.635  21.520   8.568
  674   HD23  LEU  23          HD23      LEU  23 -19.315  23.139   8.397
  675    H    SER  24           H        SER  24 -17.095  18.847   6.064
  676    HA   SER  24           HA       SER  24 -16.134  16.893   5.459
  677    HB2  SER  24           HB2      SER  24 -18.324  16.599   3.353
  678    HB3  SER  24           HB3      SER  24 -17.279  15.308   3.951
  679    HG   SER  24           HG       SER  24 -19.422  16.619   5.203
  680    H    LEU  25           H        LEU  25 -14.784  15.848   3.790
  681    HA   LEU  25           HA       LEU  25 -14.081  17.575   1.481
  682    HB2  LEU  25           HB2      LEU  25 -12.157  16.225   3.415
  683    HB3  LEU  25           HB3      LEU  25 -11.659  16.927   1.885
  684    HG   LEU  25           HG       LEU  25 -12.886  18.499   4.192
  685   HD11  LEU  25          HD11      LEU  25  -9.981  18.363   3.317
  686   HD12  LEU  25          HD12      LEU  25 -10.656  17.670   4.793
  687   HD13  LEU  25          HD13      LEU  25 -10.643  19.417   4.572
  688   HD21  LEU  25          HD21      LEU  25 -12.225  20.506   2.924
  689   HD22  LEU  25          HD22      LEU  25 -13.367  19.532   2.006
  690   HD23  LEU  25          HD23      LEU  25 -11.650  19.497   1.593
  691    H    LEU  26           H        LEU  26 -13.533  16.527  -0.413
  692    HA   LEU  26           HA       LEU  26 -13.993  13.660  -0.643
  693    HB2  LEU  26           HB2      LEU  26 -13.427  15.854  -2.655
  694    HB3  LEU  26           HB3      LEU  26 -13.438  14.163  -3.134
  695    HG   LEU  26           HG       LEU  26 -15.813  15.616  -1.893
  696   HD11  LEU  26          HD11      LEU  26 -16.832  15.562  -4.122
  697   HD12  LEU  26          HD12      LEU  26 -15.355  14.870  -4.797
  698   HD13  LEU  26          HD13      LEU  26 -15.343  16.504  -4.129
  699   HD21  LEU  26          HD21      LEU  26 -17.097  13.603  -2.547
  700   HD22  LEU  26          HD22      LEU  26 -15.824  13.208  -1.397
  701   HD23  LEU  26          HD23      LEU  26 -15.610  12.830  -3.107
  702    H    ASP  27           H        ASP  27 -12.178  13.191   0.831
  703    HA   ASP  27           HA       ASP  27  -9.470  13.394  -0.191
  704    HB2  ASP  27           HB2      ASP  27 -10.501  11.715   2.137
  705    HB3  ASP  27           HB3      ASP  27  -8.825  12.141   1.806
  706    H    ASP  28           H        ASP  28  -9.904  12.372  -2.238
  707    HA   ASP  28           HA       ASP  28 -10.573   9.749  -2.800
  708    HB2  ASP  28           HB2      ASP  28  -8.855  10.035  -4.750
  709    HB3  ASP  28           HB3      ASP  28 -10.186  11.186  -4.655
  710    H    MET  29           H        MET  29  -7.526  11.011  -1.556
  711    HA   MET  29           HA       MET  29  -5.934   8.708  -1.553
  712    HB2  MET  29           HB2      MET  29  -5.941  10.971   0.488
  713    HB3  MET  29           HB3      MET  29  -4.628   9.829   0.222
  714    HG2  MET  29           HG2      MET  29  -4.929  10.876  -2.299
  715    HG3  MET  29           HG3      MET  29  -5.358  12.258  -1.298
  716    HE1  MET  29           HE1      MET  29  -2.638   9.567  -2.141
  717    HE2  MET  29           HE2      MET  29  -2.835   9.345  -0.401
  718    HE3  MET  29           HE3      MET  29  -1.338  10.020  -1.045
  719    H    ASN  30           H        ASN  30  -8.154   9.948   0.979
  720    HA   ASN  30           HA       ASN  30  -7.624   7.915   2.906
  721    HB2  ASN  30           HB2      ASN  30  -8.505  10.082   3.597
  722    HB3  ASN  30           HB3      ASN  30  -9.961   9.844   2.642
  723   HD21  ASN  30          HD21      ASN  30 -11.608   8.555   3.470
  724   HD22  ASN  30          HD22      ASN  30 -11.621   7.981   5.096
  725    H    HIS  31           H        HIS  31  -9.979   8.156   0.265
  726    HA   HIS  31           HA       HIS  31 -11.534   5.866   0.944
  727    HB2  HIS  31           HB2      HIS  31 -11.136   7.261  -1.725
  728    HB3  HIS  31           HB3      HIS  31 -12.264   5.926  -1.489
  729    HD2  HIS  31           HD2      HIS  31 -12.432   9.608  -1.515
  730    HE1  HIS  31           HE1      HIS  31 -15.357   8.436   1.287
  731    HE2  HIS  31           HE2      HIS  31 -14.299  10.382   0.085
  732    H    CYS  32           H        CYS  32  -8.646   6.275  -1.093
  733    HA   CYS  32           HA       CYS  32  -8.324   3.550  -1.863
  734    HB2  CYS  32           HB2      CYS  32  -6.229   5.745  -1.617
  735    HB3  CYS  32           HB3      CYS  32  -5.993   4.203  -2.440
  736    HG   CYS  32           HG       CYS  32  -7.285   7.005  -3.591
  737    H    TYR  33           H        TYR  33  -6.947   5.441   0.816
  738    HA   TYR  33           HA       TYR  33  -5.326   3.528   2.062
  739    HB2  TYR  33           HB2      TYR  33  -6.767   5.994   3.067
  740    HB3  TYR  33           HB3      TYR  33  -5.870   4.988   4.191
  741    HD1  TYR  33           HD1      TYR  33  -3.447   4.339   2.512
  742    HD2  TYR  33           HD2      TYR  33  -5.531   8.024   3.094
  743    HE1  TYR  33           HE1      TYR  33  -1.367   5.573   2.148
  744    HE2  TYR  33           HE2      TYR  33  -3.443   9.260   2.706
  745    HH   TYR  33           HH       TYR  33  -1.075   8.933   2.820
  746    H    SER  34           H        SER  34  -8.778   4.224   2.432
  747    HA   SER  34           HA       SER  34  -9.377   2.556   4.624
  748    HB2  SER  34           HB2      SER  34 -10.933   4.308   3.796
  749    HB3  SER  34           HB3      SER  34 -11.218   3.364   2.334
  750    HG   SER  34           HG       SER  34 -12.436   1.984   3.440
  751    H    ARG  35           H        ARG  35  -9.467   1.936   1.100
  752    HA   ARG  35           HA       ARG  35 -10.358  -0.762   1.278
  753    HB2  ARG  35           HB2      ARG  35 -10.620   0.717  -0.720
  754    HB3  ARG  35           HB3      ARG  35  -8.890   0.581  -1.024
  755    HG2  ARG  35           HG2      ARG  35  -9.048  -1.566  -1.810
  756    HG3  ARG  35           HG3      ARG  35 -10.362  -1.996  -0.720
  757    HD2  ARG  35           HD2      ARG  35 -11.196  -2.053  -2.960
  758    HD3  ARG  35           HD3      ARG  35 -11.927  -0.673  -2.154
  759    HE   ARG  35           HE       ARG  35  -9.784  -0.557  -4.187
  760   HH11  ARG  35          HH11      ARG  35 -12.268   1.093  -2.424
  761   HH12  ARG  35          HH12      ARG  35 -12.245   2.463  -3.479
  762   HH21  ARG  35          HH21      ARG  35  -9.777   1.198  -5.514
  763   HH22  ARG  35          HH22      ARG  35 -10.851   2.520  -5.210
  764    H    LEU  36           H        LEU  36  -7.124   0.734   1.251
  765    HA   LEU  36           HA       LEU  36  -5.576  -1.631   1.143
  766    HB2  LEU  36           HB2      LEU  36  -5.012   0.992   2.572
  767    HB3  LEU  36           HB3      LEU  36  -3.828  -0.294   2.383
  768    HG   LEU  36           HG       LEU  36  -5.094   1.303   0.123
  769   HD11  LEU  36          HD11      LEU  36  -2.834   2.227  -0.222
  770   HD12  LEU  36          HD12      LEU  36  -2.267   1.368   1.214
  771   HD13  LEU  36          HD13      LEU  36  -3.482   2.639   1.366
  772   HD21  LEU  36          HD21      LEU  36  -3.530   0.120  -1.370
  773   HD22  LEU  36          HD22      LEU  36  -4.672  -0.987  -0.617
  774   HD23  LEU  36          HD23      LEU  36  -3.010  -0.902  -0.026
  775    H    ARG  37           H        ARG  37  -7.056   0.086   3.929
  776    HA   ARG  37           HA       ARG  37  -6.132  -1.751   5.913
  777    HB2  ARG  37           HB2      ARG  37  -7.974   0.582   5.891
  778    HB3  ARG  37           HB3      ARG  37  -8.321  -0.600   7.138
  779    HG2  ARG  37           HG2      ARG  37  -6.904   1.147   8.048
  780    HG3  ARG  37           HG3      ARG  37  -6.022  -0.376   8.013
  781    HD2  ARG  37           HD2      ARG  37  -5.711   1.818   5.940
  782    HD3  ARG  37           HD3      ARG  37  -4.666   1.646   7.348
  783    HE   ARG  37           HE       ARG  37  -4.812  -0.185   5.042
  784   HH11  ARG  37          HH11      ARG  37  -3.058   0.935   7.780
  785   HH12  ARG  37          HH12      ARG  37  -1.688  -0.055   7.438
  786   HH21  ARG  37          HH21      ARG  37  -3.076  -1.460   4.637
  787   HH22  ARG  37          HH22      ARG  37  -1.701  -1.400   5.677
  788    H    GLU  38           H        GLU  38  -8.475  -2.173   3.548
  789    HA   GLU  38           HA       GLU  38 -10.013  -4.215   5.003
  790    HB2  GLU  38           HB2      GLU  38 -10.219  -3.210   2.127
  791    HB3  GLU  38           HB3      GLU  38 -11.275  -4.428   2.835
  792    HG2  GLU  38           HG2      GLU  38 -12.083  -2.749   4.482
  793    HG3  GLU  38           HG3      GLU  38 -11.052  -1.536   3.731
  794    H    LEU  39           H        LEU  39  -7.644  -3.864   2.403
  795    HA   LEU  39           HA       LEU  39  -7.500  -6.704   1.791
  796    HB2  LEU  39           HB2      LEU  39  -5.887  -4.355   0.738
  797    HB3  LEU  39           HB3      LEU  39  -5.799  -5.995   0.114
  798    HG   LEU  39           HG       LEU  39  -8.222  -4.160  -0.028
  799   HD11  LEU  39          HD11      LEU  39  -7.829  -4.141  -2.446
  800   HD12  LEU  39          HD12      LEU  39  -6.376  -5.120  -2.232
  801   HD13  LEU  39          HD13      LEU  39  -6.449  -3.485  -1.566
  802   HD21  LEU  39          HD21      LEU  39  -8.956  -6.492   0.234
  803   HD22  LEU  39          HD22      LEU  39  -7.924  -6.989  -1.112
  804   HD23  LEU  39          HD23      LEU  39  -9.292  -5.908  -1.394
  805    H    VAL  40           H        VAL  40  -5.998  -4.689   4.080
  806    HA   VAL  40           HA       VAL  40  -3.626  -6.469   4.340
  807    HB   VAL  40           HB       VAL  40  -3.976  -3.613   5.394
  808   HG11  VAL  40          HG11      VAL  40  -1.563  -3.704   5.968
  809   HG12  VAL  40          HG12      VAL  40  -1.518  -5.404   5.493
  810   HG13  VAL  40          HG13      VAL  40  -2.498  -4.899   6.868
  811   HG21  VAL  40          HG21      VAL  40  -2.324  -4.638   3.048
  812   HG22  VAL  40          HG22      VAL  40  -2.281  -2.989   3.684
  813   HG23  VAL  40          HG23      VAL  40  -3.767  -3.617   2.970
  814    HA   PRO  41           HA       PRO  41  -5.695  -7.636   8.336
  815    HB2  PRO  41           HB2      PRO  41  -4.846 -10.245   8.281
  816    HB3  PRO  41           HB3      PRO  41  -6.339  -9.715   7.492
  817    HG2  PRO  41           HG2      PRO  41  -3.609 -10.147   6.275
  818    HG3  PRO  41           HG3      PRO  41  -5.193 -10.700   5.684
  819    HD2  PRO  41           HD2      PRO  41  -3.999  -8.494   4.673
  820    HD3  PRO  41           HD3      PRO  41  -5.760  -8.591   4.845
  821    H    GLY  42           H        GLY  42  -2.536  -7.330   7.017
  822    HA2  GLY  42           HA2      GLY  42  -0.981  -8.033   9.363
  823    HA3  GLY  42           HA3      GLY  42  -0.411  -7.189   7.934
  824    H    VAL  43           H        VAL  43  -2.807  -6.534  10.471
  825    HA   VAL  43           HA       VAL  43  -1.539  -3.956  11.158
  826    HB   VAL  43           HB       VAL  43  -4.540  -4.451  10.773
  827   HG11  VAL  43          HG11      VAL  43  -4.885  -2.075  11.398
  828   HG12  VAL  43          HG12      VAL  43  -3.172  -1.934  11.806
  829   HG13  VAL  43          HG13      VAL  43  -4.215  -3.017  12.730
  830   HG21  VAL  43          HG21      VAL  43  -3.384  -4.064   8.632
  831   HG22  VAL  43          HG22      VAL  43  -2.676  -2.570   9.251
  832   HG23  VAL  43          HG23      VAL  43  -4.423  -2.695   9.024
  833    HA   PRO  44           HA       PRO  44  -1.893  -5.850  15.360
  834    HB2  PRO  44           HB2      PRO  44  -1.324  -2.998  16.159
  835    HB3  PRO  44           HB3      PRO  44  -0.550  -4.495  16.706
  836    HG2  PRO  44           HG2      PRO  44   0.717  -2.893  14.987
  837    HG3  PRO  44           HG3      PRO  44   0.789  -4.658  14.773
  838    HD2  PRO  44           HD2      PRO  44  -0.915  -2.635  13.311
  839    HD3  PRO  44           HD3      PRO  44  -0.010  -4.020  12.659
  840    H    ARG  45           H        ARG  45  -3.680  -6.031  16.683
  841    HA   ARG  45           HA       ARG  45  -6.111  -4.712  15.971
  842    HB2  ARG  45           HB2      ARG  45  -5.564  -6.499  18.363
  843    HB3  ARG  45           HB3      ARG  45  -7.153  -6.057  17.742
  844    HG2  ARG  45           HG2      ARG  45  -6.557  -7.217  15.590
  845    HG3  ARG  45           HG3      ARG  45  -5.064  -7.766  16.356
  846    HD2  ARG  45           HD2      ARG  45  -6.662  -9.543  16.509
  847    HD3  ARG  45           HD3      ARG  45  -6.468  -8.868  18.127
  848    HE   ARG  45           HE       ARG  45  -8.769  -8.350  16.330
  849   HH11  ARG  45          HH11      ARG  45  -7.528  -8.554  19.561
  850   HH12  ARG  45          HH12      ARG  45  -9.097  -8.403  20.266
  851   HH21  ARG  45          HH21      ARG  45 -10.741  -8.134  17.275
  852   HH22  ARG  45          HH22      ARG  45 -10.877  -8.160  19.002
  853    H    GLY  46           H        GLY  46  -7.433  -3.306  17.205
  854    HA2  GLY  46           HA2      GLY  46  -7.911  -1.485  18.517
  855    HA3  GLY  46           HA3      GLY  46  -6.816  -2.160  19.715
  856    H    THR  47           H        THR  47  -6.164  -0.969  16.402
  857    HA   THR  47           HA       THR  47  -4.382   1.149  17.478
  858    HB   THR  47           HB       THR  47  -3.573  -0.820  15.277
  859    HG1  THR  47           HG1      THR  47  -3.405  -1.865  17.228
  860   HG21  THR  47          HG21      THR  47  -1.337   0.241  15.446
  861   HG22  THR  47          HG22      THR  47  -1.973   1.416  16.597
  862   HG23  THR  47          HG23      THR  47  -2.558   1.406  14.931
  863    H    GLN  48           H        GLN  48  -5.112   3.020  16.664
  864    HA   GLN  48           HA       GLN  48  -6.434   3.256  14.079
  865    HB2  GLN  48           HB2      GLN  48  -7.241   4.559  16.012
  866    HB3  GLN  48           HB3      GLN  48  -5.676   5.345  16.165
  867    HG2  GLN  48           HG2      GLN  48  -6.018   6.443  13.972
  868    HG3  GLN  48           HG3      GLN  48  -7.582   5.645  13.821
  869   HE21  GLN  48          HE21      GLN  48  -8.675   7.631  13.711
  870   HE22  GLN  48          HE22      GLN  48  -8.875   8.658  15.082
  871    H    LEU  49           H        LEU  49  -5.249   3.419  12.249
  872    HA   LEU  49           HA       LEU  49  -2.428   4.269  12.357
  873    HB2  LEU  49           HB2      LEU  49  -4.017   2.893  10.166
  874    HB3  LEU  49           HB3      LEU  49  -2.297   3.260  10.079
  875    HG   LEU  49           HG       LEU  49  -3.562   1.389  12.129
  876   HD11  LEU  49          HD11      LEU  49  -2.550  -0.443  10.836
  877   HD12  LEU  49          HD12      LEU  49  -2.039   0.708   9.599
  878   HD13  LEU  49          HD13      LEU  49  -3.757   0.434   9.899
  879   HD21  LEU  49          HD21      LEU  49  -1.242   0.717  12.640
  880   HD22  LEU  49          HD22      LEU  49  -1.499   2.427  12.969
  881   HD23  LEU  49          HD23      LEU  49  -0.631   1.933  11.513
  882    H    SER  50           H        SER  50  -1.893   6.272  11.818
  883    HA   SER  50           HA       SER  50  -3.544   8.081  10.274
  884    HB2  SER  50           HB2      SER  50  -0.671   8.403  11.257
  885    HB3  SER  50           HB3      SER  50  -1.690   9.694  10.619
  886    HG   SER  50           HG       SER  50  -1.772   9.751  12.855
  887    H    GLN  51           H        GLN  51  -2.210   9.383   8.464
  888    HA   GLN  51           HA       GLN  51  -2.334   7.879   6.179
  889    HB2  GLN  51           HB2      GLN  51  -1.168   9.794   5.026
  890    HB3  GLN  51           HB3      GLN  51  -2.529  10.257   6.040
  891    HG2  GLN  51           HG2      GLN  51  -1.024  11.043   7.788
  892    HG3  GLN  51           HG3      GLN  51   0.376  10.444   6.898
  893   HE21  GLN  51          HE21      GLN  51   1.303  12.509   6.915
  894   HE22  GLN  51          HE22      GLN  51   0.724  13.788   5.912
  895    H    VAL  52           H        VAL  52   0.802   8.831   7.722
  896    HA   VAL  52           HA       VAL  52   2.425   7.353   5.862
  897    HB   VAL  52           HB       VAL  52   3.277   8.327   8.639
  898   HG11  VAL  52          HG11      VAL  52   4.938   7.651   6.173
  899   HG12  VAL  52          HG12      VAL  52   4.836   6.691   7.650
  900   HG13  VAL  52          HG13      VAL  52   5.575   8.291   7.694
  901   HG21  VAL  52          HG21      VAL  52   2.410  10.235   7.364
  902   HG22  VAL  52          HG22      VAL  52   3.417   9.808   5.980
  903   HG23  VAL  52          HG23      VAL  52   4.171  10.349   7.482
  904    H    GLU  53           H        GLU  53   1.167   6.719   9.124
  905    HA   GLU  53           HA       GLU  53   2.441   4.328   9.788
  906    HB2  GLU  53           HB2      GLU  53  -0.429   5.110  10.484
  907    HB3  GLU  53           HB3      GLU  53   0.548   3.914  11.332
  908    HG2  GLU  53           HG2      GLU  53   1.052   6.905  11.219
  909    HG3  GLU  53           HG3      GLU  53   0.431   5.992  12.594
  910    H    ILE  54           H        ILE  54  -0.451   4.853   7.820
  911    HA   ILE  54           HA       ILE  54  -1.240   2.197   7.367
  912    HB   ILE  54           HB       ILE  54  -1.567   4.718   5.691
  913   HG12  ILE  54          HG12      ILE  54  -3.477   3.168   7.512
  914   HG13  ILE  54          HG13      ILE  54  -2.766   4.744   7.834
  915   HG21  ILE  54          HG21      ILE  54  -2.820   2.006   5.112
  916   HG22  ILE  54          HG22      ILE  54  -1.664   2.872   4.100
  917   HG23  ILE  54          HG23      ILE  54  -3.282   3.522   4.337
  918   HD11  ILE  54          HD11      ILE  54  -4.833   4.066   5.752
  919   HD12  ILE  54          HD12      ILE  54  -4.064   5.652   5.916
  920   HD13  ILE  54          HD13      ILE  54  -5.056   5.010   7.226
  921    H    LEU  55           H        LEU  55   0.899   4.308   5.422
  922    HA   LEU  55           HA       LEU  55   1.611   2.562   3.363
  923    HB2  LEU  55           HB2      LEU  55   3.341   4.698   4.660
  924    HB3  LEU  55           HB3      LEU  55   3.598   4.010   3.061
  925    HG   LEU  55           HG       LEU  55   1.183   5.678   3.873
  926   HD11  LEU  55          HD11      LEU  55   2.161   7.460   2.492
  927   HD12  LEU  55          HD12      LEU  55   3.597   6.470   2.214
  928   HD13  LEU  55          HD13      LEU  55   3.212   7.039   3.842
  929   HD21  LEU  55          HD21      LEU  55   0.640   5.711   1.471
  930   HD22  LEU  55          HD22      LEU  55   0.627   4.068   2.101
  931   HD23  LEU  55          HD23      LEU  55   1.994   4.627   1.135
  932    H    GLN  56           H        GLN  56   3.171   3.055   6.516
  933    HA   GLN  56           HA       GLN  56   5.380   1.327   6.241
  934    HB2  GLN  56           HB2      GLN  56   3.889   2.137   8.773
  935    HB3  GLN  56           HB3      GLN  56   5.518   1.457   8.716
  936    HG2  GLN  56           HG2      GLN  56   6.331   3.430   7.517
  937    HG3  GLN  56           HG3      GLN  56   4.702   4.104   7.471
  938   HE21  GLN  56          HE21      GLN  56   7.121   5.251   8.619
  939   HE22  GLN  56          HE22      GLN  56   6.778   5.541  10.283
  940    H    ARG  57           H        ARG  57   2.114   0.756   7.534
  941    HA   ARG  57           HA       ARG  57   2.478  -1.990   8.282
  942    HB2  ARG  57           HB2      ARG  57  -0.027  -0.332   7.816
  943    HB3  ARG  57           HB3      ARG  57  -0.069  -1.987   8.412
  944    HG2  ARG  57           HG2      ARG  57   1.540   0.108   9.879
  945    HG3  ARG  57           HG3      ARG  57  -0.202   0.019  10.094
  946    HD2  ARG  57           HD2      ARG  57   0.896  -1.194  11.874
  947    HD3  ARG  57           HD3      ARG  57   0.012  -2.324  10.852
  948    HE   ARG  57           HE       ARG  57   2.156  -2.971   9.866
  949   HH11  ARG  57          HH11      ARG  57   2.349  -1.305  12.901
  950   HH12  ARG  57          HH12      ARG  57   3.857  -2.042  13.312
  951   HH21  ARG  57          HH21      ARG  57   4.061  -3.890  10.433
  952   HH22  ARG  57          HH22      ARG  57   4.810  -3.474  11.935
  953    H    VAL  58           H        VAL  58   1.456  -0.405   5.295
  954    HA   VAL  58           HA       VAL  58   0.512  -2.732   3.931
  955    HB   VAL  58           HB       VAL  58   1.528  -0.056   2.854
  956   HG11  VAL  58          HG11      VAL  58   0.622  -0.715   0.637
  957   HG12  VAL  58          HG12      VAL  58   0.304  -2.340   1.254
  958   HG13  VAL  58          HG13      VAL  58   1.961  -1.746   1.137
  959   HG21  VAL  58          HG21      VAL  58  -0.634   0.055   4.050
  960   HG22  VAL  58          HG22      VAL  58  -1.298  -1.201   3.008
  961   HG23  VAL  58          HG23      VAL  58  -0.861   0.372   2.330
  962    H    ILE  59           H        ILE  59   3.652  -0.978   3.773
  963    HA   ILE  59           HA       ILE  59   5.069  -2.738   2.118
  964    HB   ILE  59           HB       ILE  59   6.105  -0.926   4.348
  965   HG12  ILE  59          HG12      ILE  59   6.000  -0.497   1.320
  966   HG13  ILE  59          HG13      ILE  59   4.924   0.252   2.494
  967   HG21  ILE  59          HG21      ILE  59   7.813  -2.632   3.893
  968   HG22  ILE  59          HG22      ILE  59   8.343  -1.069   3.276
  969   HG23  ILE  59          HG23      ILE  59   7.727  -2.293   2.163
  970   HD11  ILE  59          HD11      ILE  59   6.833   1.456   3.457
  971   HD12  ILE  59          HD12      ILE  59   6.612   1.801   1.742
  972   HD13  ILE  59          HD13      ILE  59   7.897   0.711   2.259
  973    H    ASP  60           H        ASP  60   4.894  -2.673   5.695
  974    HA   ASP  60           HA       ASP  60   6.527  -4.854   6.315
  975    HB2  ASP  60           HB2      ASP  60   5.714  -3.250   7.994
  976    HB3  ASP  60           HB3      ASP  60   4.062  -3.814   7.768
  977    H    TYR  61           H        TYR  61   3.036  -4.792   5.647
  978    HA   TYR  61           HA       TYR  61   2.409  -7.519   5.983
  979    HB2  TYR  61           HB2      TYR  61   0.654  -5.857   5.872
  980    HB3  TYR  61           HB3      TYR  61   1.158  -5.344   4.267
  981    HD1  TYR  61           HD1      TYR  61  -0.217  -8.300   6.114
  982    HD2  TYR  61           HD2      TYR  61   0.096  -6.290   2.343
  983    HE1  TYR  61           HE1      TYR  61  -1.845  -9.858   5.152
  984    HE2  TYR  61           HE2      TYR  61  -1.558  -7.848   1.397
  985    HH   TYR  61           HH       TYR  61  -2.411 -10.138   1.833
  986    H    ILE  62           H        ILE  62   3.375  -5.724   3.058
  987    HA   ILE  62           HA       ILE  62   3.133  -7.872   1.225
  988    HB   ILE  62           HB       ILE  62   4.764  -5.295   1.054
  989   HG12  ILE  62          HG12      ILE  62   2.062  -6.024  -0.200
  990   HG13  ILE  62          HG13      ILE  62   2.278  -4.982   1.200
  991   HG21  ILE  62          HG21      ILE  62   4.883  -5.689  -1.392
  992   HG22  ILE  62          HG22      ILE  62   4.148  -7.277  -1.161
  993   HG23  ILE  62          HG23      ILE  62   5.741  -6.931  -0.482
  994   HD11  ILE  62          HD11      ILE  62   3.241  -4.404  -1.605
  995   HD12  ILE  62          HD12      ILE  62   3.473  -3.358  -0.201
  996   HD13  ILE  62          HD13      ILE  62   1.847  -3.684  -0.798
  997    H    LEU  63           H        LEU  63   5.905  -6.651   3.111
  998    HA   LEU  63           HA       LEU  63   7.876  -8.480   2.174
  999    HB2  LEU  63           HB2      LEU  63   7.679  -6.987   4.817
 1000    HB3  LEU  63           HB3      LEU  63   9.111  -7.847   4.268
 1001    HG   LEU  63           HG       LEU  63   7.891  -5.429   2.876
 1002   HD11  LEU  63          HD11      LEU  63  10.379  -5.597   4.601
 1003   HD12  LEU  63          HD12      LEU  63   8.859  -4.812   5.036
 1004   HD13  LEU  63          HD13      LEU  63   9.827  -4.174   3.710
 1005   HD21  LEU  63          HD21      LEU  63  10.483  -6.904   2.284
 1006   HD22  LEU  63          HD22      LEU  63   9.936  -5.416   1.504
 1007   HD23  LEU  63          HD23      LEU  63   9.028  -6.909   1.281
 1008    H    ASP  64           H        ASP  64   5.441  -8.670   4.724
 1009    HA   ASP  64           HA       ASP  64   6.252 -11.092   5.962
 1010    HB2  ASP  64           HB2      ASP  64   4.638  -9.534   6.994
 1011    HB3  ASP  64           HB3      ASP  64   3.489  -9.820   5.695
 1012    H    LEU  65           H        LEU  65   4.363 -10.425   3.057
 1013    HA   LEU  65           HA       LEU  65   3.579 -13.191   2.621
 1014    HB2  LEU  65           HB2      LEU  65   3.313 -10.773   0.800
 1015    HB3  LEU  65           HB3      LEU  65   2.588 -12.349   0.515
 1016    HG   LEU  65           HG       LEU  65   1.858 -10.346   2.679
 1017   HD11  LEU  65          HD11      LEU  65   0.859  -9.878   0.524
 1018   HD12  LEU  65          HD12      LEU  65  -0.379 -10.446   1.639
 1019   HD13  LEU  65          HD13      LEU  65   0.253 -11.533   0.402
 1020   HD21  LEU  65          HD21      LEU  65   0.842 -13.200   2.438
 1021   HD22  LEU  65          HD22      LEU  65   0.198 -11.963   3.520
 1022   HD23  LEU  65          HD23      LEU  65   1.843 -12.546   3.740
 1023    H    GLN  66           H        GLN  66   5.976 -10.959   1.263
 1024    HA   GLN  66           HA       GLN  66   6.814 -12.746  -0.854
 1025    HB2  GLN  66           HB2      GLN  66   7.983 -10.105   0.116
 1026    HB3  GLN  66           HB3      GLN  66   8.594 -10.995  -1.274
 1027    HG2  GLN  66           HG2      GLN  66   6.430 -10.704  -2.422
 1028    HG3  GLN  66           HG3      GLN  66   5.799  -9.827  -1.027
 1029   HE21  GLN  66          HE21      GLN  66   6.091  -8.890  -3.789
 1030   HE22  GLN  66          HE22      GLN  66   7.101  -7.494  -3.715
 1031    H    VAL  67           H        VAL  67   8.470 -11.367   2.010
 1032    HA   VAL  67           HA       VAL  67  10.722 -13.188   1.762
 1033    HB   VAL  67           HB       VAL  67  10.169 -11.117   3.936
 1034   HG11  VAL  67          HG11      VAL  67  11.806 -12.787   4.673
 1035   HG12  VAL  67          HG12      VAL  67  12.607 -11.241   4.397
 1036   HG13  VAL  67          HG13      VAL  67  12.764 -12.538   3.211
 1037   HG21  VAL  67          HG21      VAL  67  10.262 -10.055   1.709
 1038   HG22  VAL  67          HG22      VAL  67  11.820 -10.818   1.387
 1039   HG23  VAL  67          HG23      VAL  67  11.677  -9.611   2.667
 1040    H    VAL  68           H        VAL  68   9.676 -15.153   2.036
 1041    HA   VAL  68           HA       VAL  68   9.216 -15.964   4.846
 1042    HB   VAL  68           HB       VAL  68   7.581 -17.762   3.832
 1043   HG11  VAL  68          HG11      VAL  68   6.845 -15.983   5.367
 1044   HG12  VAL  68          HG12      VAL  68   5.634 -16.258   4.117
 1045   HG13  VAL  68          HG13      VAL  68   6.696 -14.851   4.021
 1046   HG21  VAL  68          HG21      VAL  68   7.392 -15.666   1.619
 1047   HG22  VAL  68          HG22      VAL  68   6.332 -17.066   1.812
 1048   HG23  VAL  68          HG23      VAL  68   8.038 -17.299   1.436
  Start of MODEL   16
    1    H1   MET   1           H1       MET   1 -43.629  44.782  20.504
    2    H2   MET   1           H2       MET   1 -42.319  43.718  20.558
    3    H3   MET   1           H3       MET   1 -43.592  43.439  19.487
    4    HA   MET   1           HA       MET   1 -41.649  44.311  18.368
    5    HB2  MET   1           HB2      MET   1 -44.097  46.130  18.406
    6    HB3  MET   1           HB3      MET   1 -42.843  46.197  17.172
    7    HG2  MET   1           HG2      MET   1 -43.377  43.853  16.539
    8    HG3  MET   1           HG3      MET   1 -44.691  43.856  17.722
    9    HE1  MET   1           HE1      MET   1 -46.513  44.038  14.200
   10    HE2  MET   1           HE2      MET   1 -46.358  43.107  15.688
   11    HE3  MET   1           HE3      MET   1 -45.009  43.185  14.552
   12    H    GLY   2           H        GLY   2 -39.803  45.079  19.297
   13    HA2  GLY   2           HA2      GLY   2 -39.767  47.629  20.781
   14    HA3  GLY   2           HA3      GLY   2 -38.447  46.481  20.621
   15    H    HIS   3           H        HIS   3 -38.899  49.510  19.983
   16    HA   HIS   3           HA       HIS   3 -38.227  49.702  17.167
   17    HB2  HIS   3           HB2      HIS   3 -38.332  51.814  19.365
   18    HB3  HIS   3           HB3      HIS   3 -38.010  52.168  17.669
   19    HD2  HIS   3           HD2      HIS   3 -40.233  52.168  15.991
   20    HE1  HIS   3           HE1      HIS   3 -43.045  51.333  19.040
   21    HE2  HIS   3           HE2      HIS   3 -42.733  52.160  16.674
   22    H    HIS   4           H        HIS   4 -36.378  48.337  17.178
   23    HA   HIS   4           HA       HIS   4 -33.857  49.795  17.694
   24    HB2  HIS   4           HB2      HIS   4 -32.736  47.671  18.341
   25    HB3  HIS   4           HB3      HIS   4 -34.032  48.077  19.460
   26    HD2  HIS   4           HD2      HIS   4 -36.077  46.223  19.645
   27    HE1  HIS   4           HE1      HIS   4 -34.489  43.537  16.787
   28    HE2  HIS   4           HE2      HIS   4 -36.152  43.827  18.671
   29    H    HIS   5           H        HIS   5 -32.021  48.712  16.401
   30    HA   HIS   5           HA       HIS   5 -32.866  48.583  13.608
   31    HB2  HIS   5           HB2      HIS   5 -30.907  49.988  14.557
   32    HB3  HIS   5           HB3      HIS   5 -30.012  48.480  14.677
   33    HD2  HIS   5           HD2      HIS   5 -32.163  49.229  11.477
   34    HE1  HIS   5           HE1      HIS   5 -28.060  49.660  10.538
   35    HE2  HIS   5           HE2      HIS   5 -30.427  49.845   9.660
   36    H    HIS   6           H        HIS   6 -33.774  46.556  13.284
   37    HA   HIS   6           HA       HIS   6 -32.743  44.138  14.435
   38    HB2  HIS   6           HB2      HIS   6 -35.147  44.394  14.081
   39    HB3  HIS   6           HB3      HIS   6 -34.919  44.578  12.348
   40    HD2  HIS   6           HD2      HIS   6 -35.185  42.260  10.960
   41    HE1  HIS   6           HE1      HIS   6 -34.678  39.597  14.201
   42    HE2  HIS   6           HE2      HIS   6 -35.033  39.789  11.710
   43    H    HIS   7           H        HIS   7 -30.632  43.865  13.714
   44    HA   HIS   7           HA       HIS   7 -30.411  42.646  11.005
   45    HB2  HIS   7           HB2      HIS   7 -28.338  44.304  12.510
   46    HB3  HIS   7           HB3      HIS   7 -27.891  43.215  11.202
   47    HD2  HIS   7           HD2      HIS   7 -30.264  46.364  11.606
   48    HE1  HIS   7           HE1      HIS   7 -28.635  46.235   7.709
   49    HE2  HIS   7           HE2      HIS   7 -30.249  47.420   9.247
   50    H    HIS   8           H        HIS   8 -30.828  40.566  11.638
   51    HA   HIS   8           HA       HIS   8 -29.649  39.252  13.882
   52    HB2  HIS   8           HB2      HIS   8 -31.764  38.478  12.798
   53    HB3  HIS   8           HB3      HIS   8 -30.860  38.041  11.354
   54    HD2  HIS   8           HD2      HIS   8 -31.520  36.709  14.970
   55    HE1  HIS   8           HE1      HIS   8 -29.249  33.840  12.849
   56    HE2  HIS   8           HE2      HIS   8 -30.365  34.392  15.041
   57    H    SER   9           H        SER   9 -27.441  39.363  13.919
   58    HA   SER   9           HA       SER   9 -25.772  38.810  11.598
   59    HB2  SER   9           HB2      SER   9 -24.978  39.309  14.503
   60    HB3  SER   9           HB3      SER   9 -23.879  39.276  13.122
   61    HG   SER   9           HG       SER   9 -26.051  41.090  13.450
   62    H    HIS  10           H        HIS  10 -24.920  36.870  11.070
   63    HA   HIS  10           HA       HIS  10 -24.529  34.708  12.985
   64    HB2  HIS  10           HB2      HIS  10 -25.939  33.084  11.628
   65    HB3  HIS  10           HB3      HIS  10 -26.868  34.311  12.477
   66    HD1  HIS  10           HD1      HIS  10 -28.038  36.139  11.021
   67    HD2  HIS  10           HD2      HIS  10 -26.143  33.183   8.805
   68    HE1  HIS  10           HE1      HIS  10 -28.843  36.436   8.676
   69    HE2  HIS  10           HE2      HIS  10 -27.560  34.752   7.337
   70    H    MET  11           H        MET  11 -22.676  33.689  12.457
   71    HA   MET  11           HA       MET  11 -21.846  33.427   9.621
   72    HB2  MET  11           HB2      MET  11 -19.985  34.176  11.929
   73    HB3  MET  11           HB3      MET  11 -19.465  33.805  10.289
   74    HG2  MET  11           HG2      MET  11 -20.778  35.772   9.481
   75    HG3  MET  11           HG3      MET  11 -21.137  36.175  11.162
   76    HE1  MET  11           HE1      MET  11 -20.086  38.639  10.895
   77    HE2  MET  11           HE2      MET  11 -19.793  38.285   9.191
   78    HE3  MET  11           HE3      MET  11 -18.495  38.929  10.194
   79    H    GLY  12           H        GLY  12 -20.069  31.713   9.384
   80    HA2  GLY  12           HA2      GLY  12 -19.794  29.658  11.389
   81    HA3  GLY  12           HA3      GLY  12 -20.897  29.184  10.102
   82    H    GLY  13           H        GLY  13 -17.733  29.081  11.090
   83    HA2  GLY  13           HA2      GLY  13 -16.680  27.744   8.869
   84    HA3  GLY  13           HA3      GLY  13 -16.224  29.438   8.709
   85    H    GLY  14           H        GLY  14 -16.443  27.178  11.478
   86    HA2  GLY  14           HA2      GLY  14 -13.947  28.137  12.638
   87    HA3  GLY  14           HA3      GLY  14 -15.033  26.931  13.312
   88    H    LYS  15           H        LYS  15 -12.360  26.516  13.504
   89    HA   LYS  15           HA       LYS  15 -11.861  24.135  11.870
   90    HB2  LYS  15           HB2      LYS  15 -10.891  26.038  10.574
   91    HB3  LYS  15           HB3      LYS  15  -9.894  26.472  11.953
   92    HG2  LYS  15           HG2      LYS  15  -8.648  24.366  11.750
   93    HG3  LYS  15           HG3      LYS  15  -9.697  23.853  10.424
   94    HD2  LYS  15           HD2      LYS  15  -8.898  25.755   9.045
   95    HD3  LYS  15           HD3      LYS  15  -7.868  26.292  10.373
   96    HE2  LYS  15           HE2      LYS  15  -7.595  23.637   8.925
   97    HE3  LYS  15           HE3      LYS  15  -6.609  25.066   8.622
   98    HZ1  LYS  15           HZ1      LYS  15  -5.815  24.963  10.894
   99    HZ2  LYS  15           HZ2      LYS  15  -5.488  23.518  10.079
  100    HZ3  LYS  15           HZ3      LYS  15  -6.758  23.591  11.192
  101    H    GLY  16           H        GLY  16 -10.307  22.696  12.806
  102    HA2  GLY  16           HA2      GLY  16 -10.125  22.788  15.689
  103    HA3  GLY  16           HA3      GLY  16  -9.554  21.507  14.631
  104    HA   PRO  17           HA       PRO  17  -5.780  23.775  16.265
  105    HB2  PRO  17           HB2      PRO  17  -4.523  21.744  17.521
  106    HB3  PRO  17           HB3      PRO  17  -5.908  22.556  18.265
  107    HG2  PRO  17           HG2      PRO  17  -5.825  19.933  16.781
  108    HG3  PRO  17           HG3      PRO  17  -6.649  20.331  18.305
  109    HD2  PRO  17           HD2      PRO  17  -7.909  20.280  15.833
  110    HD3  PRO  17           HD3      PRO  17  -8.485  21.241  17.212
  111    H    ALA  18           H        ALA  18  -3.503  23.556  15.677
  112    HA   ALA  18           HA       ALA  18  -2.526  21.545  13.866
  113    HB1  ALA  18           HB1      ALA  18  -3.919  22.840  12.278
  114    HB2  ALA  18           HB2      ALA  18  -2.207  22.991  11.882
  115    HB3  ALA  18           HB3      ALA  18  -3.046  24.311  12.702
  116    H    ALA  19           H        ALA  19  -0.574  21.328  14.868
  117    HA   ALA  19           HA       ALA  19   1.199  23.670  15.184
  118    HB1  ALA  19           HB1      ALA  19   0.651  21.696  17.435
  119    HB2  ALA  19           HB2      ALA  19   0.092  23.368  17.373
  120    HB3  ALA  19           HB3      ALA  19   1.817  23.022  17.481
  121    H    GLU  20           H        GLU  20   3.308  23.260  14.800
  122    HA   GLU  20           HA       GLU  20   5.250  22.342  14.207
  123    HB2  GLU  20           HB2      GLU  20   4.195  19.841  15.577
  124    HB3  GLU  20           HB3      GLU  20   5.843  20.006  14.979
  125    HG2  GLU  20           HG2      GLU  20   6.159  21.963  16.522
  126    HG3  GLU  20           HG3      GLU  20   4.549  21.660  17.171
  127    H    GLU  21           H        GLU  21   6.130  21.620  12.373
  128    HA   GLU  21           HA       GLU  21   4.434  20.265  10.382
  129    HB2  GLU  21           HB2      GLU  21   7.030  21.801  10.051
  130    HB3  GLU  21           HB3      GLU  21   6.084  21.130   8.731
  131    HG2  GLU  21           HG2      GLU  21   4.221  22.644   9.245
  132    HG3  GLU  21           HG3      GLU  21   5.090  23.275  10.642
  133    HA   PRO  22           HA       PRO  22   7.223  16.712  11.157
  134    HB2  PRO  22           HB2      PRO  22   5.546  14.739  10.379
  135    HB3  PRO  22           HB3      PRO  22   5.271  15.638  11.876
  136    HG2  PRO  22           HG2      PRO  22   3.887  15.902   9.225
  137    HG3  PRO  22           HG3      PRO  22   3.213  16.039  10.862
  138    HD2  PRO  22           HD2      PRO  22   3.979  18.197   9.191
  139    HD3  PRO  22           HD3      PRO  22   3.652  18.308  10.932
  140    H    LEU  23           H        LEU  23   8.841  16.017   9.852
  141    HA   LEU  23           HA       LEU  23  10.031  15.111   8.156
  142    HB2  LEU  23           HB2      LEU  23   7.338  14.658   6.827
  143    HB3  LEU  23           HB3      LEU  23   8.850  13.973   6.257
  144    HG   LEU  23           HG       LEU  23   7.634  13.368   8.986
  145   HD11  LEU  23          HD11      LEU  23   7.517  11.667   6.482
  146   HD12  LEU  23          HD12      LEU  23   6.162  12.506   7.239
  147   HD13  LEU  23          HD13      LEU  23   6.963  11.187   8.090
  148   HD21  LEU  23          HD21      LEU  23   9.269  11.530   9.086
  149   HD22  LEU  23          HD22      LEU  23  10.082  13.083   8.932
  150   HD23  LEU  23          HD23      LEU  23   9.941  12.023   7.529
  151    H    SER  24           H        SER  24  11.286  16.020   6.559
  152    HA   SER  24           HA       SER  24  10.234  18.059   4.742
  153    HB2  SER  24           HB2      SER  24  10.708  19.371   6.801
  154    HB3  SER  24           HB3      SER  24  12.371  18.784   6.797
  155    HG   SER  24           HG       SER  24  11.146  20.388   4.781
  156    H    LEU  25           H        LEU  25  13.335  16.745   5.998
  157    HA   LEU  25           HA       LEU  25  14.664  16.991   3.434
  158    HB2  LEU  25           HB2      LEU  25  15.577  15.675   6.028
  159    HB3  LEU  25           HB3      LEU  25  16.572  15.792   4.592
  160    HG   LEU  25           HG       LEU  25  17.335  17.500   6.069
  161   HD11  LEU  25          HD11      LEU  25  17.206  18.219   3.739
  162   HD12  LEU  25          HD12      LEU  25  16.976  19.575   4.836
  163   HD13  LEU  25          HD13      LEU  25  15.587  18.873   4.005
  164   HD21  LEU  25          HD21      LEU  25  15.911  19.220   7.105
  165   HD22  LEU  25          HD22      LEU  25  15.441  17.602   7.616
  166   HD23  LEU  25          HD23      LEU  25  14.473  18.458   6.416
  167    H    LEU  26           H        LEU  26  14.286  14.102   5.533
  168    HA   LEU  26           HA       LEU  26  13.571  12.463   3.163
  169    HB2  LEU  26           HB2      LEU  26  14.708  11.636   5.866
  170    HB3  LEU  26           HB3      LEU  26  14.114  10.490   4.676
  171    HG   LEU  26           HG       LEU  26  16.485  12.364   4.296
  172   HD11  LEU  26          HD11      LEU  26  17.852  10.315   4.313
  173   HD12  LEU  26          HD12      LEU  26  16.418   9.351   4.673
  174   HD13  LEU  26          HD13      LEU  26  17.002  10.539   5.843
  175   HD21  LEU  26          HD21      LEU  26  15.332  12.020   2.153
  176   HD22  LEU  26          HD22      LEU  26  15.367  10.269   2.388
  177   HD23  LEU  26          HD23      LEU  26  16.873  11.162   2.166
  178    H    ASP  27           H        ASP  27  11.396  12.962   3.076
  179    HA   ASP  27           HA       ASP  27   9.557  12.676   5.232
  180    HB2  ASP  27           HB2      ASP  27   9.118  12.726   2.213
  181    HB3  ASP  27           HB3      ASP  27   7.823  12.757   3.407
  182    H    ASP  28           H        ASP  28   9.257  10.781   6.160
  183    HA   ASP  28           HA       ASP  28   9.816   8.226   5.305
  184    HB2  ASP  28           HB2      ASP  28   9.237   8.995   7.665
  185    HB3  ASP  28           HB3      ASP  28   7.528   8.886   7.220
  186    H    MET  29           H        MET  29   6.738   9.975   4.956
  187    HA   MET  29           HA       MET  29   5.191   8.004   3.687
  188    HB2  MET  29           HB2      MET  29   4.001   9.900   4.404
  189    HB3  MET  29           HB3      MET  29   5.139  11.026   3.686
  190    HG2  MET  29           HG2      MET  29   4.220  10.742   1.517
  191    HG3  MET  29           HG3      MET  29   3.367   9.271   1.975
  192    HE1  MET  29           HE1      MET  29   1.884   9.821   4.585
  193    HE2  MET  29           HE2      MET  29   1.096   9.171   3.142
  194    HE3  MET  29           HE3      MET  29   0.366  10.522   4.014
  195    H    ASN  30           H        ASN  30   7.377  10.442   2.224
  196    HA   ASN  30           HA       ASN  30   6.854   9.846  -0.505
  197    HB2  ASN  30           HB2      ASN  30   7.924  11.959   0.355
  198    HB3  ASN  30           HB3      ASN  30   9.387  11.052   0.715
  199   HD21  ASN  30          HD21      ASN  30  10.677  10.316  -1.049
  200   HD22  ASN  30          HD22      ASN  30  10.497  10.981  -2.631
  201    H    HIS  31           H        HIS  31   9.364   8.701   1.743
  202    HA   HIS  31           HA       HIS  31  10.779   7.017  -0.066
  203    HB2  HIS  31           HB2      HIS  31  11.772   7.899   2.032
  204    HB3  HIS  31           HB3      HIS  31  10.658   6.923   2.983
  205    HD2  HIS  31           HD2      HIS  31  13.892   6.479   0.803
  206    HE1  HIS  31           HE1      HIS  31  13.066   2.848   2.810
  207    HE2  HIS  31           HE2      HIS  31  14.609   4.019   1.190
  208    H    CYS  32           H        CYS  32   8.118   6.430   2.199
  209    HA   CYS  32           HA       CYS  32   7.902   3.631   1.904
  210    HB2  CYS  32           HB2      CYS  32   5.870   5.695   2.796
  211    HB3  CYS  32           HB3      CYS  32   5.494   3.973   2.726
  212    HG   CYS  32           HG       CYS  32   6.885   5.641   5.144
  213    H    TYR  33           H        TYR  33   6.376   6.301   0.132
  214    HA   TYR  33           HA       TYR  33   4.775   4.796  -1.635
  215    HB2  TYR  33           HB2      TYR  33   5.860   7.597  -1.614
  216    HB3  TYR  33           HB3      TYR  33   5.269   6.997  -3.159
  217    HD1  TYR  33           HD1      TYR  33   2.927   5.559  -2.740
  218    HD2  TYR  33           HD2      TYR  33   4.218   8.974  -0.517
  219    HE1  TYR  33           HE1      TYR  33   0.612   6.083  -2.214
  220    HE2  TYR  33           HE2      TYR  33   1.885   9.496   0.022
  221    HH   TYR  33           HH       TYR  33  -0.323   9.056  -0.754
  222    H    SER  34           H        SER  34   8.136   5.924  -1.961
  223    HA   SER  34           HA       SER  34   8.752   4.916  -4.501
  224    HB2  SER  34           HB2      SER  34  10.575   5.165  -2.066
  225    HB3  SER  34           HB3      SER  34  11.126   4.950  -3.728
  226    HG   SER  34           HG       SER  34  10.013   6.941  -4.215
  227    H    ARG  35           H        ARG  35   9.051   3.342  -1.302
  228    HA   ARG  35           HA       ARG  35  10.033   0.845  -2.182
  229    HB2  ARG  35           HB2      ARG  35  10.316   1.743   0.092
  230    HB3  ARG  35           HB3      ARG  35   8.585   1.582   0.388
  231    HG2  ARG  35           HG2      ARG  35   8.709  -0.680   0.719
  232    HG3  ARG  35           HG3      ARG  35   9.948  -0.907  -0.509
  233    HD2  ARG  35           HD2      ARG  35  10.858  -1.501   1.620
  234    HD3  ARG  35           HD3      ARG  35  11.635  -0.016   1.096
  235    HE   ARG  35           HE       ARG  35   9.751   1.005   2.642
  236   HH11  ARG  35          HH11      ARG  35  11.671  -1.783   3.301
  237   HH12  ARG  35          HH12      ARG  35  11.683  -1.498   5.004
  238   HH21  ARG  35          HH21      ARG  35   9.788   1.347   4.832
  239   HH22  ARG  35          HH22      ARG  35  10.625   0.236   5.855
  240    H    LEU  36           H        LEU  36   6.706   2.037  -1.692
  241    HA   LEU  36           HA       LEU  36   5.281  -0.376  -1.953
  242    HB2  LEU  36           HB2      LEU  36   4.500   2.456  -2.730
  243    HB3  LEU  36           HB3      LEU  36   3.391   1.106  -2.858
  244    HG   LEU  36           HG       LEU  36   4.555   2.253  -0.298
  245   HD11  LEU  36          HD11      LEU  36   2.230   2.829   0.231
  246   HD12  LEU  36          HD12      LEU  36   1.713   2.210  -1.338
  247   HD13  LEU  36          HD13      LEU  36   2.776   3.617  -1.248
  248   HD21  LEU  36          HD21      LEU  36   4.404  -0.185  -0.050
  249   HD22  LEU  36          HD22      LEU  36   2.728  -0.159  -0.602
  250   HD23  LEU  36          HD23      LEU  36   3.168   0.609   0.925
  251    H    ARG  37           H        ARG  37   6.106   2.069  -4.404
  252    HA   ARG  37           HA       ARG  37   5.018   0.846  -6.673
  253    HB2  ARG  37           HB2      ARG  37   6.086   3.272  -6.183
  254    HB3  ARG  37           HB3      ARG  37   7.504   2.559  -6.921
  255    HG2  ARG  37           HG2      ARG  37   4.892   2.420  -8.420
  256    HG3  ARG  37           HG3      ARG  37   5.722   3.966  -8.324
  257    HD2  ARG  37           HD2      ARG  37   6.377   2.973 -10.379
  258    HD3  ARG  37           HD3      ARG  37   7.763   2.822  -9.297
  259    HE   ARG  37           HE       ARG  37   6.160   0.488  -9.178
  260   HH11  ARG  37          HH11      ARG  37   8.387   2.024 -11.321
  261   HH12  ARG  37          HH12      ARG  37   8.881   0.531 -12.028
  262   HH21  ARG  37          HH21      ARG  37   6.822  -1.395 -10.065
  263   HH22  ARG  37          HH22      ARG  37   8.002  -1.387 -11.328
  264    H    GLU  38           H        GLU  38   8.132   0.392  -5.110
  265    HA   GLU  38           HA       GLU  38   9.400  -1.219  -7.112
  266    HB2  GLU  38           HB2      GLU  38   9.960  -0.835  -4.145
  267    HB3  GLU  38           HB3      GLU  38  10.957  -1.861  -5.179
  268    HG2  GLU  38           HG2      GLU  38  11.570   0.042  -6.574
  269    HG3  GLU  38           HG3      GLU  38  10.481   1.094  -5.672
  270    H    LEU  39           H        LEU  39   7.491  -1.956  -4.217
  271    HA   LEU  39           HA       LEU  39   7.651  -4.818  -4.418
  272    HB2  LEU  39           HB2      LEU  39   5.786  -2.974  -2.888
  273    HB3  LEU  39           HB3      LEU  39   5.711  -4.724  -2.756
  274    HG   LEU  39           HG       LEU  39   8.203  -3.111  -2.055
  275   HD11  LEU  39          HD11      LEU  39   6.394  -2.456  -0.529
  276   HD12  LEU  39          HD12      LEU  39   7.617  -3.405   0.314
  277   HD13  LEU  39          HD13      LEU  39   6.084  -4.151  -0.146
  278   HD21  LEU  39          HD21      LEU  39   8.916  -5.186  -0.913
  279   HD22  LEU  39          HD22      LEU  39   8.666  -5.456  -2.634
  280   HD23  LEU  39          HD23      LEU  39   7.455  -6.007  -1.474
  281    H    VAL  40           H        VAL  40   5.860  -2.498  -6.167
  282    HA   VAL  40           HA       VAL  40   3.762  -4.405  -7.004
  283    HB   VAL  40           HB       VAL  40   3.991  -1.416  -7.602
  284   HG11  VAL  40          HG11      VAL  40   2.679  -2.590  -9.323
  285   HG12  VAL  40          HG12      VAL  40   1.632  -1.574  -8.340
  286   HG13  VAL  40          HG13      VAL  40   1.658  -3.318  -8.081
  287   HG21  VAL  40          HG21      VAL  40   2.247  -2.839  -5.546
  288   HG22  VAL  40          HG22      VAL  40   2.200  -1.112  -5.925
  289   HG23  VAL  40          HG23      VAL  40   3.650  -1.816  -5.208
  290    HA   PRO  41           HA       PRO  41   6.159  -4.786 -10.956
  291    HB2  PRO  41           HB2      PRO  41   4.611  -7.260 -11.397
  292    HB3  PRO  41           HB3      PRO  41   6.352  -7.075 -11.165
  293    HG2  PRO  41           HG2      PRO  41   4.727  -8.258  -9.298
  294    HG3  PRO  41           HG3      PRO  41   6.221  -7.394  -8.878
  295    HD2  PRO  41           HD2      PRO  41   3.366  -6.414  -8.742
  296    HD3  PRO  41           HD3      PRO  41   4.680  -6.234  -7.553
  297    H    GLY  42           H        GLY  42   2.760  -4.626 -10.228
  298    HA2  GLY  42           HA2      GLY  42   1.768  -4.558 -12.968
  299    HA3  GLY  42           HA3      GLY  42   0.836  -4.333 -11.498
  300    H    VAL  43           H        VAL  43   3.593  -2.656 -12.966
  301    HA   VAL  43           HA       VAL  43   2.107  -0.097 -13.047
  302    HB   VAL  43           HB       VAL  43   5.035  -0.585 -12.279
  303   HG11  VAL  43          HG11      VAL  43   3.715   2.106 -12.826
  304   HG12  VAL  43          HG12      VAL  43   5.010   1.360 -13.763
  305   HG13  VAL  43          HG13      VAL  43   5.313   1.882 -12.108
  306   HG21  VAL  43          HG21      VAL  43   3.464  -0.866 -10.411
  307   HG22  VAL  43          HG22      VAL  43   2.766   0.725 -10.715
  308   HG23  VAL  43          HG23      VAL  43   4.439   0.585 -10.171
  309    HA   PRO  44           HA       PRO  44   3.124  -0.405 -17.500
  310    HB2  PRO  44           HB2      PRO  44   2.751   2.582 -17.449
  311    HB3  PRO  44           HB3      PRO  44   1.993   1.371 -18.496
  312    HG2  PRO  44           HG2      PRO  44   0.596   2.499 -16.512
  313    HG3  PRO  44           HG3      PRO  44   0.410   0.763 -16.859
  314    HD2  PRO  44           HD2      PRO  44   2.015   2.106 -14.671
  315    HD3  PRO  44           HD3      PRO  44   0.969   0.671 -14.575
  316    H    ARG  45           H        ARG  45   5.181  -0.606 -18.227
  317    HA   ARG  45           HA       ARG  45   7.470   0.422 -16.980
  318    HB2  ARG  45           HB2      ARG  45   7.358  -1.635 -18.459
  319    HB3  ARG  45           HB3      ARG  45   7.288  -0.577 -19.859
  320    HG2  ARG  45           HG2      ARG  45   9.549  -1.335 -19.682
  321    HG3  ARG  45           HG3      ARG  45   9.553   0.352 -19.162
  322    HD2  ARG  45           HD2      ARG  45   9.520  -0.402 -16.793
  323    HD3  ARG  45           HD3      ARG  45   9.578  -2.081 -17.336
  324    HE   ARG  45           HE       ARG  45  11.728  -0.084 -17.514
  325   HH11  ARG  45          HH11      ARG  45  10.783  -3.373 -18.004
  326   HH12  ARG  45          HH12      ARG  45  12.412  -3.935 -18.085
  327   HH21  ARG  45          HH21      ARG  45  13.809  -0.849 -17.611
  328   HH22  ARG  45          HH22      ARG  45  14.094  -2.537 -17.858
  329    H    GLY  46           H        GLY  46   8.446   2.374 -17.091
  330    HA2  GLY  46           HA2      GLY  46   9.392   4.274 -18.099
  331    HA3  GLY  46           HA3      GLY  46   8.361   4.053 -19.502
  332    H    THR  47           H        THR  47   6.327   3.792 -16.908
  333    HA   THR  47           HA       THR  47   5.420   6.592 -17.141
  334    HB   THR  47           HB       THR  47   3.999   4.169 -15.938
  335    HG1  THR  47           HG1      THR  47   4.206   4.008 -18.189
  336   HG21  THR  47          HG21      THR  47   2.916   6.953 -16.545
  337   HG22  THR  47          HG22      THR  47   3.144   6.269 -14.934
  338   HG23  THR  47          HG23      THR  47   1.948   5.571 -16.028
  339    H    GLN  48           H        GLN  48   5.727   8.029 -15.567
  340    HA   GLN  48           HA       GLN  48   7.192   7.429 -13.180
  341    HB2  GLN  48           HB2      GLN  48   7.450   9.564 -14.434
  342    HB3  GLN  48           HB3      GLN  48   5.798  10.014 -14.034
  343    HG2  GLN  48           HG2      GLN  48   7.278  11.243 -12.601
  344    HG3  GLN  48           HG3      GLN  48   6.453  10.047 -11.609
  345   HE21  GLN  48          HE21      GLN  48   9.515  11.010 -12.966
  346   HE22  GLN  48          HE22      GLN  48  10.489   9.939 -12.025
  347    H    LEU  49           H        LEU  49   3.782   7.859 -13.877
  348    HA   LEU  49           HA       LEU  49   1.856   7.672 -12.727
  349    HB2  LEU  49           HB2      LEU  49   3.610   6.381 -10.605
  350    HB3  LEU  49           HB3      LEU  49   1.866   6.497 -10.461
  351    HG   LEU  49           HG       LEU  49   3.369   4.916 -12.586
  352   HD11  LEU  49          HD11      LEU  49   3.493   3.871 -10.381
  353   HD12  LEU  49          HD12      LEU  49   2.454   2.933 -11.450
  354   HD13  LEU  49          HD13      LEU  49   1.738   3.969 -10.212
  355   HD21  LEU  49          HD21      LEU  49   1.155   4.051 -13.278
  356   HD22  LEU  49          HD22      LEU  49   1.272   5.789 -13.532
  357   HD23  LEU  49          HD23      LEU  49   0.364   5.162 -12.154
  358    H    SER  50           H        SER  50   1.026   8.097 -10.197
  359    HA   SER  50           HA       SER  50   2.020  10.723  -9.272
  360    HB2  SER  50           HB2      SER  50  -0.905   9.972  -9.743
  361    HB3  SER  50           HB3      SER  50  -0.345  11.471  -8.992
  362    HG   SER  50           HG       SER  50   0.063  12.242 -10.881
  363    H    GLN  51           H        GLN  51   0.825  11.269  -7.081
  364    HA   GLN  51           HA       GLN  51   1.611   9.443  -5.102
  365    HB2  GLN  51           HB2      GLN  51  -0.463  11.671  -4.838
  366    HB3  GLN  51           HB3      GLN  51   0.351  10.882  -3.494
  367    HG2  GLN  51           HG2      GLN  51   1.682  12.593  -5.614
  368    HG3  GLN  51           HG3      GLN  51   1.295  13.100  -3.970
  369   HE21  GLN  51          HE21      GLN  51   2.494  12.177  -2.237
  370   HE22  GLN  51          HE22      GLN  51   4.037  11.455  -2.503
  371    H    VAL  52           H        VAL  52  -1.664  10.122  -6.347
  372    HA   VAL  52           HA       VAL  52  -2.996   8.180  -4.707
  373    HB   VAL  52           HB       VAL  52  -4.156   9.246  -7.326
  374   HG11  VAL  52          HG11      VAL  52  -5.464   8.366  -4.714
  375   HG12  VAL  52          HG12      VAL  52  -5.436   7.457  -6.229
  376   HG13  VAL  52          HG13      VAL  52  -6.321   8.978  -6.135
  377   HG21  VAL  52          HG21      VAL  52  -3.356  11.224  -6.164
  378   HG22  VAL  52          HG22      VAL  52  -4.095  10.692  -4.655
  379   HG23  VAL  52          HG23      VAL  52  -5.117  11.153  -6.019
  380    H    GLU  53           H        GLU  53  -1.763   8.176  -8.041
  381    HA   GLU  53           HA       GLU  53  -2.767   5.797  -9.051
  382    HB2  GLU  53           HB2      GLU  53  -0.162   7.260  -9.554
  383    HB3  GLU  53           HB3      GLU  53  -0.506   5.759 -10.395
  384    HG2  GLU  53           HG2      GLU  53  -2.265   8.231 -10.528
  385    HG3  GLU  53           HG3      GLU  53  -1.028   7.810 -11.717
  386    H    ILE  54           H        ILE  54   0.279   6.241  -7.203
  387    HA   ILE  54           HA       ILE  54   1.140   3.570  -7.207
  388    HB   ILE  54           HB       ILE  54   1.657   5.797  -5.196
  389   HG12  ILE  54          HG12      ILE  54   3.380   4.657  -7.463
  390   HG13  ILE  54          HG13      ILE  54   2.536   6.201  -7.489
  391   HG21  ILE  54          HG21      ILE  54   2.019   3.728  -3.972
  392   HG22  ILE  54          HG22      ILE  54   3.591   4.432  -4.350
  393   HG23  ILE  54          HG23      ILE  54   2.997   3.059  -5.288
  394   HD11  ILE  54          HD11      ILE  54   4.833   5.460  -5.681
  395   HD12  ILE  54          HD12      ILE  54   3.975   7.004  -5.668
  396   HD13  ILE  54          HD13      ILE  54   4.894   6.515  -7.094
  397    H    LEU  55           H        LEU  55  -0.892   5.262  -4.755
  398    HA   LEU  55           HA       LEU  55  -1.455   3.186  -3.001
  399    HB2  LEU  55           HB2      LEU  55  -3.352   5.329  -4.037
  400    HB3  LEU  55           HB3      LEU  55  -3.727   4.278  -2.683
  401    HG   LEU  55           HG       LEU  55  -1.450   6.297  -2.742
  402   HD11  LEU  55          HD11      LEU  55  -3.639   7.412  -2.664
  403   HD12  LEU  55          HD12      LEU  55  -2.787   7.594  -1.134
  404   HD13  LEU  55          HD13      LEU  55  -4.106   6.429  -1.271
  405   HD21  LEU  55          HD21      LEU  55  -0.881   4.381  -1.326
  406   HD22  LEU  55          HD22      LEU  55  -2.424   4.512  -0.479
  407   HD23  LEU  55          HD23      LEU  55  -1.221   5.792  -0.324
  408    H    GLN  56           H        GLN  56  -3.170   3.918  -6.051
  409    HA   GLN  56           HA       GLN  56  -5.085   1.849  -5.985
  410    HB2  GLN  56           HB2      GLN  56  -3.852   3.110  -8.469
  411    HB3  GLN  56           HB3      GLN  56  -5.401   2.277  -8.382
  412    HG2  GLN  56           HG2      GLN  56  -6.344   4.064  -7.024
  413    HG3  GLN  56           HG3      GLN  56  -4.768   4.847  -6.905
  414   HE21  GLN  56          HE21      GLN  56  -5.254   6.752  -7.911
  415   HE22  GLN  56          HE22      GLN  56  -5.737   6.884  -9.561
  416    H    ARG  57           H        ARG  57  -1.842   1.952  -7.486
  417    HA   ARG  57           HA       ARG  57  -1.830  -0.539  -8.795
  418    HB2  ARG  57           HB2      ARG  57   0.548   0.968  -7.614
  419    HB3  ARG  57           HB3      ARG  57   0.651  -0.315  -8.810
  420    HG2  ARG  57           HG2      ARG  57  -0.664   2.375  -9.248
  421    HG3  ARG  57           HG3      ARG  57   0.949   1.928  -9.790
  422    HD2  ARG  57           HD2      ARG  57   0.057   0.307 -11.330
  423    HD3  ARG  57           HD3      ARG  57  -1.572   0.491 -10.665
  424    HE   ARG  57           HE       ARG  57  -0.855   3.004 -11.531
  425   HH11  ARG  57          HH11      ARG  57  -1.174  -0.075 -13.066
  426   HH12  ARG  57          HH12      ARG  57  -1.690   0.616 -14.560
  427   HH21  ARG  57          HH21      ARG  57  -1.531   3.863 -13.439
  428   HH22  ARG  57          HH22      ARG  57  -1.877   2.815 -14.773
  429    H    VAL  58           H        VAL  58  -0.961   0.356  -5.488
  430    HA   VAL  58           HA       VAL  58  -0.024  -2.190  -4.615
  431    HB   VAL  58           HB       VAL  58  -1.130   0.168  -3.016
  432   HG11  VAL  58          HG11      VAL  58  -1.302  -1.879  -1.684
  433   HG12  VAL  58          HG12      VAL  58  -0.031  -0.840  -1.045
  434   HG13  VAL  58          HG13      VAL  58   0.394  -2.262  -2.002
  435   HG21  VAL  58          HG21      VAL  58   1.235   0.716  -2.569
  436   HG22  VAL  58          HG22      VAL  58   0.912   0.707  -4.302
  437   HG23  VAL  58          HG23      VAL  58   1.757  -0.651  -3.558
  438    H    ILE  59           H        ILE  59  -3.230  -0.586  -4.425
  439    HA   ILE  59           HA       ILE  59  -4.640  -2.546  -2.983
  440    HB   ILE  59           HB       ILE  59  -5.661  -0.657  -5.155
  441   HG12  ILE  59          HG12      ILE  59  -5.857  -0.335  -2.118
  442   HG13  ILE  59          HG13      ILE  59  -4.598   0.407  -3.095
  443   HG21  ILE  59          HG21      ILE  59  -7.935  -0.978  -4.207
  444   HG22  ILE  59          HG22      ILE  59  -7.302  -2.206  -3.108
  445   HG23  ILE  59          HG23      ILE  59  -7.280  -2.489  -4.848
  446   HD11  ILE  59          HD11      ILE  59  -7.554   0.946  -3.338
  447   HD12  ILE  59          HD12      ILE  59  -6.278   1.705  -4.297
  448   HD13  ILE  59          HD13      ILE  59  -6.358   1.979  -2.557
  449    H    ASP  60           H        ASP  60  -4.317  -2.164  -6.538
  450    HA   ASP  60           HA       ASP  60  -5.627  -4.528  -7.334
  451    HB2  ASP  60           HB2      ASP  60  -3.475  -2.896  -8.743
  452    HB3  ASP  60           HB3      ASP  60  -4.374  -4.199  -9.517
  453    H    TYR  61           H        TYR  61  -2.243  -3.947  -6.482
  454    HA   TYR  61           HA       TYR  61  -1.090  -6.397  -7.219
  455    HB2  TYR  61           HB2      TYR  61   0.330  -4.539  -6.579
  456    HB3  TYR  61           HB3      TYR  61  -0.404  -4.447  -4.982
  457    HD1  TYR  61           HD1      TYR  61   1.618  -6.773  -7.140
  458    HD2  TYR  61           HD2      TYR  61   0.663  -5.554  -3.150
  459    HE1  TYR  61           HE1      TYR  61   3.348  -8.268  -6.272
  460    HE2  TYR  61           HE2      TYR  61   2.410  -7.052  -2.289
  461    HH   TYR  61           HH       TYR  61   4.727  -8.526  -4.333
  462    H    ILE  62           H        ILE  62  -2.592  -5.432  -4.121
  463    HA   ILE  62           HA       ILE  62  -2.211  -7.992  -2.871
  464    HB   ILE  62           HB       ILE  62  -4.093  -5.747  -2.000
  465   HG12  ILE  62          HG12      ILE  62  -1.208  -6.261  -1.085
  466   HG13  ILE  62          HG13      ILE  62  -1.675  -4.998  -2.215
  467   HG21  ILE  62          HG21      ILE  62  -2.918  -8.088  -0.433
  468   HG22  ILE  62          HG22      ILE  62  -4.606  -7.899  -0.913
  469   HG23  ILE  62          HG23      ILE  62  -3.895  -6.788   0.256
  470   HD11  ILE  62          HD11      ILE  62  -3.011  -3.927  -0.447
  471   HD12  ILE  62          HD12      ILE  62  -1.313  -4.092  -0.005
  472   HD13  ILE  62          HD13      ILE  62  -2.509  -5.191   0.682
  473    H    LEU  63           H        LEU  63  -4.939  -6.428  -4.564
  474    HA   LEU  63           HA       LEU  63  -6.933  -8.373  -4.195
  475    HB2  LEU  63           HB2      LEU  63  -6.400  -6.497  -6.528
  476    HB3  LEU  63           HB3      LEU  63  -7.820  -7.528  -6.455
  477    HG   LEU  63           HG       LEU  63  -7.157  -5.334  -4.448
  478   HD11  LEU  63          HD11      LEU  63  -7.756  -4.385  -6.624
  479   HD12  LEU  63          HD12      LEU  63  -9.026  -4.084  -5.443
  480   HD13  LEU  63          HD13      LEU  63  -9.237  -5.345  -6.659
  481   HD21  LEU  63          HD21      LEU  63  -8.422  -7.155  -3.394
  482   HD22  LEU  63          HD22      LEU  63  -9.642  -7.074  -4.666
  483   HD23  LEU  63          HD23      LEU  63  -9.429  -5.718  -3.557
  484    H    ASP  64           H        ASP  64  -4.224  -8.283  -6.459
  485    HA   ASP  64           HA       ASP  64  -4.830 -10.569  -8.017
  486    HB2  ASP  64           HB2      ASP  64  -3.143  -8.884  -8.665
  487    HB3  ASP  64           HB3      ASP  64  -2.146  -9.309  -7.283
  488    H    LEU  65           H        LEU  65  -3.191 -10.178  -4.895
  489    HA   LEU  65           HA       LEU  65  -2.325 -12.930  -4.642
  490    HB2  LEU  65           HB2      LEU  65  -2.448 -10.771  -2.505
  491    HB3  LEU  65           HB3      LEU  65  -1.526 -12.265  -2.426
  492    HG   LEU  65           HG       LEU  65  -1.003  -9.923  -4.292
  493   HD11  LEU  65          HD11      LEU  65   0.644 -10.961  -1.975
  494   HD12  LEU  65          HD12      LEU  65  -0.317  -9.480  -1.988
  495   HD13  LEU  65          HD13      LEU  65   1.082  -9.628  -3.048
  496   HD21  LEU  65          HD21      LEU  65   1.006 -11.147  -5.059
  497   HD22  LEU  65          HD22      LEU  65  -0.481 -11.989  -5.486
  498   HD23  LEU  65          HD23      LEU  65   0.495 -12.562  -4.131
  499    H    GLN  66           H        GLN  66  -5.092 -11.065  -3.565
  500    HA   GLN  66           HA       GLN  66  -6.058 -13.041  -1.652
  501    HB2  GLN  66           HB2      GLN  66  -7.346 -10.454  -2.637
  502    HB3  GLN  66           HB3      GLN  66  -7.985 -11.458  -1.342
  503    HG2  GLN  66           HG2      GLN  66  -5.324 -10.000  -1.293
  504    HG3  GLN  66           HG3      GLN  66  -6.802  -9.457  -0.502
  505   HE21  GLN  66          HE21      GLN  66  -7.513 -10.586   1.371
  506   HE22  GLN  66          HE22      GLN  66  -6.448 -11.609   2.262
  507    H    VAL  67           H        VAL  67  -7.820 -14.361  -1.891
  508    HA   VAL  67           HA       VAL  67  -9.417 -15.679  -2.749
  509    HB   VAL  67           HB       VAL  67 -10.011 -13.343  -4.624
  510   HG11  VAL  67          HG11      VAL  67 -11.053 -15.389  -5.497
  511   HG12  VAL  67          HG12      VAL  67 -12.288 -14.295  -4.878
  512   HG13  VAL  67          HG13      VAL  67 -11.805 -15.705  -3.932
  513   HG21  VAL  67          HG21      VAL  67 -11.771 -12.704  -3.003
  514   HG22  VAL  67          HG22      VAL  67 -10.169 -12.678  -2.264
  515   HG23  VAL  67          HG23      VAL  67 -11.268 -14.018  -1.937
  516    H    VAL  68           H        VAL  68  -8.540 -17.452  -3.683
  517    HA   VAL  68           HA       VAL  68  -7.322 -17.401  -6.347
  518    HB   VAL  68           HB       VAL  68  -7.735 -19.780  -4.464
  519   HG11  VAL  68          HG11      VAL  68  -6.033 -20.933  -5.845
  520   HG12  VAL  68          HG12      VAL  68  -5.970 -19.547  -6.937
  521   HG13  VAL  68          HG13      VAL  68  -7.453 -20.495  -6.799
  522   HG21  VAL  68          HG21      VAL  68  -6.291 -18.071  -3.422
  523   HG22  VAL  68          HG22      VAL  68  -5.244 -18.062  -4.845
  524   HG23  VAL  68          HG23      VAL  68  -5.357 -19.507  -3.837
  525    H1   MET   1           H1       MET   1 -21.145  46.511  -3.451
  526    H2   MET   1           H2       MET   1 -21.210  46.389  -1.769
  527    H3   MET   1           H3       MET   1 -19.912  47.177  -2.508
  528    HA   MET   1           HA       MET   1 -21.510  48.714  -1.518
  529    HB2  MET   1           HB2      MET   1 -21.703  50.217  -3.495
  530    HB3  MET   1           HB3      MET   1 -20.112  49.481  -3.385
  531    HG2  MET   1           HG2      MET   1 -20.705  47.879  -5.142
  532    HG3  MET   1           HG3      MET   1 -22.327  48.571  -5.235
  533    HE1  MET   1           HE1      MET   1 -21.967  48.868  -7.899
  534    HE2  MET   1           HE2      MET   1 -20.314  48.253  -7.794
  535    HE3  MET   1           HE3      MET   1 -20.635  49.794  -8.586
  536    H    GLY   2           H        GLY   2 -23.622  49.676  -1.559
  537    HA2  GLY   2           HA2      GLY   2 -25.789  48.817  -3.180
  538    HA3  GLY   2           HA3      GLY   2 -25.792  47.905  -1.677
  539    H    HIS   3           H        HIS   3 -24.800  51.294  -2.001
  540    HA   HIS   3           HA       HIS   3 -26.711  52.198  -0.033
  541    HB2  HIS   3           HB2      HIS   3 -24.815  53.799  -1.809
  542    HB3  HIS   3           HB3      HIS   3 -25.763  54.475  -0.490
  543    HD2  HIS   3           HD2      HIS   3 -22.368  52.865  -1.081
  544    HE1  HIS   3           HE1      HIS   3 -23.031  52.905   3.097
  545    HE2  HIS   3           HE2      HIS   3 -21.398  52.320   1.259
  546    H    HIS   4           H        HIS   4 -28.816  52.070  -0.688
  547    HA   HIS   4           HA       HIS   4 -29.805  53.902  -2.714
  548    HB2  HIS   4           HB2      HIS   4 -29.262  51.867  -4.069
  549    HB3  HIS   4           HB3      HIS   4 -30.307  50.898  -3.037
  550    HD2  HIS   4           HD2      HIS   4 -30.601  53.627  -5.848
  551    HE1  HIS   4           HE1      HIS   4 -34.404  51.896  -5.175
  552    HE2  HIS   4           HE2      HIS   4 -33.034  53.373  -6.702
  553    H    HIS   5           H        HIS   5 -32.040  54.349  -2.496
  554    HA   HIS   5           HA       HIS   5 -33.175  53.919   0.137
  555    HB2  HIS   5           HB2      HIS   5 -33.269  56.113  -1.083
  556    HB3  HIS   5           HB3      HIS   5 -34.320  55.387  -2.288
  557    HD2  HIS   5           HD2      HIS   5 -36.994  55.058  -1.505
  558    HE1  HIS   5           HE1      HIS   5 -36.551  57.131   2.148
  559    HE2  HIS   5           HE2      HIS   5 -38.197  56.223   0.466
  560    H    HIS   6           H        HIS   6 -33.795  51.771   0.354
  561    HA   HIS   6           HA       HIS   6 -36.185  50.844  -1.022
  562    HB2  HIS   6           HB2      HIS   6 -34.344  50.153  -2.569
  563    HB3  HIS   6           HB3      HIS   6 -33.575  49.270  -1.255
  564    HD2  HIS   6           HD2      HIS   6 -36.824  49.013  -3.480
  565    HE1  HIS   6           HE1      HIS   6 -35.907  45.235  -1.817
  566    HE2  HIS   6           HE2      HIS   6 -37.214  46.455  -3.596
  567    H    HIS   7           H        HIS   7 -37.345  50.475   0.820
  568    HA   HIS   7           HA       HIS   7 -36.161  49.361   3.252
  569    HB2  HIS   7           HB2      HIS   7 -39.037  50.215   2.699
  570    HB3  HIS   7           HB3      HIS   7 -38.334  49.895   4.285
  571    HD2  HIS   7           HD2      HIS   7 -36.508  51.907   5.201
  572    HE1  HIS   7           HE1      HIS   7 -37.765  54.705   2.294
  573    HE2  HIS   7           HE2      HIS   7 -36.631  54.407   4.525
  574    H    HIS   8           H        HIS   8 -37.521  48.003   0.494
  575    HA   HIS   8           HA       HIS   8 -39.205  45.969   1.719
  576    HB2  HIS   8           HB2      HIS   8 -38.364  46.291  -1.194
  577    HB3  HIS   8           HB3      HIS   8 -39.684  45.289  -0.595
  578    HD2  HIS   8           HD2      HIS   8 -39.023  48.901  -1.717
  579    HE1  HIS   8           HE1      HIS   8 -42.879  48.777   0.011
  580    HE2  HIS   8           HE2      HIS   8 -41.292  50.116  -1.417
  581    H    SER   9           H        SER   9 -35.977  46.168   1.667
  582    HA   SER   9           HA       SER   9 -35.050  43.636   0.817
  583    HB2  SER   9           HB2      SER   9 -33.895  45.512   2.925
  584    HB3  SER   9           HB3      SER   9 -33.041  44.142   2.212
  585    HG   SER   9           HG       SER   9 -32.796  46.407   1.285
  586    H    HIS  10           H        HIS  10 -36.666  42.187   1.589
  587    HA   HIS  10           HA       HIS  10 -36.229  41.157   4.323
  588    HB2  HIS  10           HB2      HIS  10 -38.984  41.663   3.082
  589    HB3  HIS  10           HB3      HIS  10 -38.714  40.766   4.574
  590    HD1  HIS  10           HD1      HIS  10 -37.500  42.255   6.541
  591    HD2  HIS  10           HD2      HIS  10 -39.360  44.356   3.476
  592    HE1  HIS  10           HE1      HIS  10 -37.768  44.592   7.393
  593    HE2  HIS  10           HE2      HIS  10 -39.025  45.796   5.589
  594    H    MET  11           H        MET  11 -35.199  40.321   1.790
  595    HA   MET  11           HA       MET  11 -36.712  38.135   0.685
  596    HB2  MET  11           HB2      MET  11 -33.802  38.940   0.260
  597    HB3  MET  11           HB3      MET  11 -34.651  37.714  -0.676
  598    HG2  MET  11           HG2      MET  11 -34.564  39.744  -1.957
  599    HG3  MET  11           HG3      MET  11 -36.236  39.475  -1.459
  600    HE1  MET  11           HE1      MET  11 -36.688  42.076  -2.175
  601    HE2  MET  11           HE2      MET  11 -34.979  42.274  -2.568
  602    HE3  MET  11           HE3      MET  11 -35.775  43.424  -1.495
  603    H    GLY  12           H        GLY  12 -36.990  36.303   1.838
  604    HA2  GLY  12           HA2      GLY  12 -34.741  35.104   3.379
  605    HA3  GLY  12           HA3      GLY  12 -36.447  34.806   3.665
  606    H    GLY  13           H        GLY  13 -34.908  32.632   3.490
  607    HA2  GLY  13           HA2      GLY  13 -36.036  31.206   1.233
  608    HA3  GLY  13           HA3      GLY  13 -34.285  31.380   1.139
  609    H    GLY  14           H        GLY  14 -33.022  29.970   2.297
  610    HA2  GLY  14           HA2      GLY  14 -32.409  28.202   3.649
  611    HA3  GLY  14           HA3      GLY  14 -33.842  28.507   4.616
  612    H    LYS  15           H        LYS  15 -33.812  27.728   1.163
  613    HA   LYS  15           HA       LYS  15 -35.637  25.470   1.593
  614    HB2  LYS  15           HB2      LYS  15 -34.694  26.822  -0.972
  615    HB3  LYS  15           HB3      LYS  15 -35.923  25.563  -0.887
  616    HG2  LYS  15           HG2      LYS  15 -37.366  27.066   0.468
  617    HG3  LYS  15           HG3      LYS  15 -36.134  28.326   0.368
  618    HD2  LYS  15           HD2      LYS  15 -37.926  28.743  -1.265
  619    HD3  LYS  15           HD3      LYS  15 -36.401  28.416  -2.088
  620    HE2  LYS  15           HE2      LYS  15 -37.147  26.092  -2.526
  621    HE3  LYS  15           HE3      LYS  15 -38.673  26.431  -1.708
  622    HZ1  LYS  15           HZ1      LYS  15 -39.145  28.109  -3.396
  623    HZ2  LYS  15           HZ2      LYS  15 -38.896  26.592  -4.103
  624    HZ3  LYS  15           HZ3      LYS  15 -37.682  27.764  -4.170
  625    H    GLY  16           H        GLY  16 -33.351  24.664   2.630
  626    HA2  GLY  16           HA2      GLY  16 -31.694  23.080   2.638
  627    HA3  GLY  16           HA3      GLY  16 -32.412  22.421   1.177
  628    HA   PRO  17           HA       PRO  17 -29.238  25.674  -0.509
  629    HB2  PRO  17           HB2      PRO  17 -27.728  27.197   1.184
  630    HB3  PRO  17           HB3      PRO  17 -29.364  27.648   0.694
  631    HG2  PRO  17           HG2      PRO  17 -28.441  26.363   3.254
  632    HG3  PRO  17           HG3      PRO  17 -29.649  27.644   3.017
  633    HD2  PRO  17           HD2      PRO  17 -30.284  24.984   3.408
  634    HD3  PRO  17           HD3      PRO  17 -31.335  26.126   2.546
  635    H    ALA  18           H        ALA  18 -28.129  23.872  -1.214
  636    HA   ALA  18           HA       ALA  18 -26.167  22.429   0.298
  637    HB1  ALA  18           HB1      ALA  18 -25.719  21.236  -1.805
  638    HB2  ALA  18           HB2      ALA  18 -26.675  22.424  -2.699
  639    HB3  ALA  18           HB3      ALA  18 -27.454  21.372  -1.516
  640    H    ALA  19           H        ALA  19 -23.931  22.056  -0.787
  641    HA   ALA  19           HA       ALA  19 -21.826  22.704  -1.214
  642    HB1  ALA  19           HB1      ALA  19 -22.664  23.817  -3.262
  643    HB2  ALA  19           HB2      ALA  19 -21.309  24.698  -2.557
  644    HB3  ALA  19           HB3      ALA  19 -22.955  25.298  -2.344
  645    H    GLU  20           H        GLU  20 -23.421  25.755  -0.136
  646    HA   GLU  20           HA       GLU  20 -21.351  26.638   1.553
  647    HB2  GLU  20           HB2      GLU  20 -24.299  27.358   1.550
  648    HB3  GLU  20           HB3      GLU  20 -23.072  28.238   2.458
  649    HG2  GLU  20           HG2      GLU  20 -21.923  28.773   0.294
  650    HG3  GLU  20           HG3      GLU  20 -23.252  27.988  -0.561
  651    H    GLU  21           H        GLU  21 -23.724  24.233   2.125
  652    HA   GLU  21           HA       GLU  21 -23.898  24.287   4.959
  653    HB2  GLU  21           HB2      GLU  21 -24.771  21.991   4.773
  654    HB3  GLU  21           HB3      GLU  21 -25.501  23.024   3.551
  655    HG2  GLU  21           HG2      GLU  21 -23.974  22.086   1.842
  656    HG3  GLU  21           HG3      GLU  21 -23.252  21.043   3.067
  657    HA   PRO  22           HA       PRO  22 -19.794  22.900   6.207
  658    HB2  PRO  22           HB2      PRO  22 -20.381  21.417   8.491
  659    HB3  PRO  22           HB3      PRO  22 -20.330  23.184   8.439
  660    HG2  PRO  22           HG2      PRO  22 -22.722  21.356   8.231
  661    HG3  PRO  22           HG3      PRO  22 -22.528  22.842   9.187
  662    HD2  PRO  22           HD2      PRO  22 -23.860  22.870   6.849
  663    HD3  PRO  22           HD3      PRO  22 -22.815  24.236   7.306
  664    H    LEU  23           H        LEU  23 -18.674  21.415   5.085
  665    HA   LEU  23           HA       LEU  23 -19.803  18.766   4.470
  666    HB2  LEU  23           HB2      LEU  23 -17.347  20.158   3.328
  667    HB3  LEU  23           HB3      LEU  23 -18.051  18.660   2.738
  668    HG   LEU  23           HG       LEU  23 -19.369  21.407   2.628
  669   HD11  LEU  23          HD11      LEU  23 -17.537  21.187   1.012
  670   HD12  LEU  23          HD12      LEU  23 -19.096  21.242   0.192
  671   HD13  LEU  23          HD13      LEU  23 -18.257  19.701   0.379
  672   HD21  LEU  23          HD21      LEU  23 -21.092  19.678   2.948
  673   HD22  LEU  23          HD22      LEU  23 -20.438  18.745   1.600
  674   HD23  LEU  23          HD23      LEU  23 -21.170  20.323   1.309
  675    H    SER  24           H        SER  24 -19.003  16.880   5.220
  676    HA   SER  24           HA       SER  24 -16.906  16.856   7.271
  677    HB2  SER  24           HB2      SER  24 -17.682  14.542   7.690
  678    HB3  SER  24           HB3      SER  24 -19.043  15.666   7.671
  679    HG   SER  24           HG       SER  24 -18.272  13.776   5.709
  680    H    LEU  25           H        LEU  25 -16.651  16.835   4.069
  681    HA   LEU  25           HA       LEU  25 -15.086  16.305   2.543
  682    HB2  LEU  25           HB2      LEU  25 -13.459  15.298   4.906
  683    HB3  LEU  25           HB3      LEU  25 -12.822  15.599   3.297
  684    HG   LEU  25           HG       LEU  25 -13.941  17.715   5.181
  685   HD11  LEU  25          HD11      LEU  25 -11.780  16.870   5.946
  686   HD12  LEU  25          HD12      LEU  25 -11.635  18.525   5.365
  687   HD13  LEU  25          HD13      LEU  25 -11.074  17.190   4.358
  688   HD21  LEU  25          HD21      LEU  25 -14.389  18.336   2.853
  689   HD22  LEU  25          HD22      LEU  25 -12.697  18.067   2.432
  690   HD23  LEU  25          HD23      LEU  25 -13.135  19.375   3.533
  691    H    LEU  26           H        LEU  26 -13.521  14.346   1.825
  692    HA   LEU  26           HA       LEU  26 -14.572  11.686   2.381
  693    HB2  LEU  26           HB2      LEU  26 -16.017  12.766   0.536
  694    HB3  LEU  26           HB3      LEU  26 -14.601  12.739  -0.489
  695    HG   LEU  26           HG       LEU  26 -15.822  10.200   0.684
  696   HD11  LEU  26          HD11      LEU  26 -17.540  11.303  -0.665
  697   HD12  LEU  26          HD12      LEU  26 -16.981   9.834  -1.455
  698   HD13  LEU  26          HD13      LEU  26 -16.430  11.407  -2.035
  699   HD21  LEU  26          HD21      LEU  26 -13.513   9.906  -0.108
  700   HD22  LEU  26          HD22      LEU  26 -13.948  10.555  -1.687
  701   HD23  LEU  26          HD23      LEU  26 -14.637   9.024  -1.139
  702    H    ASP  27           H        ASP  27 -12.623  13.532   0.035
  703    HA   ASP  27           HA       ASP  27 -10.547  13.436  -0.781
  704    HB2  ASP  27           HB2      ASP  27  -9.859  11.985   1.809
  705    HB3  ASP  27           HB3      ASP  27  -8.684  12.682   0.691
  706    H    ASP  28           H        ASP  28 -10.224  12.306  -2.544
  707    HA   ASP  28           HA       ASP  28 -10.894   9.645  -3.067
  708    HB2  ASP  28           HB2      ASP  28 -10.606  11.405  -4.797
  709    HB3  ASP  28           HB3      ASP  28  -8.866  11.415  -4.508
  710    H    MET  29           H        MET  29  -7.820  11.025  -1.959
  711    HA   MET  29           HA       MET  29  -6.236   8.660  -2.188
  712    HB2  MET  29           HB2      MET  29  -5.812  11.007  -0.283
  713    HB3  MET  29           HB3      MET  29  -4.613   9.799  -0.730
  714    HG2  MET  29           HG2      MET  29  -4.947  10.625  -3.147
  715    HG3  MET  29           HG3      MET  29  -5.762  12.007  -2.420
  716    HE1  MET  29           HE1      MET  29  -2.425  10.059  -2.899
  717    HE2  MET  29           HE2      MET  29  -2.576   9.957  -1.140
  718    HE3  MET  29           HE3      MET  29  -1.302  10.943  -1.859
  719    H    ASN  30           H        ASN  30  -8.240  10.006   0.434
  720    HA   ASN  30           HA       ASN  30  -7.463   8.101   2.437
  721    HB2  ASN  30           HB2      ASN  30  -8.475  10.463   2.782
  722    HB3  ASN  30           HB3      ASN  30 -10.037   9.732   2.447
  723   HD21  ASN  30          HD21      ASN  30  -9.117  11.040   4.867
  724   HD22  ASN  30          HD22      ASN  30  -9.269   9.884   6.141
  725    H    HIS  31           H        HIS  31 -10.003   8.195  -0.019
  726    HA   HIS  31           HA       HIS  31 -11.483   5.891   0.666
  727    HB2  HIS  31           HB2      HIS  31 -12.200   7.478  -1.093
  728    HB3  HIS  31           HB3      HIS  31 -10.817   7.042  -2.088
  729    HD2  HIS  31           HD2      HIS  31 -14.398   5.777  -1.258
  730    HE1  HIS  31           HE1      HIS  31 -12.672   3.150  -4.087
  731    HE2  HIS  31           HE2      HIS  31 -14.824   3.936  -3.029
  732    H    CYS  32           H        CYS  32  -8.547   6.276  -1.326
  733    HA   CYS  32           HA       CYS  32  -8.076   3.528  -1.875
  734    HB2  CYS  32           HB2      CYS  32  -6.154   5.884  -1.868
  735    HB3  CYS  32           HB3      CYS  32  -5.768   4.285  -2.502
  736    HG   CYS  32           HG       CYS  32  -8.198   6.358  -3.737
  737    H    TYR  33           H        TYR  33  -6.957   5.645   0.748
  738    HA   TYR  33           HA       TYR  33  -5.161   3.873   2.025
  739    HB2  TYR  33           HB2      TYR  33  -6.612   6.381   2.885
  740    HB3  TYR  33           HB3      TYR  33  -5.816   5.419   4.124
  741    HD1  TYR  33           HD1      TYR  33  -3.329   4.660   3.396
  742    HD2  TYR  33           HD2      TYR  33  -5.287   8.196   2.031
  743    HE1  TYR  33           HE1      TYR  33  -1.162   5.689   2.986
  744    HE2  TYR  33           HE2      TYR  33  -3.102   9.238   1.596
  745    HH   TYR  33           HH       TYR  33  -0.248   7.546   1.450
  746    H    SER  34           H        SER  34  -8.640   4.349   2.386
  747    HA   SER  34           HA       SER  34  -9.114   2.618   4.565
  748    HB2  SER  34           HB2      SER  34 -10.828   4.204   3.721
  749    HB3  SER  34           HB3      SER  34 -10.977   3.267   2.233
  750    HG   SER  34           HG       SER  34 -11.953   2.759   4.777
  751    H    ARG  35           H        ARG  35  -9.130   2.031   1.063
  752    HA   ARG  35           HA       ARG  35  -9.740  -0.706   1.060
  753    HB2  ARG  35           HB2      ARG  35  -8.456   1.133  -0.931
  754    HB3  ARG  35           HB3      ARG  35  -8.548  -0.603  -1.266
  755    HG2  ARG  35           HG2      ARG  35 -10.871  -0.618  -1.370
  756    HG3  ARG  35           HG3      ARG  35 -11.042   0.806  -0.341
  757    HD2  ARG  35           HD2      ARG  35 -11.697   1.351  -2.555
  758    HD3  ARG  35           HD3      ARG  35 -10.203   2.194  -2.183
  759    HE   ARG  35           HE       ARG  35  -9.057   0.469  -3.568
  760   HH11  ARG  35          HH11      ARG  35 -12.444   0.867  -4.102
  761   HH12  ARG  35          HH12      ARG  35 -12.324   0.485  -5.780
  762   HH21  ARG  35          HH21      ARG  35  -8.950  -0.018  -5.725
  763   HH22  ARG  35          HH22      ARG  35 -10.386  -0.002  -6.679
  764    H    LEU  36           H        LEU  36  -6.595   0.938   1.316
  765    HA   LEU  36           HA       LEU  36  -4.899  -1.314   1.294
  766    HB2  LEU  36           HB2      LEU  36  -4.602   1.280   2.864
  767    HB3  LEU  36           HB3      LEU  36  -3.331   0.082   2.673
  768    HG   LEU  36           HG       LEU  36  -4.558   1.746   0.441
  769   HD11  LEU  36          HD11      LEU  36  -2.337   2.792   0.287
  770   HD12  LEU  36          HD12      LEU  36  -1.796   1.859   1.682
  771   HD13  LEU  36          HD13      LEU  36  -3.078   3.059   1.864
  772   HD21  LEU  36          HD21      LEU  36  -2.853   0.736  -1.045
  773   HD22  LEU  36          HD22      LEU  36  -3.974  -0.474  -0.431
  774   HD23  LEU  36          HD23      LEU  36  -2.355  -0.347   0.260
  775    H    ARG  37           H        ARG  37  -6.393   0.351   4.121
  776    HA   ARG  37           HA       ARG  37  -5.557  -1.571   6.038
  777    HB2  ARG  37           HB2      ARG  37  -7.680   0.585   6.156
  778    HB3  ARG  37           HB3      ARG  37  -7.353  -0.487   7.517
  779    HG2  ARG  37           HG2      ARG  37  -4.909   0.285   7.351
  780    HG3  ARG  37           HG3      ARG  37  -5.484   1.539   6.252
  781    HD2  ARG  37           HD2      ARG  37  -6.486   1.170   9.096
  782    HD3  ARG  37           HD3      ARG  37  -5.199   2.280   8.631
  783    HE   ARG  37           HE       ARG  37  -7.746   2.637   7.268
  784   HH11  ARG  37          HH11      ARG  37  -5.713   3.697   9.864
  785   HH12  ARG  37          HH12      ARG  37  -6.571   5.178  10.059
  786   HH21  ARG  37          HH21      ARG  37  -8.786   4.561   7.537
  787   HH22  ARG  37          HH22      ARG  37  -8.259   5.666   8.753
  788    H    GLU  38           H        GLU  38  -8.070  -1.830   3.719
  789    HA   GLU  38           HA       GLU  38  -9.580  -3.831   5.239
  790    HB2  GLU  38           HB2      GLU  38  -9.867  -2.790   2.391
  791    HB3  GLU  38           HB3      GLU  38 -10.870  -4.084   3.036
  792    HG2  GLU  38           HG2      GLU  38 -10.739  -1.247   4.097
  793    HG3  GLU  38           HG3      GLU  38 -12.021  -1.916   3.091
  794    H    LEU  39           H        LEU  39  -7.069  -3.670   2.841
  795    HA   LEU  39           HA       LEU  39  -7.124  -6.546   2.238
  796    HB2  LEU  39           HB2      LEU  39  -5.614  -4.205   1.037
  797    HB3  LEU  39           HB3      LEU  39  -5.351  -5.867   0.544
  798    HG   LEU  39           HG       LEU  39  -7.984  -4.362   0.255
  799   HD11  LEU  39          HD11      LEU  39  -6.285  -3.508  -1.292
  800   HD12  LEU  39          HD12      LEU  39  -7.538  -4.393  -2.160
  801   HD13  LEU  39          HD13      LEU  39  -5.969  -5.147  -1.870
  802   HD21  LEU  39          HD21      LEU  39  -8.746  -6.315  -1.052
  803   HD22  LEU  39          HD22      LEU  39  -8.375  -6.772   0.607
  804   HD23  LEU  39          HD23      LEU  39  -7.241  -7.162  -0.689
  805    H    VAL  40           H        VAL  40  -5.602  -4.563   4.507
  806    HA   VAL  40           HA       VAL  40  -3.281  -6.402   4.766
  807    HB   VAL  40           HB       VAL  40  -3.578  -3.585   5.925
  808   HG11  VAL  40          HG11      VAL  40  -2.143  -4.982   7.344
  809   HG12  VAL  40          HG12      VAL  40  -1.164  -3.783   6.498
  810   HG13  VAL  40          HG13      VAL  40  -1.180  -5.460   5.947
  811   HG21  VAL  40          HG21      VAL  40  -1.918  -4.542   3.553
  812   HG22  VAL  40          HG22      VAL  40  -1.864  -2.922   4.254
  813   HG23  VAL  40          HG23      VAL  40  -3.347  -3.497   3.486
  814    HA   PRO  41           HA       PRO  41  -5.530  -7.608   8.641
  815    HB2  PRO  41           HB2      PRO  41  -5.028 -10.260   8.535
  816    HB3  PRO  41           HB3      PRO  41  -6.272  -9.537   7.505
  817    HG2  PRO  41           HG2      PRO  41  -3.424 -10.258   6.803
  818    HG3  PRO  41           HG3      PRO  41  -4.917 -10.616   5.903
  819    HD2  PRO  41           HD2      PRO  41  -3.274  -8.489   5.312
  820    HD3  PRO  41           HD3      PRO  41  -5.019  -8.480   4.983
  821    H    GLY  42           H        GLY  42  -2.282  -7.535   7.569
  822    HA2  GLY  42           HA2      GLY  42  -0.988  -8.617   9.947
  823    HA3  GLY  42           HA3      GLY  42  -0.213  -7.843   8.575
  824    H    VAL  43           H        VAL  43  -2.705  -6.733  10.864
  825    HA   VAL  43           HA       VAL  43  -1.026  -4.457  11.740
  826    HB   VAL  43           HB       VAL  43  -4.013  -4.370  11.029
  827   HG11  VAL  43          HG11      VAL  43  -3.590  -2.950  12.983
  828   HG12  VAL  43          HG12      VAL  43  -3.930  -1.949  11.571
  829   HG13  VAL  43          HG13      VAL  43  -2.269  -2.131  12.144
  830   HG21  VAL  43          HG21      VAL  43  -3.376  -2.743   9.270
  831   HG22  VAL  43          HG22      VAL  43  -2.592  -4.301   9.022
  832   HG23  VAL  43          HG23      VAL  43  -1.670  -2.951   9.686
  833    HA   PRO  44           HA       PRO  44  -2.293  -5.970  15.909
  834    HB2  PRO  44           HB2      PRO  44  -1.732  -3.581  17.261
  835    HB3  PRO  44           HB3      PRO  44  -0.543  -4.844  16.921
  836    HG2  PRO  44           HG2      PRO  44  -1.088  -2.299  15.392
  837    HG3  PRO  44           HG3      PRO  44   0.470  -3.034  15.831
  838    HD2  PRO  44           HD2      PRO  44  -0.517  -3.291  13.346
  839    HD3  PRO  44           HD3      PRO  44   0.328  -4.648  14.124
  840    H    ARG  45           H        ARG  45  -4.394  -6.023  16.633
  841    HA   ARG  45           HA       ARG  45  -6.360  -4.353  15.344
  842    HB2  ARG  45           HB2      ARG  45  -6.675  -6.640  17.339
  843    HB3  ARG  45           HB3      ARG  45  -8.034  -5.791  16.618
  844    HG2  ARG  45           HG2      ARG  45  -7.794  -7.801  15.372
  845    HG3  ARG  45           HG3      ARG  45  -7.159  -6.523  14.341
  846    HD2  ARG  45           HD2      ARG  45  -4.842  -7.156  15.077
  847    HD3  ARG  45           HD3      ARG  45  -5.544  -8.506  15.977
  848    HE   ARG  45           HE       ARG  45  -6.349  -8.540  13.241
  849   HH11  ARG  45          HH11      ARG  45  -3.699  -9.399  15.297
  850   HH12  ARG  45          HH12      ARG  45  -3.080 -10.552  14.175
  851   HH21  ARG  45          HH21      ARG  45  -5.547 -10.037  11.849
  852   HH22  ARG  45          HH22      ARG  45  -4.119 -10.920  12.260
  853    H    GLY  46           H        GLY  46  -7.447  -2.656  16.149
  854    HA2  GLY  46           HA2      GLY  46  -8.383  -1.154  17.650
  855    HA3  GLY  46           HA3      GLY  46  -7.696  -2.061  18.987
  856    H    THR  47           H        THR  47  -5.577  -1.067  16.394
  857    HA   THR  47           HA       THR  47  -4.199   0.851  18.171
  858    HB   THR  47           HB       THR  47  -2.880  -0.972  16.963
  859    HG1  THR  47           HG1      THR  47  -1.368   0.427  17.413
  860   HG21  THR  47          HG21      THR  47  -4.018  -0.844  14.756
  861   HG22  THR  47          HG22      THR  47  -2.274  -0.646  14.608
  862   HG23  THR  47          HG23      THR  47  -3.333   0.763  14.501
  863    H    GLN  48           H        GLN  48  -3.119   2.766  16.809
  864    HA   GLN  48           HA       GLN  48  -5.221   4.097  15.178
  865    HB2  GLN  48           HB2      GLN  48  -4.878   5.091  17.465
  866    HB3  GLN  48           HB3      GLN  48  -3.196   5.410  17.054
  867    HG2  GLN  48           HG2      GLN  48  -4.520   7.443  16.855
  868    HG3  GLN  48           HG3      GLN  48  -3.933   6.957  15.268
  869   HE21  GLN  48          HE21      GLN  48  -6.758   7.150  17.332
  870   HE22  GLN  48          HE22      GLN  48  -7.928   7.005  16.070
  871    H    LEU  49           H        LEU  49  -4.486   3.694  13.121
  872    HA   LEU  49           HA       LEU  49  -1.684   4.208  12.385
  873    HB2  LEU  49           HB2      LEU  49  -3.983   3.160  10.688
  874    HB3  LEU  49           HB3      LEU  49  -2.322   3.340  10.145
  875    HG   LEU  49           HG       LEU  49  -3.335   1.392  12.251
  876   HD11  LEU  49          HD11      LEU  49  -3.874   0.723   9.954
  877   HD12  LEU  49          HD12      LEU  49  -2.656  -0.346  10.644
  878   HD13  LEU  49          HD13      LEU  49  -2.181   0.897   9.485
  879   HD21  LEU  49          HD21      LEU  49  -1.016   0.511  12.352
  880   HD22  LEU  49          HD22      LEU  49  -1.111   2.169  12.933
  881   HD23  LEU  49          HD23      LEU  49  -0.468   1.839  11.323
  882    H    SER  50           H        SER  50  -1.213   6.313  12.083
  883    HA   SER  50           HA       SER  50  -2.839   8.238  10.711
  884    HB2  SER  50           HB2      SER  50  -0.977   8.993  12.138
  885    HB3  SER  50           HB3      SER  50   0.188   8.152  11.118
  886    HG   SER  50           HG       SER  50  -0.310  10.577  10.844
  887    H    GLN  51           H        GLN  51  -2.146   9.214   8.552
  888    HA   GLN  51           HA       GLN  51  -2.422   7.383   6.458
  889    HB2  GLN  51           HB2      GLN  51  -1.849   9.324   4.956
  890    HB3  GLN  51           HB3      GLN  51  -3.096   9.663   6.149
  891    HG2  GLN  51           HG2      GLN  51  -1.426  10.826   7.567
  892    HG3  GLN  51           HG3      GLN  51  -0.186  10.500   6.355
  893   HE21  GLN  51          HE21      GLN  51   0.196  12.727   6.091
  894   HE22  GLN  51          HE22      GLN  51  -0.918  13.753   5.259
  895    H    VAL  52           H        VAL  52   0.577   8.749   7.795
  896    HA   VAL  52           HA       VAL  52   2.372   7.574   5.873
  897    HB   VAL  52           HB       VAL  52   3.000   8.473   8.742
  898   HG11  VAL  52          HG11      VAL  52   4.863   8.039   6.369
  899   HG12  VAL  52          HG12      VAL  52   4.758   7.025   7.812
  900   HG13  VAL  52          HG13      VAL  52   5.339   8.684   7.945
  901   HG21  VAL  52          HG21      VAL  52   3.760  10.609   7.721
  902   HG22  VAL  52          HG22      VAL  52   2.036  10.338   7.460
  903   HG23  VAL  52          HG23      VAL  52   3.180  10.061   6.144
  904    H    GLU  53           H        GLU  53   1.239   6.617   9.126
  905    HA   GLU  53           HA       GLU  53   2.734   4.274   9.511
  906    HB2  GLU  53           HB2      GLU  53  -0.040   4.973  10.569
  907    HB3  GLU  53           HB3      GLU  53   0.938   3.640  11.167
  908    HG2  GLU  53           HG2      GLU  53   1.726   6.567  11.320
  909    HG3  GLU  53           HG3      GLU  53   0.996   5.643  12.631
  910    H    ILE  54           H        ILE  54  -0.372   4.746   7.842
  911    HA   ILE  54           HA       ILE  54  -1.149   2.087   7.414
  912    HB   ILE  54           HB       ILE  54  -1.607   4.550   5.667
  913   HG12  ILE  54          HG12      ILE  54  -3.475   3.188   7.679
  914   HG13  ILE  54          HG13      ILE  54  -2.597   4.689   7.958
  915   HG21  ILE  54          HG21      ILE  54  -2.958   1.826   5.427
  916   HG22  ILE  54          HG22      ILE  54  -1.900   2.598   4.239
  917   HG23  ILE  54          HG23      ILE  54  -3.479   3.293   4.587
  918   HD11  ILE  54          HD11      ILE  54  -4.771   4.253   5.914
  919   HD12  ILE  54          HD12      ILE  54  -3.878   5.759   6.157
  920   HD13  ILE  54          HD13      ILE  54  -4.910   5.127   7.439
  921    H    LEU  55           H        LEU  55   0.752   4.254   5.280
  922    HA   LEU  55           HA       LEU  55   1.393   2.535   3.196
  923    HB2  LEU  55           HB2      LEU  55   3.144   4.700   4.423
  924    HB3  LEU  55           HB3      LEU  55   3.392   3.987   2.838
  925    HG   LEU  55           HG       LEU  55   0.978   5.659   3.645
  926   HD11  LEU  55          HD11      LEU  55   1.912   7.383   2.154
  927   HD12  LEU  55          HD12      LEU  55   3.341   6.383   1.882
  928   HD13  LEU  55          HD13      LEU  55   3.005   7.024   3.492
  929   HD21  LEU  55          HD21      LEU  55   1.717   4.510   0.929
  930   HD22  LEU  55          HD22      LEU  55   0.368   5.600   1.254
  931   HD23  LEU  55          HD23      LEU  55   0.376   3.981   1.949
  932    H    GLN  56           H        GLN  56   3.095   2.991   6.274
  933    HA   GLN  56           HA       GLN  56   5.270   1.246   5.889
  934    HB2  GLN  56           HB2      GLN  56   3.846   2.026   8.462
  935    HB3  GLN  56           HB3      GLN  56   5.412   1.222   8.390
  936    HG2  GLN  56           HG2      GLN  56   6.407   3.175   7.319
  937    HG3  GLN  56           HG3      GLN  56   4.831   3.973   7.254
  938   HE21  GLN  56          HE21      GLN  56   5.647   5.710   8.478
  939   HE22  GLN  56          HE22      GLN  56   5.899   5.582  10.182
  940    H    ARG  57           H        ARG  57   2.045   0.602   7.380
  941    HA   ARG  57           HA       ARG  57   2.633  -2.108   8.118
  942    HB2  ARG  57           HB2      ARG  57  -0.132  -0.871   7.797
  943    HB3  ARG  57           HB3      ARG  57   0.262  -2.327   8.706
  944    HG2  ARG  57           HG2      ARG  57   1.054   0.512   9.375
  945    HG3  ARG  57           HG3      ARG  57  -0.100  -0.499  10.235
  946    HD2  ARG  57           HD2      ARG  57   1.579  -1.805  11.221
  947    HD3  ARG  57           HD3      ARG  57   2.779  -1.392   9.992
  948    HE   ARG  57           HE       ARG  57   1.837   0.444  12.114
  949   HH11  ARG  57          HH11      ARG  57   4.366  -0.638  10.006
  950   HH12  ARG  57          HH12      ARG  57   5.474   0.573  10.548
  951   HH21  ARG  57          HH21      ARG  57   3.300   1.997  12.770
  952   HH22  ARG  57          HH22      ARG  57   4.879   2.024  12.074
  953    H    VAL  58           H        VAL  58   1.360  -0.648   5.210
  954    HA   VAL  58           HA       VAL  58   0.533  -3.036   3.891
  955    HB   VAL  58           HB       VAL  58   1.550  -0.403   2.713
  956   HG11  VAL  58          HG11      VAL  58   0.487  -1.118   0.601
  957   HG12  VAL  58          HG12      VAL  58   0.110  -2.688   1.314
  958   HG13  VAL  58          HG13      VAL  58   1.790  -2.208   1.071
  959   HG21  VAL  58          HG21      VAL  58  -0.834   0.130   2.338
  960   HG22  VAL  58          HG22      VAL  58  -0.512  -0.133   4.049
  961   HG23  VAL  58          HG23      VAL  58  -1.310  -1.388   3.103
  962    H    ILE  59           H        ILE  59   3.649  -1.243   3.946
  963    HA   ILE  59           HA       ILE  59   5.156  -2.986   2.306
  964    HB   ILE  59           HB       ILE  59   6.105  -1.209   4.605
  965   HG12  ILE  59          HG12      ILE  59   6.139  -0.643   1.593
  966   HG13  ILE  59          HG13      ILE  59   4.928  -0.017   2.703
  967   HG21  ILE  59          HG21      ILE  59   7.817  -2.901   4.112
  968   HG22  ILE  59          HG22      ILE  59   8.361  -1.317   3.564
  969   HG23  ILE  59          HG23      ILE  59   7.761  -2.493   2.394
  970   HD11  ILE  59          HD11      ILE  59   6.660   1.235   3.890
  971   HD12  ILE  59          HD12      ILE  59   6.593   1.652   2.177
  972   HD13  ILE  59          HD13      ILE  59   7.877   0.604   2.776
  973    H    ASP  60           H        ASP  60   4.756  -2.943   5.872
  974    HA   ASP  60           HA       ASP  60   6.279  -5.163   6.605
  975    HB2  ASP  60           HB2      ASP  60   3.681  -4.150   7.857
  976    HB3  ASP  60           HB3      ASP  60   4.788  -5.277   8.632
  977    H    TYR  61           H        TYR  61   2.882  -4.997   5.619
  978    HA   TYR  61           HA       TYR  61   2.112  -7.674   5.839
  979    HB2  TYR  61           HB2      TYR  61   0.438  -5.997   5.485
  980    HB3  TYR  61           HB3      TYR  61   1.213  -5.408   4.023
  981    HD1  TYR  61           HD1      TYR  61  -0.534  -8.435   5.408
  982    HD2  TYR  61           HD2      TYR  61   0.416  -6.172   1.902
  983    HE1  TYR  61           HE1      TYR  61  -2.008  -9.869   4.075
  984    HE2  TYR  61           HE2      TYR  61  -1.074  -7.609   0.582
  985    HH   TYR  61           HH       TYR  61  -1.978  -9.937   0.713
  986    H    ILE  62           H        ILE  62   3.358  -5.962   2.935
  987    HA   ILE  62           HA       ILE  62   3.247  -8.172   1.180
  988    HB   ILE  62           HB       ILE  62   4.937  -5.636   0.966
  989   HG12  ILE  62          HG12      ILE  62   2.234  -6.284  -0.332
  990   HG13  ILE  62          HG13      ILE  62   2.433  -5.262   1.085
  991   HG21  ILE  62          HG21      ILE  62   4.250  -7.655  -1.216
  992   HG22  ILE  62          HG22      ILE  62   5.846  -7.394  -0.513
  993   HG23  ILE  62          HG23      ILE  62   5.089  -6.121  -1.467
  994   HD11  ILE  62          HD11      ILE  62   3.500  -4.689  -1.681
  995   HD12  ILE  62          HD12      ILE  62   3.724  -3.662  -0.261
  996   HD13  ILE  62          HD13      ILE  62   2.106  -3.933  -0.909
  997    H    LEU  63           H        LEU  63   6.041  -6.789   2.973
  998    HA   LEU  63           HA       LEU  63   8.030  -8.586   2.098
  999    HB2  LEU  63           HB2      LEU  63   7.834  -7.085   4.736
 1000    HB3  LEU  63           HB3      LEU  63   9.282  -7.893   4.153
 1001    HG   LEU  63           HG       LEU  63   7.948  -5.477   2.865
 1002   HD11  LEU  63          HD11      LEU  63  10.585  -5.692   4.354
 1003   HD12  LEU  63          HD12      LEU  63   9.115  -4.922   4.950
 1004   HD13  LEU  63          HD13      LEU  63   9.959  -4.243   3.561
 1005   HD21  LEU  63          HD21      LEU  63   8.929  -6.899   1.125
 1006   HD22  LEU  63          HD22      LEU  63  10.463  -6.948   1.996
 1007   HD23  LEU  63          HD23      LEU  63   9.879  -5.427   1.321
 1008    H    ASP  64           H        ASP  64   5.722  -8.821   4.770
 1009    HA   ASP  64           HA       ASP  64   6.665 -11.166   6.028
 1010    HB2  ASP  64           HB2      ASP  64   4.990  -9.601   7.001
 1011    HB3  ASP  64           HB3      ASP  64   3.805 -10.121   5.810
 1012    H    LEU  65           H        LEU  65   4.670 -10.724   3.144
 1013    HA   LEU  65           HA       LEU  65   4.017 -13.534   2.796
 1014    HB2  LEU  65           HB2      LEU  65   3.834 -11.279   0.765
 1015    HB3  LEU  65           HB3      LEU  65   3.026 -12.837   0.673
 1016    HG   LEU  65           HG       LEU  65   2.428 -10.618   2.667
 1017   HD11  LEU  65          HD11      LEU  65   1.619 -10.109   0.427
 1018   HD12  LEU  65          HD12      LEU  65   0.271 -10.436   1.517
 1019   HD13  LEU  65          HD13      LEU  65   0.779 -11.662   0.354
 1020   HD21  LEU  65          HD21      LEU  65   1.089 -13.337   2.431
 1021   HD22  LEU  65          HD22      LEU  65   0.555 -12.008   3.464
 1022   HD23  LEU  65          HD23      LEU  65   2.107 -12.786   3.766
 1023    H    GLN  66           H        GLN  66   6.445 -11.292   1.576
 1024    HA   GLN  66           HA       GLN  66   7.400 -12.871  -0.612
 1025    HB2  GLN  66           HB2      GLN  66   8.778 -10.551   0.816
 1026    HB3  GLN  66           HB3      GLN  66   9.286 -11.236  -0.724
 1027    HG2  GLN  66           HG2      GLN  66   6.675  -9.795  -0.193
 1028    HG3  GLN  66           HG3      GLN  66   8.077  -9.124  -1.021
 1029   HE21  GLN  66          HE21      GLN  66   5.307  -9.511  -1.918
 1030   HE22  GLN  66          HE22      GLN  66   5.416 -10.420  -3.374
 1031    H    VAL  67           H        VAL  67   9.076 -11.957   2.411
 1032    HA   VAL  67           HA       VAL  67  10.850 -14.325   2.148
 1033    HB   VAL  67           HB       VAL  67  12.598 -12.943   3.343
 1034   HG11  VAL  67          HG11      VAL  67  13.237 -11.572   1.385
 1035   HG12  VAL  67          HG12      VAL  67  11.620 -11.773   0.707
 1036   HG13  VAL  67          HG13      VAL  67  12.676 -13.173   0.896
 1037   HG21  VAL  67          HG21      VAL  67  11.125 -11.305   4.463
 1038   HG22  VAL  67          HG22      VAL  67  10.649 -10.628   2.904
 1039   HG23  VAL  67          HG23      VAL  67  12.316 -10.472   3.463
 1040    H    VAL  68           H        VAL  68  11.585 -15.339   4.050
 1041    HA   VAL  68           HA       VAL  68   9.680 -15.384   6.250
 1042    HB   VAL  68           HB       VAL  68  10.956 -17.354   7.085
 1043   HG11  VAL  68          HG11      VAL  68  10.362 -18.894   5.251
 1044   HG12  VAL  68          HG12      VAL  68  10.222 -17.530   4.139
 1045   HG13  VAL  68          HG13      VAL  68   9.110 -17.676   5.501
 1046   HG21  VAL  68          HG21      VAL  68  12.758 -16.959   4.652
 1047   HG22  VAL  68          HG22      VAL  68  12.783 -18.356   5.735
 1048   HG23  VAL  68          HG23      VAL  68  13.235 -16.763   6.341
  Start of MODEL   17
    1    H1   MET   1           H1       MET   1 -17.978  26.327  10.978
    2    H2   MET   1           H2       MET   1 -18.532  27.353  12.198
    3    H3   MET   1           H3       MET   1 -19.406  25.961  11.805
    4    HA   MET   1           HA       MET   1 -16.667  25.996  12.923
    5    HB2  MET   1           HB2      MET   1 -19.320  25.353  14.275
    6    HB3  MET   1           HB3      MET   1 -17.744  25.121  15.020
    7    HG2  MET   1           HG2      MET   1 -18.728  27.831  14.103
    8    HG3  MET   1           HG3      MET   1 -19.036  27.198  15.714
    9    HE1  MET   1           HE1      MET   1 -15.012  28.906  14.215
   10    HE2  MET   1           HE2      MET   1 -16.605  29.246  13.534
   11    HE3  MET   1           HE3      MET   1 -15.832  27.689  13.238
   12    H    GLY   2           H        GLY   2 -16.018  23.802  13.757
   13    HA2  GLY   2           HA2      GLY   2 -15.702  21.530  13.541
   14    HA3  GLY   2           HA3      GLY   2 -17.321  21.408  12.876
   15    H    HIS   3           H        HIS   3 -14.078  22.578  11.978
   16    HA   HIS   3           HA       HIS   3 -14.227  21.260   9.355
   17    HB2  HIS   3           HB2      HIS   3 -13.578  23.330   8.152
   18    HB3  HIS   3           HB3      HIS   3 -15.120  23.545   8.962
   19    HD2  HIS   3           HD2      HIS   3 -14.966  25.186  11.364
   20    HE1  HIS   3           HE1      HIS   3 -11.274  26.884  10.200
   21    HE2  HIS   3           HE2      HIS   3 -13.287  27.131  11.703
   22    H    HIS   4           H        HIS   4 -12.300  20.366   8.820
   23    HA   HIS   4           HA       HIS   4  -9.773  21.453   9.915
   24    HB2  HIS   4           HB2      HIS   4 -10.535  18.495   9.805
   25    HB3  HIS   4           HB3      HIS   4  -8.923  19.094  10.185
   26    HD2  HIS   4           HD2      HIS   4  -8.633  20.255  12.738
   27    HE1  HIS   4           HE1      HIS   4 -12.451  19.058  14.103
   28    HE2  HIS   4           HE2      HIS   4 -10.160  19.844  14.798
   29    H    HIS   5           H        HIS   5  -8.216  21.735   8.361
   30    HA   HIS   5           HA       HIS   5  -8.866  21.005   5.602
   31    HB2  HIS   5           HB2      HIS   5  -7.101  22.502   4.923
   32    HB3  HIS   5           HB3      HIS   5  -8.004  23.306   6.199
   33    HD2  HIS   5           HD2      HIS   5  -6.573  23.800   8.559
   34    HE1  HIS   5           HE1      HIS   5  -2.874  22.421   7.041
   35    HE2  HIS   5           HE2      HIS   5  -3.998  23.790   8.842
   36    H    HIS   6           H        HIS   6  -7.351  19.932   4.191
   37    HA   HIS   6           HA       HIS   6  -5.327  18.182   5.484
   38    HB2  HIS   6           HB2      HIS   6  -7.496  16.994   4.836
   39    HB3  HIS   6           HB3      HIS   6  -7.149  17.393   3.158
   40    HD2  HIS   6           HD2      HIS   6  -4.890  15.655   5.929
   41    HE1  HIS   6           HE1      HIS   6  -4.817  13.401   2.357
   42    HE2  HIS   6           HE2      HIS   6  -3.764  13.741   4.623
   43    H    HIS   7           H        HIS   7  -5.090  20.809   4.192
   44    HA   HIS   7           HA       HIS   7  -3.778  20.335   1.599
   45    HB2  HIS   7           HB2      HIS   7  -4.341  22.968   3.045
   46    HB3  HIS   7           HB3      HIS   7  -3.771  22.795   1.387
   47    HD2  HIS   7           HD2      HIS   7  -7.038  23.081   3.290
   48    HE1  HIS   7           HE1      HIS   7  -7.992  21.653  -0.572
   49    HE2  HIS   7           HE2      HIS   7  -8.883  22.796   1.498
   50    H    HIS   8           H        HIS   8  -1.736  19.543   1.874
   51    HA   HIS   8           HA       HIS   8   0.278  21.278   3.059
   52    HB2  HIS   8           HB2      HIS   8  -0.486  19.778   4.964
   53    HB3  HIS   8           HB3      HIS   8   0.090  18.394   4.044
   54    HD2  HIS   8           HD2      HIS   8   1.463  21.283   6.254
   55    HE1  HIS   8           HE1      HIS   8   4.698  18.818   5.088
   56    HE2  HIS   8           HE2      HIS   8   3.933  20.626   6.679
   57    H    SER   9           H        SER   9   2.414  20.813   2.343
   58    HA   SER   9           HA       SER   9   2.863  18.773   0.274
   59    HB2  SER   9           HB2      SER   9   3.234  21.761  -0.255
   60    HB3  SER   9           HB3      SER   9   3.727  20.469  -1.351
   61    HG   SER   9           HG       SER   9   1.046  20.844  -0.482
   62    H    HIS  10           H        HIS  10   4.640  17.773   1.144
   63    HA   HIS  10           HA       HIS  10   7.029  19.433   1.772
   64    HB2  HIS  10           HB2      HIS  10   5.946  18.367   3.827
   65    HB3  HIS  10           HB3      HIS  10   6.356  16.796   3.158
   66    HD1  HIS  10           HD1      HIS  10   7.461  17.554   5.873
   67    HD2  HIS  10           HD2      HIS  10   9.530  18.316   2.353
   68    HE1  HIS  10           HE1      HIS  10   9.870  17.706   6.521
   69    HE2  HIS  10           HE2      HIS  10  11.100  17.937   4.351
   70    H    MET  11           H        MET  11   8.576  19.089   0.332
   71    HA   MET  11           HA       MET  11   8.767  16.554  -1.190
   72    HB2  MET  11           HB2      MET  11   8.566  18.642  -2.509
   73    HB3  MET  11           HB3      MET  11   9.974  19.318  -1.706
   74    HG2  MET  11           HG2      MET  11  11.392  17.579  -2.741
   75    HG3  MET  11           HG3      MET  11   9.974  16.911  -3.550
   76    HE1  MET  11           HE1      MET  11  11.687  21.117  -4.474
   77    HE2  MET  11           HE2      MET  11  12.383  20.026  -3.273
   78    HE3  MET  11           HE3      MET  11  10.809  20.770  -2.986
   79    H    GLY  12           H        GLY  12  10.329  15.131  -0.653
   80    HA2  GLY  12           HA2      GLY  12  13.040  15.775  -0.142
   81    HA3  GLY  12           HA3      GLY  12  12.238  15.437   1.390
   82    H    GLY  13           H        GLY  13  12.405  13.360   2.038
   83    HA2  GLY  13           HA2      GLY  13  12.292  11.041   1.976
   84    HA3  GLY  13           HA3      GLY  13  12.058  11.101   0.237
   85    H    GLY  14           H        GLY  14  13.701  10.245  -0.917
   86    HA2  GLY  14           HA2      GLY  14  15.804   9.618  -1.609
   87    HA3  GLY  14           HA3      GLY  14  16.466  10.799  -0.488
   88    H    LYS  15           H        LYS  15  18.168   9.400   0.148
   89    HA   LYS  15           HA       LYS  15  17.576   6.864   1.482
   90    HB2  LYS  15           HB2      LYS  15  20.186   8.367   1.038
   91    HB3  LYS  15           HB3      LYS  15  20.076   6.797   1.832
   92    HG2  LYS  15           HG2      LYS  15  19.199   5.789  -0.236
   93    HG3  LYS  15           HG3      LYS  15  19.236   7.364  -1.034
   94    HD2  LYS  15           HD2      LYS  15  21.692   7.435  -0.838
   95    HD3  LYS  15           HD3      LYS  15  21.687   5.903   0.040
   96    HE2  LYS  15           HE2      LYS  15  20.759   6.273  -2.831
   97    HE3  LYS  15           HE3      LYS  15  22.327   5.633  -2.339
   98    HZ1  LYS  15           HZ1      LYS  15  19.700   4.410  -1.694
   99    HZ2  LYS  15           HZ2      LYS  15  21.212   3.805  -1.249
  100    HZ3  LYS  15           HZ3      LYS  15  20.775   3.871  -2.880
  101    H    GLY  16           H        GLY  16  16.544   7.174   3.413
  102    HA2  GLY  16           HA2      GLY  16  17.984   8.408   5.612
  103    HA3  GLY  16           HA3      GLY  16  16.515   9.256   5.157
  104    HA   PRO  17           HA       PRO  17  15.413   5.015   7.419
  105    HB2  PRO  17           HB2      PRO  17  17.127   5.355   9.825
  106    HB3  PRO  17           HB3      PRO  17  16.928   3.935   8.790
  107    HG2  PRO  17           HG2      PRO  17  19.221   5.382   8.795
  108    HG3  PRO  17           HG3      PRO  17  18.606   4.600   7.322
  109    HD2  PRO  17           HD2      PRO  17  18.365   7.497   8.166
  110    HD3  PRO  17           HD3      PRO  17  18.813   6.822   6.581
  111    H    ALA  18           H        ALA  18  13.419   5.887   7.939
  112    HA   ALA  18           HA       ALA  18  13.187   7.807  10.200
  113    HB1  ALA  18           HB1      ALA  18  11.311   7.405   7.848
  114    HB2  ALA  18           HB2      ALA  18  12.484   8.711   8.017
  115    HB3  ALA  18           HB3      ALA  18  11.124   8.603   9.135
  116    H    ALA  19           H        ALA  19  10.490   7.617  10.741
  117    HA   ALA  19           HA       ALA  19   9.817   4.858  11.470
  118    HB1  ALA  19           HB1      ALA  19   9.645   5.371  13.881
  119    HB2  ALA  19           HB2      ALA  19  10.258   7.003  13.591
  120    HB3  ALA  19           HB3      ALA  19  11.301   5.608  13.311
  121    H    GLU  20           H        GLU  20   7.715   5.164  13.118
  122    HA   GLU  20           HA       GLU  20   5.632   6.244  11.529
  123    HB2  GLU  20           HB2      GLU  20   4.141   5.726  13.505
  124    HB3  GLU  20           HB3      GLU  20   5.088   4.373  12.904
  125    HG2  GLU  20           HG2      GLU  20   6.623   4.518  14.774
  126    HG3  GLU  20           HG3      GLU  20   5.883   6.019  15.328
  127    H    GLU  21           H        GLU  21   6.162   8.371  11.147
  128    HA   GLU  21           HA       GLU  21   5.853  10.346  13.333
  129    HB2  GLU  21           HB2      GLU  21   7.514  10.400  10.777
  130    HB3  GLU  21           HB3      GLU  21   7.159  11.873  11.667
  131    HG2  GLU  21           HG2      GLU  21   8.674   9.477  12.753
  132    HG3  GLU  21           HG3      GLU  21   9.395  10.985  12.192
  133    HA   PRO  22           HA       PRO  22   2.550  12.206  10.743
  134    HB2  PRO  22           HB2      PRO  22   2.406  14.695  11.781
  135    HB3  PRO  22           HB3      PRO  22   1.949  13.289  12.753
  136    HG2  PRO  22           HG2      PRO  22   4.527  14.852  12.786
  137    HG3  PRO  22           HG3      PRO  22   3.549  14.279  14.156
  138    HD2  PRO  22           HD2      PRO  22   5.781  12.950  13.193
  139    HD3  PRO  22           HD3      PRO  22   4.456  12.152  14.067
  140    H    LEU  23           H        LEU  23   2.766  15.107  10.077
  141    HA   LEU  23           HA       LEU  23   4.661  15.000   7.868
  142    HB2  LEU  23           HB2      LEU  23   2.817  17.249   8.779
  143    HB3  LEU  23           HB3      LEU  23   3.659  17.171   7.238
  144    HG   LEU  23           HG       LEU  23   1.528  15.175   8.114
  145   HD11  LEU  23          HD11      LEU  23   0.504  17.374   7.836
  146   HD12  LEU  23          HD12      LEU  23  -0.004  16.277   6.555
  147   HD13  LEU  23          HD13      LEU  23   1.208  17.516   6.223
  148   HD21  LEU  23          HD21      LEU  23   2.840  15.577   5.401
  149   HD22  LEU  23          HD22      LEU  23   1.524  14.455   5.752
  150   HD23  LEU  23          HD23      LEU  23   3.102  14.216   6.497
  151    H    SER  24           H        SER  24   6.468  14.727   9.531
  152    HA   SER  24           HA       SER  24   7.941  17.172   9.928
  153    HB2  SER  24           HB2      SER  24   8.120  17.057  12.404
  154    HB3  SER  24           HB3      SER  24   6.438  17.258  11.924
  155    HG   SER  24           HG       SER  24   7.724  14.910  12.858
  156    H    LEU  25           H        LEU  25  10.048  16.736  11.096
  157    HA   LEU  25           HA       LEU  25  11.929  15.657  11.672
  158    HB2  LEU  25           HB2      LEU  25  10.272  14.167  12.922
  159    HB3  LEU  25           HB3      LEU  25  10.371  13.034  11.597
  160    HG   LEU  25           HG       LEU  25  11.718  12.458  13.695
  161   HD11  LEU  25          HD11      LEU  25  12.204  11.318  11.587
  162   HD12  LEU  25          HD12      LEU  25  13.667  11.559  12.535
  163   HD13  LEU  25          HD13      LEU  25  13.343  12.593  11.141
  164   HD21  LEU  25          HD21      LEU  25  13.871  13.560  14.068
  165   HD22  LEU  25          HD22      LEU  25  12.545  14.709  14.216
  166   HD23  LEU  25          HD23      LEU  25  13.542  14.699  12.758
  167    H    LEU  26           H        LEU  26  10.579  13.091   9.583
  168    HA   LEU  26           HA       LEU  26  12.442  13.711   7.397
  169    HB2  LEU  26           HB2      LEU  26  13.436  12.013   9.123
  170    HB3  LEU  26           HB3      LEU  26  12.270  10.871   8.500
  171    HG   LEU  26           HG       LEU  26  14.366  12.185   6.713
  172   HD11  LEU  26          HD11      LEU  26  15.788  10.204   7.004
  173   HD12  LEU  26          HD12      LEU  26  14.661   9.548   8.196
  174   HD13  LEU  26          HD13      LEU  26  15.543  11.037   8.538
  175   HD21  LEU  26          HD21      LEU  26  14.016  10.214   5.249
  176   HD22  LEU  26          HD22      LEU  26  12.528  11.125   5.479
  177   HD23  LEU  26          HD23      LEU  26  12.772   9.614   6.353
  178    H    ASP  27           H        ASP  27  11.628  13.031   5.378
  179    HA   ASP  27           HA       ASP  27   8.806  12.577   5.164
  180    HB2  ASP  27           HB2      ASP  27  10.986  12.498   3.040
  181    HB3  ASP  27           HB3      ASP  27   9.260  12.480   2.708
  182    H    ASP  28           H        ASP  28   8.813  10.592   6.504
  183    HA   ASP  28           HA       ASP  28   9.830   8.096   5.636
  184    HB2  ASP  28           HB2      ASP  28   9.059   8.606   7.979
  185    HB3  ASP  28           HB3      ASP  28   7.393   8.637   7.404
  186    H    MET  29           H        MET  29   6.682   9.687   5.244
  187    HA   MET  29           HA       MET  29   5.246   7.843   3.770
  188    HB2  MET  29           HB2      MET  29   4.088   9.754   4.547
  189    HB3  MET  29           HB3      MET  29   5.239  10.872   3.836
  190    HG2  MET  29           HG2      MET  29   4.325  10.590   1.661
  191    HG3  MET  29           HG3      MET  29   3.428   9.149   2.133
  192    HE1  MET  29           HE1      MET  29   1.181   9.140   3.393
  193    HE2  MET  29           HE2      MET  29   0.544  10.530   4.273
  194    HE3  MET  29           HE3      MET  29   2.064   9.786   4.780
  195    H    ASN  30           H        ASN  30   7.538  10.278   2.515
  196    HA   ASN  30           HA       ASN  30   7.151   9.799  -0.258
  197    HB2  ASN  30           HB2      ASN  30   8.277  11.811   0.954
  198    HB3  ASN  30           HB3      ASN  30   9.733  10.833   0.989
  199   HD21  ASN  30          HD21      ASN  30   9.068   9.741  -1.814
  200   HD22  ASN  30          HD22      ASN  30   9.498  11.039  -2.848
  201    H    HIS  31           H        HIS  31   9.586   8.592   2.061
  202    HA   HIS  31           HA       HIS  31  11.110   6.926   0.372
  203    HB2  HIS  31           HB2      HIS  31  11.751   7.674   2.682
  204    HB3  HIS  31           HB3      HIS  31  10.538   6.597   3.359
  205    HD2  HIS  31           HD2      HIS  31  14.212   6.569   2.448
  206    HE1  HIS  31           HE1      HIS  31  13.015   2.519   2.756
  207    HE2  HIS  31           HE2      HIS  31  14.980   4.106   2.718
  208    H    CYS  32           H        CYS  32   8.272   6.223   2.368
  209    HA   CYS  32           HA       CYS  32   8.015   3.462   1.907
  210    HB2  CYS  32           HB2      CYS  32   6.010   5.540   2.843
  211    HB3  CYS  32           HB3      CYS  32   5.597   3.834   2.699
  212    HG   CYS  32           HG       CYS  32   7.540   5.369   4.977
  213    H    TYR  33           H        TYR  33   6.613   6.247   0.213
  214    HA   TYR  33           HA       TYR  33   4.823   4.874  -1.478
  215    HB2  TYR  33           HB2      TYR  33   5.982   7.616  -1.374
  216    HB3  TYR  33           HB3      TYR  33   5.510   7.115  -2.990
  217    HD1  TYR  33           HD1      TYR  33   3.117   5.799  -2.981
  218    HD2  TYR  33           HD2      TYR  33   4.293   8.836  -0.206
  219    HE1  TYR  33           HE1      TYR  33   0.768   6.345  -2.572
  220    HE2  TYR  33           HE2      TYR  33   1.937   9.369   0.205
  221    HH   TYR  33           HH       TYR  33  -0.194   9.129  -0.764
  222    H    SER  34           H        SER  34   8.200   5.859  -2.029
  223    HA   SER  34           HA       SER  34   8.475   4.782  -4.641
  224    HB2  SER  34           HB2      SER  34  10.072   6.430  -3.627
  225    HB3  SER  34           HB3      SER  34  10.667   5.165  -2.555
  226    HG   SER  34           HG       SER  34  10.768   5.146  -5.404
  227    H    ARG  35           H        ARG  35   9.066   3.424  -1.401
  228    HA   ARG  35           HA       ARG  35  10.154   0.934  -2.093
  229    HB2  ARG  35           HB2      ARG  35  10.156   2.123   0.153
  230    HB3  ARG  35           HB3      ARG  35   8.525   1.491   0.391
  231    HG2  ARG  35           HG2      ARG  35   9.310  -0.780   0.331
  232    HG3  ARG  35           HG3      ARG  35  10.910  -0.276  -0.216
  233    HD2  ARG  35           HD2      ARG  35  11.296   0.855   1.919
  234    HD3  ARG  35           HD3      ARG  35   9.686   0.382   2.454
  235    HE   ARG  35           HE       ARG  35  11.414  -1.807   1.676
  236   HH11  ARG  35          HH11      ARG  35  10.349   0.099   4.359
  237   HH12  ARG  35          HH12      ARG  35  10.810  -1.098   5.512
  238   HH21  ARG  35          HH21      ARG  35  11.997  -3.301   3.179
  239   HH22  ARG  35          HH22      ARG  35  11.751  -2.978   4.862
  240    H    LEU  36           H        LEU  36   6.736   1.933  -1.716
  241    HA   LEU  36           HA       LEU  36   5.483  -0.585  -2.049
  242    HB2  LEU  36           HB2      LEU  36   4.483   2.141  -3.000
  243    HB3  LEU  36           HB3      LEU  36   3.504   0.686  -2.908
  244    HG   LEU  36           HG       LEU  36   4.626   2.290  -0.590
  245   HD11  LEU  36          HD11      LEU  36   2.265   2.646  -0.001
  246   HD12  LEU  36          HD12      LEU  36   1.769   1.762  -1.446
  247   HD13  LEU  36          HD13      LEU  36   2.650   3.285  -1.598
  248   HD21  LEU  36          HD21      LEU  36   4.804  -0.088   0.002
  249   HD22  LEU  36          HD22      LEU  36   3.118  -0.349  -0.449
  250   HD23  LEU  36          HD23      LEU  36   3.516   0.679   0.929
  251    H    ARG  37           H        ARG  37   6.387   1.928  -4.387
  252    HA   ARG  37           HA       ARG  37   5.378   0.684  -6.727
  253    HB2  ARG  37           HB2      ARG  37   6.113   3.199  -6.121
  254    HB3  ARG  37           HB3      ARG  37   7.613   2.709  -6.883
  255    HG2  ARG  37           HG2      ARG  37   5.260   2.036  -8.539
  256    HG3  ARG  37           HG3      ARG  37   5.333   3.754  -8.162
  257    HD2  ARG  37           HD2      ARG  37   6.432   3.386 -10.266
  258    HD3  ARG  37           HD3      ARG  37   7.662   3.798  -9.072
  259    HE   ARG  37           HE       ARG  37   8.180   1.378  -8.963
  260   HH11  ARG  37          HH11      ARG  37   6.635   2.565 -11.815
  261   HH12  ARG  37          HH12      ARG  37   7.210   1.255 -12.782
  262   HH21  ARG  37          HH21      ARG  37   8.853  -0.297 -10.216
  263   HH22  ARG  37          HH22      ARG  37   8.427  -0.342 -11.892
  264    H    GLU  38           H        GLU  38   8.380   0.259  -5.016
  265    HA   GLU  38           HA       GLU  38   9.983  -0.976  -7.030
  266    HB2  GLU  38           HB2      GLU  38  10.012  -1.442  -4.004
  267    HB3  GLU  38           HB3      GLU  38  11.265  -1.977  -5.114
  268    HG2  GLU  38           HG2      GLU  38  10.557   0.886  -4.458
  269    HG3  GLU  38           HG3      GLU  38  11.957  -0.001  -3.871
  270    H    LEU  39           H        LEU  39   7.573  -2.168  -4.763
  271    HA   LEU  39           HA       LEU  39   8.117  -4.991  -5.323
  272    HB2  LEU  39           HB2      LEU  39   6.266  -3.699  -3.285
  273    HB3  LEU  39           HB3      LEU  39   6.692  -5.405  -3.353
  274    HG   LEU  39           HG       LEU  39   8.647  -3.138  -2.787
  275   HD11  LEU  39          HD11      LEU  39   7.503  -5.169  -0.850
  276   HD12  LEU  39          HD12      LEU  39   7.082  -3.458  -0.917
  277   HD13  LEU  39          HD13      LEU  39   8.718  -3.941  -0.481
  278   HD21  LEU  39          HD21      LEU  39  10.267  -4.923  -2.225
  279   HD22  LEU  39          HD22      LEU  39   9.780  -4.994  -3.915
  280   HD23  LEU  39          HD23      LEU  39   9.107  -6.145  -2.758
  281    H    VAL  40           H        VAL  40   6.056  -2.682  -6.638
  282    HA   VAL  40           HA       VAL  40   3.881  -4.608  -7.213
  283    HB   VAL  40           HB       VAL  40   3.981  -1.620  -7.880
  284   HG11  VAL  40          HG11      VAL  40   1.631  -3.562  -7.969
  285   HG12  VAL  40          HG12      VAL  40   2.446  -2.850  -9.363
  286   HG13  VAL  40          HG13      VAL  40   1.536  -1.822  -8.256
  287   HG21  VAL  40          HG21      VAL  40   2.603  -3.017  -5.548
  288   HG22  VAL  40          HG22      VAL  40   2.426  -1.309  -5.967
  289   HG23  VAL  40          HG23      VAL  40   3.995  -1.928  -5.453
  290    HA   PRO  41           HA       PRO  41   5.810  -4.918 -11.434
  291    HB2  PRO  41           HB2      PRO  41   5.117  -7.483 -11.959
  292    HB3  PRO  41           HB3      PRO  41   6.488  -7.101 -10.904
  293    HG2  PRO  41           HG2      PRO  41   3.675  -7.876 -10.143
  294    HG3  PRO  41           HG3      PRO  41   5.213  -8.469  -9.480
  295    HD2  PRO  41           HD2      PRO  41   3.694  -6.508  -8.276
  296    HD3  PRO  41           HD3      PRO  41   5.452  -6.636  -8.076
  297    H    GLY  42           H        GLY  42   2.625  -5.112 -10.140
  298    HA2  GLY  42           HA2      GLY  42   1.038  -5.433 -12.477
  299    HA3  GLY  42           HA3      GLY  42   0.522  -4.711 -10.963
  300    H    VAL  43           H        VAL  43   2.973  -2.776 -11.513
  301    HA   VAL  43           HA       VAL  43   1.690  -0.537 -12.575
  302    HB   VAL  43           HB       VAL  43   4.668  -1.224 -12.534
  303   HG11  VAL  43          HG11      VAL  43   3.404   1.478 -13.124
  304   HG12  VAL  43          HG12      VAL  43   4.350   0.491 -14.238
  305   HG13  VAL  43          HG13      VAL  43   5.123   1.208 -12.826
  306   HG21  VAL  43          HG21      VAL  43   3.660  -1.099 -10.301
  307   HG22  VAL  43          HG22      VAL  43   3.009   0.504 -10.650
  308   HG23  VAL  43          HG23      VAL  43   4.756   0.263 -10.548
  309    HA   PRO  44           HA       PRO  44   1.548  -1.684 -17.014
  310    HB2  PRO  44           HB2      PRO  44   0.781   1.176 -17.423
  311    HB3  PRO  44           HB3      PRO  44  -0.082  -0.296 -17.892
  312    HG2  PRO  44           HG2      PRO  44  -0.956   1.217 -15.855
  313    HG3  PRO  44           HG3      PRO  44  -1.053  -0.559 -15.775
  314    HD2  PRO  44           HD2      PRO  44   0.984   1.288 -14.502
  315    HD3  PRO  44           HD3      PRO  44   0.132  -0.107 -13.794
  316    H    ARG  45           H        ARG  45   2.787  -1.273 -18.888
  317    HA   ARG  45           HA       ARG  45   5.491  -0.643 -18.406
  318    HB2  ARG  45           HB2      ARG  45   4.715  -2.343 -20.010
  319    HB3  ARG  45           HB3      ARG  45   4.068  -1.079 -21.049
  320    HG2  ARG  45           HG2      ARG  45   6.343  -0.206 -21.425
  321    HG3  ARG  45           HG3      ARG  45   7.005  -1.451 -20.361
  322    HD2  ARG  45           HD2      ARG  45   5.513  -1.950 -22.952
  323    HD3  ARG  45           HD3      ARG  45   7.264  -2.035 -22.744
  324    HE   ARG  45           HE       ARG  45   6.179  -3.773 -20.884
  325   HH11  ARG  45          HH11      ARG  45   6.161  -3.584 -24.354
  326   HH12  ARG  45          HH12      ARG  45   6.036  -5.297 -24.530
  327   HH21  ARG  45          HH21      ARG  45   6.025  -5.938 -21.169
  328   HH22  ARG  45          HH22      ARG  45   5.950  -6.602 -22.756
  329    H    GLY  46           H        GLY  46   6.251   1.385 -18.096
  330    HA2  GLY  46           HA2      GLY  46   7.148   3.398 -18.744
  331    HA3  GLY  46           HA3      GLY  46   6.360   3.233 -20.299
  332    H    THR  47           H        THR  47   4.260   3.035 -17.552
  333    HA   THR  47           HA       THR  47   2.930   5.512 -18.308
  334    HB   THR  47           HB       THR  47   2.157   3.598 -16.051
  335    HG1  THR  47           HG1      THR  47   0.627   2.904 -17.818
  336   HG21  THR  47          HG21      THR  47   0.501   5.610 -17.633
  337   HG22  THR  47          HG22      THR  47   1.010   5.805 -15.954
  338   HG23  THR  47          HG23      THR  47  -0.117   4.519 -16.389
  339    H    GLN  48           H        GLN  48   2.676   7.343 -17.050
  340    HA   GLN  48           HA       GLN  48   4.867   8.195 -15.473
  341    HB2  GLN  48           HB2      GLN  48   2.128   9.511 -15.794
  342    HB3  GLN  48           HB3      GLN  48   3.542  10.287 -15.095
  343    HG2  GLN  48           HG2      GLN  48   3.446  11.148 -17.275
  344    HG3  GLN  48           HG3      GLN  48   4.686   9.907 -17.371
  345   HE21  GLN  48          HE21      GLN  48   1.461  10.808 -18.326
  346   HE22  GLN  48          HE22      GLN  48   1.253   9.579 -19.521
  347    H    LEU  49           H        LEU  49   1.468   7.615 -14.564
  348    HA   LEU  49           HA       LEU  49   0.356   7.067 -12.716
  349    HB2  LEU  49           HB2      LEU  49   3.027   6.148 -11.613
  350    HB3  LEU  49           HB3      LEU  49   1.477   5.846 -10.845
  351    HG   LEU  49           HG       LEU  49   2.500   4.695 -13.460
  352   HD11  LEU  49          HD11      LEU  49   1.624   3.365 -10.880
  353   HD12  LEU  49          HD12      LEU  49   3.284   3.553 -11.452
  354   HD13  LEU  49          HD13      LEU  49   2.158   2.531 -12.342
  355   HD21  LEU  49          HD21      LEU  49   0.160   5.292 -13.848
  356   HD22  LEU  49          HD22      LEU  49  -0.326   4.479 -12.359
  357   HD23  LEU  49          HD23      LEU  49   0.322   3.545 -13.708
  358    H    SER  50           H        SER  50  -0.598   8.519 -11.486
  359    HA   SER  50           HA       SER  50   0.733  10.542  -9.915
  360    HB2  SER  50           HB2      SER  50  -1.537  10.971 -10.747
  361    HB3  SER  50           HB3      SER  50  -2.159   9.551  -9.906
  362    HG   SER  50           HG       SER  50  -2.219  11.915  -8.968
  363    H    GLN  51           H        GLN  51   0.536  10.681  -7.511
  364    HA   GLN  51           HA       GLN  51   1.401   8.348  -6.135
  365    HB2  GLN  51           HB2      GLN  51   0.306  10.947  -4.975
  366    HB3  GLN  51           HB3      GLN  51   1.168   9.711  -4.060
  367    HG2  GLN  51           HG2      GLN  51   3.181  10.102  -5.465
  368    HG3  GLN  51           HG3      GLN  51   2.319  11.378  -6.322
  369   HE21  GLN  51          HE21      GLN  51   1.842  13.331  -5.180
  370   HE22  GLN  51          HE22      GLN  51   2.701  13.766  -3.751
  371    H    VAL  52           H        VAL  52  -1.771   9.700  -6.695
  372    HA   VAL  52           HA       VAL  52  -3.231   8.101  -4.805
  373    HB   VAL  52           HB       VAL  52  -4.416   9.177  -7.411
  374   HG11  VAL  52          HG11      VAL  52  -5.878   7.735  -6.076
  375   HG12  VAL  52          HG12      VAL  52  -6.471   9.394  -6.056
  376   HG13  VAL  52          HG13      VAL  52  -5.621   8.750  -4.650
  377   HG21  VAL  52          HG21      VAL  52  -3.161  11.046  -6.458
  378   HG22  VAL  52          HG22      VAL  52  -3.921  10.797  -4.887
  379   HG23  VAL  52          HG23      VAL  52  -4.893  11.324  -6.262
  380    H    GLU  53           H        GLU  53  -2.449   7.780  -8.285
  381    HA   GLU  53           HA       GLU  53  -3.730   5.317  -8.784
  382    HB2  GLU  53           HB2      GLU  53  -1.259   6.504 -10.112
  383    HB3  GLU  53           HB3      GLU  53  -2.073   5.048 -10.684
  384    HG2  GLU  53           HG2      GLU  53  -4.177   6.479 -10.943
  385    HG3  GLU  53           HG3      GLU  53  -3.146   7.882 -10.656
  386    H    ILE  54           H        ILE  54  -0.487   6.024  -7.472
  387    HA   ILE  54           HA       ILE  54   0.607   3.454  -7.440
  388    HB   ILE  54           HB       ILE  54   0.989   5.740  -5.453
  389   HG12  ILE  54          HG12      ILE  54   2.747   4.770  -7.767
  390   HG13  ILE  54          HG13      ILE  54   1.728   6.202  -7.792
  391   HG21  ILE  54          HG21      ILE  54   1.591   3.663  -4.291
  392   HG22  ILE  54          HG22      ILE  54   3.047   4.588  -4.649
  393   HG23  ILE  54          HG23      ILE  54   2.637   3.179  -5.631
  394   HD11  ILE  54          HD11      ILE  54   4.145   5.775  -6.042
  395   HD12  ILE  54          HD12      ILE  54   3.113   7.209  -6.037
  396   HD13  ILE  54          HD13      ILE  54   4.041   6.792  -7.478
  397    H    LEU  55           H        LEU  55  -1.308   5.041  -4.842
  398    HA   LEU  55           HA       LEU  55  -1.540   2.940  -3.032
  399    HB2  LEU  55           HB2      LEU  55  -3.607   5.068  -3.692
  400    HB3  LEU  55           HB3      LEU  55  -3.627   4.068  -2.248
  401    HG   LEU  55           HG       LEU  55  -1.493   6.125  -2.935
  402   HD11  LEU  55          HD11      LEU  55  -2.418   7.432  -1.064
  403   HD12  LEU  55          HD12      LEU  55  -3.692   6.231  -0.841
  404   HD13  LEU  55          HD13      LEU  55  -3.624   7.181  -2.327
  405   HD21  LEU  55          HD21      LEU  55  -0.614   5.708  -0.666
  406   HD22  LEU  55          HD22      LEU  55  -0.527   4.258  -1.664
  407   HD23  LEU  55          HD23      LEU  55  -1.791   4.412  -0.443
  408    H    GLN  56           H        GLN  56  -3.730   3.721  -5.733
  409    HA   GLN  56           HA       GLN  56  -5.618   1.633  -5.278
  410    HB2  GLN  56           HB2      GLN  56  -5.075   3.328  -7.747
  411    HB3  GLN  56           HB3      GLN  56  -6.467   2.259  -7.569
  412    HG2  GLN  56           HG2      GLN  56  -7.304   3.568  -5.697
  413    HG3  GLN  56           HG3      GLN  56  -5.853   4.572  -5.701
  414   HE21  GLN  56          HE21      GLN  56  -5.605   6.117  -7.353
  415   HE22  GLN  56          HE22      GLN  56  -6.936   6.660  -8.304
  416    H    ARG  57           H        ARG  57  -2.724   1.813  -7.317
  417    HA   ARG  57           HA       ARG  57  -3.146  -0.780  -8.541
  418    HB2  ARG  57           HB2      ARG  57  -0.744   1.078  -8.629
  419    HB3  ARG  57           HB3      ARG  57  -0.893  -0.418  -9.558
  420    HG2  ARG  57           HG2      ARG  57  -2.894   0.483 -10.701
  421    HG3  ARG  57           HG3      ARG  57  -2.758   1.971  -9.765
  422    HD2  ARG  57           HD2      ARG  57  -0.508   2.342 -10.811
  423    HD3  ARG  57           HD3      ARG  57  -0.811   0.942 -11.849
  424    HE   ARG  57           HE       ARG  57  -2.007   3.576 -12.040
  425   HH11  ARG  57          HH11      ARG  57  -2.386   0.259 -13.015
  426   HH12  ARG  57          HH12      ARG  57  -3.335   0.688 -14.398
  427   HH21  ARG  57          HH21      ARG  57  -3.218   4.061 -13.795
  428   HH22  ARG  57          HH22      ARG  57  -3.797   2.802 -14.827
  429    H    VAL  58           H        VAL  58  -1.601   0.368  -5.629
  430    HA   VAL  58           HA       VAL  58  -0.315  -2.120  -4.994
  431    HB   VAL  58           HB       VAL  58  -1.233   0.155  -3.166
  432   HG11  VAL  58          HG11      VAL  58   0.099  -0.911  -1.361
  433   HG12  VAL  58          HG12      VAL  58   0.386  -2.310  -2.402
  434   HG13  VAL  58          HG13      VAL  58  -1.251  -1.929  -1.866
  435   HG21  VAL  58          HG21      VAL  58   1.570  -0.671  -4.052
  436   HG22  VAL  58          HG22      VAL  58   1.177   0.680  -2.982
  437   HG23  VAL  58          HG23      VAL  58   0.661   0.711  -4.665
  438    H    ILE  59           H        ILE  59  -3.573  -0.750  -4.252
  439    HA   ILE  59           HA       ILE  59  -4.749  -2.931  -2.941
  440    HB   ILE  59           HB       ILE  59  -6.045  -1.061  -4.990
  441   HG12  ILE  59          HG12      ILE  59  -6.094  -0.852  -1.939
  442   HG13  ILE  59          HG13      ILE  59  -5.015   0.071  -2.976
  443   HG21  ILE  59          HG21      ILE  59  -8.230  -1.647  -3.982
  444   HG22  ILE  59          HG22      ILE  59  -7.437  -2.830  -2.941
  445   HG23  ILE  59          HG23      ILE  59  -7.448  -3.062  -4.688
  446   HD11  ILE  59          HD11      ILE  59  -6.896   1.400  -2.255
  447   HD12  ILE  59          HD12      ILE  59  -8.023   0.241  -2.957
  448   HD13  ILE  59          HD13      ILE  59  -6.943   1.169  -4.003
  449    H    ASP  60           H        ASP  60  -4.720  -2.235  -6.432
  450    HA   ASP  60           HA       ASP  60  -5.757  -4.535  -7.560
  451    HB2  ASP  60           HB2      ASP  60  -5.378  -2.508  -8.827
  452    HB3  ASP  60           HB3      ASP  60  -3.653  -2.553  -8.511
  453    H    TYR  61           H        TYR  61  -2.360  -3.877  -6.726
  454    HA   TYR  61           HA       TYR  61  -1.115  -6.249  -7.551
  455    HB2  TYR  61           HB2      TYR  61   0.257  -4.383  -6.963
  456    HB3  TYR  61           HB3      TYR  61  -0.508  -4.201  -5.394
  457    HD1  TYR  61           HD1      TYR  61   1.637  -6.626  -7.310
  458    HD2  TYR  61           HD2      TYR  61   0.632  -5.008  -3.472
  459    HE1  TYR  61           HE1      TYR  61   3.496  -7.856  -6.298
  460    HE2  TYR  61           HE2      TYR  61   2.513  -6.238  -2.474
  461    HH   TYR  61           HH       TYR  61   4.925  -7.750  -4.356
  462    H    ILE  62           H        ILE  62  -2.480  -5.432  -4.357
  463    HA   ILE  62           HA       ILE  62  -1.873  -7.858  -3.029
  464    HB   ILE  62           HB       ILE  62  -3.943  -5.704  -2.387
  465   HG12  ILE  62          HG12      ILE  62  -1.150  -6.152  -1.199
  466   HG13  ILE  62          HG13      ILE  62  -1.540  -4.936  -2.408
  467   HG21  ILE  62          HG21      ILE  62  -2.932  -7.928  -0.587
  468   HG22  ILE  62          HG22      ILE  62  -4.566  -7.772  -1.230
  469   HG23  ILE  62          HG23      ILE  62  -3.960  -6.589  -0.074
  470   HD11  ILE  62          HD11      ILE  62  -3.015  -3.811  -0.809
  471   HD12  ILE  62          HD12      ILE  62  -1.371  -3.964  -0.191
  472   HD13  ILE  62          HD13      ILE  62  -2.636  -5.038   0.405
  473    H    LEU  63           H        LEU  63  -4.728  -6.805  -4.863
  474    HA   LEU  63           HA       LEU  63  -6.456  -8.999  -4.328
  475    HB2  LEU  63           HB2      LEU  63  -6.317  -7.218  -6.798
  476    HB3  LEU  63           HB3      LEU  63  -7.655  -8.283  -6.398
  477    HG   LEU  63           HG       LEU  63  -6.803  -5.872  -4.750
  478   HD11  LEU  63          HD11      LEU  63  -7.724  -5.182  -6.913
  479   HD12  LEU  63          HD12      LEU  63  -8.809  -4.752  -5.595
  480   HD13  LEU  63          HD13      LEU  63  -9.175  -6.145  -6.618
  481   HD21  LEU  63          HD21      LEU  63  -9.236  -7.658  -4.428
  482   HD22  LEU  63          HD22      LEU  63  -8.895  -6.193  -3.501
  483   HD23  LEU  63          HD23      LEU  63  -7.839  -7.594  -3.350
  484    H    ASP  64           H        ASP  64  -3.882  -8.502  -6.694
  485    HA   ASP  64           HA       ASP  64  -4.338 -10.860  -8.265
  486    HB2  ASP  64           HB2      ASP  64  -3.158  -8.867  -9.150
  487    HB3  ASP  64           HB3      ASP  64  -1.849  -9.107  -7.997
  488    H    LEU  65           H        LEU  65  -2.263 -10.105  -5.472
  489    HA   LEU  65           HA       LEU  65  -0.769 -12.497  -5.313
  490    HB2  LEU  65           HB2      LEU  65  -1.708 -10.722  -3.024
  491    HB3  LEU  65           HB3      LEU  65  -0.425 -11.918  -2.923
  492    HG   LEU  65           HG       LEU  65  -0.353  -9.382  -4.597
  493   HD11  LEU  65          HD11      LEU  65  -0.165  -8.922  -2.206
  494   HD12  LEU  65          HD12      LEU  65   1.362  -8.622  -3.025
  495   HD13  LEU  65          HD13      LEU  65   1.156 -10.087  -2.070
  496   HD21  LEU  65          HD21      LEU  65   1.813 -11.486  -4.233
  497   HD22  LEU  65          HD22      LEU  65   1.996  -9.952  -5.085
  498   HD23  LEU  65          HD23      LEU  65   0.901 -11.180  -5.716
  499    H    GLN  66           H        GLN  66  -3.842 -11.593  -3.852
  500    HA   GLN  66           HA       GLN  66  -4.351 -14.215  -2.669
  501    HB2  GLN  66           HB2      GLN  66  -6.131 -11.739  -2.831
  502    HB3  GLN  66           HB3      GLN  66  -6.397 -13.141  -1.799
  503    HG2  GLN  66           HG2      GLN  66  -4.408 -12.601  -0.481
  504    HG3  GLN  66           HG3      GLN  66  -4.006 -11.281  -1.575
  505   HE21  GLN  66          HE21      GLN  66  -5.334  -9.409  -1.540
  506   HE22  GLN  66          HE22      GLN  66  -6.322  -9.023  -0.179
  507    H    VAL  67           H        VAL  67  -6.867 -14.906  -3.004
  508    HA   VAL  67           HA       VAL  67  -7.324 -15.331  -5.855
  509    HB   VAL  67           HB       VAL  67  -9.249 -16.751  -5.154
  510   HG11  VAL  67          HG11      VAL  67  -7.927 -18.571  -4.123
  511   HG12  VAL  67          HG12      VAL  67  -6.642 -17.424  -3.739
  512   HG13  VAL  67          HG13      VAL  67  -7.038 -17.773  -5.422
  513   HG21  VAL  67          HG21      VAL  67  -9.633 -17.296  -2.774
  514   HG22  VAL  67          HG22      VAL  67  -9.918 -15.582  -3.077
  515   HG23  VAL  67          HG23      VAL  67  -8.428 -16.100  -2.288
  516    H    VAL  68           H        VAL  68  -8.957 -14.453  -7.076
  517    HA   VAL  68           HA       VAL  68 -10.082 -11.929  -6.228
  518    HB   VAL  68           HB       VAL  68 -10.534 -13.429  -8.856
  519   HG11  VAL  68          HG11      VAL  68 -12.212 -11.675  -8.496
  520   HG12  VAL  68          HG12      VAL  68 -11.116 -11.217  -9.799
  521   HG13  VAL  68          HG13      VAL  68 -10.941 -10.483  -8.203
  522   HG21  VAL  68          HG21      VAL  68  -8.134 -13.058  -8.502
  523   HG22  VAL  68          HG22      VAL  68  -8.414 -11.343  -8.202
  524   HG23  VAL  68          HG23      VAL  68  -8.727 -12.022  -9.801
  525    H1   MET   1           H1       MET   1   0.748  43.391 -21.356
  526    H2   MET   1           H2       MET   1   0.760  42.213 -20.149
  527    H3   MET   1           H3       MET   1   2.001  42.258 -21.296
  528    HA   MET   1           HA       MET   1   1.426  44.367 -19.295
  529    HB2  MET   1           HB2      MET   1   3.462  43.612 -18.131
  530    HB3  MET   1           HB3      MET   1   2.302  42.296 -18.249
  531    HG2  MET   1           HG2      MET   1   3.586  41.314 -20.097
  532    HG3  MET   1           HG3      MET   1   4.736  42.654 -20.016
  533    HE1  MET   1           HE1      MET   1   6.870  39.705 -18.570
  534    HE2  MET   1           HE2      MET   1   6.813  41.009 -19.755
  535    HE3  MET   1           HE3      MET   1   5.718  39.632 -19.903
  536    H    GLY   2           H        GLY   2   3.557  45.758 -19.049
  537    HA2  GLY   2           HA2      GLY   2   5.390  46.890 -19.947
  538    HA3  GLY   2           HA3      GLY   2   5.177  46.045 -21.470
  539    H    HIS   3           H        HIS   3   2.567  46.722 -22.148
  540    HA   HIS   3           HA       HIS   3   2.874  49.357 -23.197
  541    HB2  HIS   3           HB2      HIS   3   0.589  48.989 -24.177
  542    HB3  HIS   3           HB3      HIS   3   1.751  47.727 -24.553
  543    HD2  HIS   3           HD2      HIS   3   1.152  45.193 -23.572
  544    HE1  HIS   3           HE1      HIS   3  -2.618  46.269 -21.999
  545    HE2  HIS   3           HE2      HIS   3  -1.170  44.363 -22.802
  546    H    HIS   4           H        HIS   4   1.288  51.123 -23.020
  547    HA   HIS   4           HA       HIS   4   1.109  51.831 -20.205
  548    HB2  HIS   4           HB2      HIS   4   0.801  54.138 -21.043
  549    HB3  HIS   4           HB3      HIS   4   2.179  53.367 -21.814
  550    HD2  HIS   4           HD2      HIS   4  -1.038  55.195 -22.780
  551    HE1  HIS   4           HE1      HIS   4   0.428  53.320 -26.276
  552    HE2  HIS   4           HE2      HIS   4  -1.227  54.994 -25.354
  553    H    HIS   5           H        HIS   5  -0.728  53.457 -19.673
  554    HA   HIS   5           HA       HIS   5  -3.399  52.317 -20.288
  555    HB2  HIS   5           HB2      HIS   5  -4.077  53.356 -18.084
  556    HB3  HIS   5           HB3      HIS   5  -2.875  52.087 -17.929
  557    HD2  HIS   5           HD2      HIS   5  -0.311  52.941 -17.092
  558    HE1  HIS   5           HE1      HIS   5  -1.542  56.876 -16.193
  559    HE2  HIS   5           HE2      HIS   5   0.384  55.251 -16.161
  560    H    HIS   6           H        HIS   6  -5.210  54.050 -20.042
  561    HA   HIS   6           HA       HIS   6  -4.402  56.610 -21.330
  562    HB2  HIS   6           HB2      HIS   6  -6.337  56.444 -22.856
  563    HB3  HIS   6           HB3      HIS   6  -5.253  55.077 -23.076
  564    HD2  HIS   6           HD2      HIS   6  -6.313  52.569 -22.373
  565    HE1  HIS   6           HE1      HIS   6 -10.209  54.036 -21.629
  566    HE2  HIS   6           HE2      HIS   6  -8.824  51.984 -22.152
  567    H    HIS   7           H        HIS   7  -6.054  58.305 -21.241
  568    HA   HIS   7           HA       HIS   7  -7.640  58.283 -18.743
  569    HB2  HIS   7           HB2      HIS   7  -7.561  60.753 -18.887
  570    HB3  HIS   7           HB3      HIS   7  -5.945  60.066 -18.901
  571    HD2  HIS   7           HD2      HIS   7  -4.632  60.178 -21.470
  572    HE1  HIS   7           HE1      HIS   7  -7.198  63.234 -22.867
  573    HE2  HIS   7           HE2      HIS   7  -4.960  62.101 -23.171
  574    H    HIS   8           H        HIS   8  -8.310  57.411 -21.745
  575    HA   HIS   8           HA       HIS   8 -10.553  59.096 -22.453
  576    HB2  HIS   8           HB2      HIS   8  -9.082  57.958 -24.145
  577    HB3  HIS   8           HB3      HIS   8  -9.716  56.406 -23.621
  578    HD2  HIS   8           HD2      HIS   8 -11.938  55.607 -24.995
  579    HE1  HIS   8           HE1      HIS   8 -12.889  59.372 -26.663
  580    HE2  HIS   8           HE2      HIS   8 -13.638  56.983 -26.374
  581    H    SER   9           H        SER   9 -12.782  58.337 -22.654
  582    HA   SER   9           HA       SER   9 -13.892  57.049 -20.425
  583    HB2  SER   9           HB2      SER   9 -15.118  57.416 -23.190
  584    HB3  SER   9           HB3      SER   9 -16.017  57.040 -21.717
  585    HG   SER   9           HG       SER   9 -15.646  59.380 -22.557
  586    H    HIS  10           H        HIS  10 -14.275  54.925 -19.925
  587    HA   HIS  10           HA       HIS  10 -14.230  52.810 -21.949
  588    HB2  HIS  10           HB2      HIS  10 -12.428  51.526 -20.880
  589    HB3  HIS  10           HB3      HIS  10 -11.826  53.109 -21.351
  590    HD1  HIS  10           HD1      HIS  10 -12.292  50.901 -18.423
  591    HD2  HIS  10           HD2      HIS  10 -11.293  54.871 -19.128
  592    HE1  HIS  10           HE1      HIS  10 -11.328  51.747 -16.271
  593    HE2  HIS  10           HE2      HIS  10 -10.906  54.187 -16.678
  594    H    MET  11           H        MET  11 -15.005  50.781 -21.204
  595    HA   MET  11           HA       MET  11 -16.736  50.863 -18.801
  596    HB2  MET  11           HB2      MET  11 -16.754  48.994 -21.219
  597    HB3  MET  11           HB3      MET  11 -17.873  48.886 -19.864
  598    HG2  MET  11           HG2      MET  11 -19.000  49.956 -21.687
  599    HG3  MET  11           HG3      MET  11 -18.708  51.171 -20.443
  600    HE1  MET  11           HE1      MET  11 -19.478  51.706 -23.600
  601    HE2  MET  11           HE2      MET  11 -18.456  53.104 -23.922
  602    HE3  MET  11           HE3      MET  11 -19.344  52.999 -22.403
  603    H    GLY  12           H        GLY  12 -17.083  48.319 -18.093
  604    HA2  GLY  12           HA2      GLY  12 -14.499  47.337 -17.110
  605    HA3  GLY  12           HA3      GLY  12 -16.092  46.783 -16.635
  606    H    GLY  13           H        GLY  13 -16.767  46.535 -19.617
  607    HA2  GLY  13           HA2      GLY  13 -16.594  45.012 -21.346
  608    HA3  GLY  13           HA3      GLY  13 -15.150  44.338 -20.612
  609    H    GLY  14           H        GLY  14 -15.528  42.982 -18.640
  610    HA2  GLY  14           HA2      GLY  14 -17.910  41.819 -17.828
  611    HA3  GLY  14           HA3      GLY  14 -17.374  40.866 -19.208
  612    H    LYS  15           H        LYS  15 -17.294  40.965 -15.921
  613    HA   LYS  15           HA       LYS  15 -15.172  39.007 -15.697
  614    HB2  LYS  15           HB2      LYS  15 -13.726  40.235 -14.156
  615    HB3  LYS  15           HB3      LYS  15 -13.875  41.149 -15.648
  616    HG2  LYS  15           HG2      LYS  15 -15.572  42.616 -14.520
  617    HG3  LYS  15           HG3      LYS  15 -15.269  41.746 -13.016
  618    HD2  LYS  15           HD2      LYS  15 -13.265  43.422 -14.583
  619    HD3  LYS  15           HD3      LYS  15 -13.997  43.847 -13.036
  620    HE2  LYS  15           HE2      LYS  15 -12.035  41.583 -13.557
  621    HE3  LYS  15           HE3      LYS  15 -11.710  43.077 -12.682
  622    HZ1  LYS  15           HZ1      LYS  15 -13.363  42.373 -11.033
  623    HZ2  LYS  15           HZ2      LYS  15 -12.058  41.309 -11.147
  624    HZ3  LYS  15           HZ3      LYS  15 -13.540  40.903 -11.843
  625    H    GLY  16           H        GLY  16 -15.028  38.084 -13.475
  626    HA2  GLY  16           HA2      GLY  16 -16.188  38.463 -11.155
  627    HA3  GLY  16           HA3      GLY  16 -17.647  38.155 -12.082
  628    HA   PRO  17           HA       PRO  17 -15.188  33.943 -11.818
  629    HB2  PRO  17           HB2      PRO  17 -13.366  34.182  -9.511
  630    HB3  PRO  17           HB3      PRO  17 -12.986  33.761 -11.183
  631    HG2  PRO  17           HG2      PRO  17 -12.212  36.125 -10.056
  632    HG3  PRO  17           HG3      PRO  17 -12.577  35.965 -11.788
  633    HD2  PRO  17           HD2      PRO  17 -14.344  37.029  -9.574
  634    HD3  PRO  17           HD3      PRO  17 -14.042  37.702 -11.195
  635    H    ALA  18           H        ALA  18 -16.150  32.223 -10.764
  636    HA   ALA  18           HA       ALA  18 -17.883  32.759  -8.488
  637    HB1  ALA  18           HB1      ALA  18 -17.545  30.202 -10.095
  638    HB2  ALA  18           HB2      ALA  18 -18.722  31.475 -10.416
  639    HB3  ALA  18           HB3      ALA  18 -18.828  30.536  -8.927
  640    H    ALA  19           H        ALA  19 -17.687  32.005  -6.434
  641    HA   ALA  19           HA       ALA  19 -15.183  30.855  -5.507
  642    HB1  ALA  19           HB1      ALA  19 -16.264  32.705  -4.282
  643    HB2  ALA  19           HB2      ALA  19 -16.072  31.277  -3.265
  644    HB3  ALA  19           HB3      ALA  19 -17.656  31.671  -3.944
  645    H    GLU  20           H        GLU  20 -18.472  29.731  -6.077
  646    HA   GLU  20           HA       GLU  20 -18.311  27.321  -4.535
  647    HB2  GLU  20           HB2      GLU  20 -20.193  28.050  -6.815
  648    HB3  GLU  20           HB3      GLU  20 -20.335  26.587  -5.851
  649    HG2  GLU  20           HG2      GLU  20 -21.927  28.077  -4.958
  650    HG3  GLU  20           HG3      GLU  20 -20.590  28.090  -3.811
  651    H    GLU  21           H        GLU  21 -17.593  25.314  -5.087
  652    HA   GLU  21           HA       GLU  21 -16.904  24.629  -7.856
  653    HB2  GLU  21           HB2      GLU  21 -14.595  23.971  -7.266
  654    HB3  GLU  21           HB3      GLU  21 -14.848  25.691  -6.991
  655    HG2  GLU  21           HG2      GLU  21 -15.111  25.255  -4.557
  656    HG3  GLU  21           HG3      GLU  21 -14.830  23.538  -4.845
  657    HA   PRO  22           HA       PRO  22 -18.121  20.469  -6.444
  658    HB2  PRO  22           HB2      PRO  22 -16.332  19.332  -8.547
  659    HB3  PRO  22           HB3      PRO  22 -18.087  19.202  -8.384
  660    HG2  PRO  22           HG2      PRO  22 -16.969  20.723 -10.315
  661    HG3  PRO  22           HG3      PRO  22 -18.476  21.209  -9.505
  662    HD2  PRO  22           HD2      PRO  22 -15.654  22.169  -8.988
  663    HD3  PRO  22           HD3      PRO  22 -17.153  23.117  -9.143
  664    H    LEU  23           H        LEU  23 -16.957  18.233  -6.039
  665    HA   LEU  23           HA       LEU  23 -15.480  16.904  -4.979
  666    HB2  LEU  23           HB2      LEU  23 -13.359  18.838  -5.987
  667    HB3  LEU  23           HB3      LEU  23 -13.083  17.190  -5.445
  668    HG   LEU  23           HG       LEU  23 -14.667  17.995  -7.922
  669   HD11  LEU  23          HD11      LEU  23 -12.830  17.023  -9.219
  670   HD12  LEU  23          HD12      LEU  23 -11.931  16.711  -7.732
  671   HD13  LEU  23          HD13      LEU  23 -12.278  18.370  -8.226
  672   HD21  LEU  23          HD21      LEU  23 -15.603  15.948  -6.964
  673   HD22  LEU  23          HD22      LEU  23 -14.001  15.206  -6.904
  674   HD23  LEU  23          HD23      LEU  23 -14.747  15.579  -8.459
  675    H    SER  24           H        SER  24 -16.481  19.480  -3.572
  676    HA   SER  24           HA       SER  24 -14.468  20.144  -1.604
  677    HB2  SER  24           HB2      SER  24 -16.182  21.805  -2.354
  678    HB3  SER  24           HB3      SER  24 -17.447  20.828  -1.611
  679    HG   SER  24           HG       SER  24 -16.987  21.784   0.195
  680    H    LEU  25           H        LEU  25 -14.045  19.045   0.196
  681    HA   LEU  25           HA       LEU  25 -13.954  17.478   1.781
  682    HB2  LEU  25           HB2      LEU  25 -16.953  17.894   1.890
  683    HB3  LEU  25           HB3      LEU  25 -16.119  16.787   2.966
  684    HG   LEU  25           HG       LEU  25 -14.669  18.860   3.641
  685   HD11  LEU  25          HD11      LEU  25 -17.048  20.348   2.499
  686   HD12  LEU  25          HD12      LEU  25 -15.398  20.388   1.874
  687   HD13  LEU  25          HD13      LEU  25 -15.745  21.041   3.473
  688   HD21  LEU  25          HD21      LEU  25 -17.567  18.681   4.512
  689   HD22  LEU  25          HD22      LEU  25 -16.255  19.464   5.400
  690   HD23  LEU  25          HD23      LEU  25 -16.220  17.724   5.135
  691    H    LEU  26           H        LEU  26 -13.140  15.693   0.968
  692    HA   LEU  26           HA       LEU  26 -14.634  13.369   0.290
  693    HB2  LEU  26           HB2      LEU  26 -13.885  15.167  -1.955
  694    HB3  LEU  26           HB3      LEU  26 -13.283  13.539  -2.186
  695    HG   LEU  26           HG       LEU  26 -16.211  14.251  -1.733
  696   HD11  LEU  26          HD11      LEU  26 -15.429  15.066  -3.908
  697   HD12  LEU  26          HD12      LEU  26 -16.548  13.719  -4.101
  698   HD13  LEU  26          HD13      LEU  26 -14.815  13.458  -4.309
  699   HD21  LEU  26          HD21      LEU  26 -15.701  12.000  -0.893
  700   HD22  LEU  26          HD22      LEU  26 -14.938  11.567  -2.424
  701   HD23  LEU  26          HD23      LEU  26 -16.671  11.899  -2.359
  702    H    ASP  27           H        ASP  27 -11.539  14.898  -0.653
  703    HA   ASP  27           HA       ASP  27  -9.404  14.203  -0.798
  704    HB2  ASP  27           HB2      ASP  27  -9.978  12.536   1.691
  705    HB3  ASP  27           HB3      ASP  27  -8.402  13.088   1.129
  706    H    ASP  28           H        ASP  28  -9.443  13.120  -2.699
  707    HA   ASP  28           HA       ASP  28 -10.601  10.628  -3.246
  708    HB2  ASP  28           HB2      ASP  28  -9.945  12.462  -4.886
  709    HB3  ASP  28           HB3      ASP  28  -8.280  11.905  -4.761
  710    H    MET  29           H        MET  29  -7.402  11.429  -2.051
  711    HA   MET  29           HA       MET  29  -6.158   8.869  -2.407
  712    HB2  MET  29           HB2      MET  29  -5.364  11.035  -0.414
  713    HB3  MET  29           HB3      MET  29  -4.348   9.739  -1.036
  714    HG2  MET  29           HG2      MET  29  -4.683  10.801  -3.346
  715    HG3  MET  29           HG3      MET  29  -5.332  12.192  -2.479
  716    HE1  MET  29           HE1      MET  29  -2.198  10.013  -3.280
  717    HE2  MET  29           HE2      MET  29  -2.369   9.720  -1.546
  718    HE3  MET  29           HE3      MET  29  -0.995  10.644  -2.153
  719    H    ASN  30           H        ASN  30  -8.070  10.335   0.195
  720    HA   ASN  30           HA       ASN  30  -7.421   8.514   2.291
  721    HB2  ASN  30           HB2      ASN  30  -8.430  10.727   2.744
  722    HB3  ASN  30           HB3      ASN  30  -9.913  10.233   1.931
  723   HD21  ASN  30          HD21      ASN  30 -11.348   8.856   3.029
  724   HD22  ASN  30          HD22      ASN  30 -11.186   8.486   4.707
  725    H    HIS  31           H        HIS  31  -9.868   8.472  -0.256
  726    HA   HIS  31           HA       HIS  31 -11.417   6.261   0.523
  727    HB2  HIS  31           HB2      HIS  31 -11.859   7.883  -1.395
  728    HB3  HIS  31           HB3      HIS  31 -10.663   7.007  -2.343
  729    HD2  HIS  31           HD2      HIS  31 -14.389   6.913  -1.563
  730    HE1  HIS  31           HE1      HIS  31 -13.407   3.189  -3.326
  731    HE2  HIS  31           HE2      HIS  31 -15.273   4.626  -2.410
  732    H    CYS  32           H        CYS  32  -8.450   6.432  -1.415
  733    HA   CYS  32           HA       CYS  32  -8.058   3.672  -1.920
  734    HB2  CYS  32           HB2      CYS  32  -5.900   5.808  -1.761
  735    HB3  CYS  32           HB3      CYS  32  -5.869   4.323  -2.707
  736    HG   CYS  32           HG       CYS  32  -8.348   5.467  -4.041
  737    H    TYR  33           H        TYR  33  -6.797   5.834   0.624
  738    HA   TYR  33           HA       TYR  33  -5.009   4.097   1.921
  739    HB2  TYR  33           HB2      TYR  33  -6.392   6.661   2.657
  740    HB3  TYR  33           HB3      TYR  33  -5.679   5.748   3.981
  741    HD1  TYR  33           HD1      TYR  33  -3.231   4.721   3.145
  742    HD2  TYR  33           HD2      TYR  33  -4.952   8.454   1.987
  743    HE1  TYR  33           HE1      TYR  33  -1.000   5.619   2.763
  744    HE2  TYR  33           HE2      TYR  33  -2.699   9.361   1.585
  745    HH   TYR  33           HH       TYR  33   0.028   7.494   1.324
  746    H    SER  34           H        SER  34  -8.418   4.762   2.628
  747    HA   SER  34           HA       SER  34  -8.815   3.149   4.884
  748    HB2  SER  34           HB2      SER  34 -10.799   3.800   2.653
  749    HB3  SER  34           HB3      SER  34 -11.226   3.194   4.259
  750    HG   SER  34           HG       SER  34 -10.698   5.720   3.467
  751    H    ARG  35           H        ARG  35  -9.096   2.410   1.436
  752    HA   ARG  35           HA       ARG  35 -10.019  -0.271   1.640
  753    HB2  ARG  35           HB2      ARG  35 -10.172   1.520  -0.263
  754    HB3  ARG  35           HB3      ARG  35  -8.626   0.854  -0.781
  755    HG2  ARG  35           HG2      ARG  35  -9.594  -1.307  -1.183
  756    HG3  ARG  35           HG3      ARG  35 -11.093  -0.856  -0.360
  757    HD2  ARG  35           HD2      ARG  35 -11.491   0.874  -2.093
  758    HD3  ARG  35           HD3      ARG  35 -10.041   0.322  -2.921
  759    HE   ARG  35           HE       ARG  35 -11.160  -1.796  -3.330
  760   HH11  ARG  35          HH11      ARG  35 -13.257   0.755  -2.291
  761   HH12  ARG  35          HH12      ARG  35 -14.628   0.098  -3.109
  762   HH21  ARG  35          HH21      ARG  35 -12.933  -2.607  -4.374
  763   HH22  ARG  35          HH22      ARG  35 -14.447  -1.775  -4.270
  764    H    LEU  36           H        LEU  36  -6.755   1.144   1.333
  765    HA   LEU  36           HA       LEU  36  -5.193  -1.164   0.956
  766    HB2  LEU  36           HB2      LEU  36  -4.585   1.348   2.571
  767    HB3  LEU  36           HB3      LEU  36  -3.392   0.100   2.263
  768    HG   LEU  36           HG       LEU  36  -4.701   1.843   0.151
  769   HD11  LEU  36          HD11      LEU  36  -3.142   3.098   1.553
  770   HD12  LEU  36          HD12      LEU  36  -2.495   2.887  -0.071
  771   HD13  LEU  36          HD13      LEU  36  -1.878   1.900   1.255
  772   HD21  LEU  36          HD21      LEU  36  -2.505  -0.243  -0.164
  773   HD22  LEU  36          HD22      LEU  36  -3.091   0.841  -1.427
  774   HD23  LEU  36          HD23      LEU  36  -4.163  -0.385  -0.759
  775    H    ARG  37           H        ARG  37  -6.155   0.447   3.967
  776    HA   ARG  37           HA       ARG  37  -4.967  -1.174   5.883
  777    HB2  ARG  37           HB2      ARG  37  -6.146   1.107   6.118
  778    HB3  ARG  37           HB3      ARG  37  -7.641   0.188   6.290
  779    HG2  ARG  37           HG2      ARG  37  -6.282  -1.101   8.166
  780    HG3  ARG  37           HG3      ARG  37  -5.269   0.344   8.147
  781    HD2  ARG  37           HD2      ARG  37  -6.917   0.589   9.857
  782    HD3  ARG  37           HD3      ARG  37  -7.333   1.701   8.555
  783    HE   ARG  37           HE       ARG  37  -9.034   0.084   7.833
  784   HH11  ARG  37          HH11      ARG  37  -7.919  -0.234  11.090
  785   HH12  ARG  37          HH12      ARG  37  -9.278  -1.179  11.569
  786   HH21  ARG  37          HH21      ARG  37 -10.733  -1.143   8.465
  787   HH22  ARG  37          HH22      ARG  37 -10.856  -1.677  10.110
  788    H    GLU  38           H        GLU  38  -8.022  -1.616   4.199
  789    HA   GLU  38           HA       GLU  38  -9.176  -3.639   5.847
  790    HB2  GLU  38           HB2      GLU  38  -9.728  -3.064   2.898
  791    HB3  GLU  38           HB3      GLU  38 -10.759  -3.988   3.977
  792    HG2  GLU  38           HG2      GLU  38 -10.242  -1.020   3.980
  793    HG3  GLU  38           HG3      GLU  38 -11.768  -1.859   3.741
  794    H    LEU  39           H        LEU  39  -6.977  -3.706   3.107
  795    HA   LEU  39           HA       LEU  39  -7.068  -6.612   2.769
  796    HB2  LEU  39           HB2      LEU  39  -5.425  -4.480   1.360
  797    HB3  LEU  39           HB3      LEU  39  -5.466  -6.177   0.910
  798    HG   LEU  39           HG       LEU  39  -7.811  -4.240   0.739
  799   HD11  LEU  39          HD11      LEU  39  -7.582  -4.498  -1.704
  800   HD12  LEU  39          HD12      LEU  39  -6.147  -5.495  -1.465
  801   HD13  LEU  39          HD13      LEU  39  -6.134  -3.797  -0.983
  802   HD21  LEU  39          HD21      LEU  39  -9.028  -6.074  -0.398
  803   HD22  LEU  39          HD22      LEU  39  -8.640  -6.492   1.268
  804   HD23  LEU  39          HD23      LEU  39  -7.692  -7.178  -0.055
  805    H    VAL  40           H        VAL  40  -5.545  -4.691   4.968
  806    HA   VAL  40           HA       VAL  40  -3.050  -6.307   5.062
  807    HB   VAL  40           HB       VAL  40  -3.592  -3.603   6.388
  808   HG11  VAL  40          HG11      VAL  40  -1.965  -4.931   7.661
  809   HG12  VAL  40          HG12      VAL  40  -1.165  -3.572   6.877
  810   HG13  VAL  40          HG13      VAL  40  -1.002  -5.196   6.204
  811   HG21  VAL  40          HG21      VAL  40  -1.929  -4.234   3.916
  812   HG22  VAL  40          HG22      VAL  40  -2.041  -2.657   4.703
  813   HG23  VAL  40          HG23      VAL  40  -3.470  -3.366   3.950
  814    HA   PRO  41           HA       PRO  41  -5.025  -8.084   8.896
  815    HB2  PRO  41           HB2      PRO  41  -3.035 -10.248   8.333
  816    HB3  PRO  41           HB3      PRO  41  -4.773 -10.373   8.641
  817    HG2  PRO  41           HG2      PRO  41  -3.778 -10.764   6.175
  818    HG3  PRO  41           HG3      PRO  41  -5.338  -9.944   6.412
  819    HD2  PRO  41           HD2      PRO  41  -2.621  -8.725   5.871
  820    HD3  PRO  41           HD3      PRO  41  -4.189  -8.342   5.126
  821    H    GLY  42           H        GLY  42  -1.869  -7.033   7.996
  822    HA2  GLY  42           HA2      GLY  42  -0.490  -7.399  10.492
  823    HA3  GLY  42           HA3      GLY  42  -0.024  -6.326   9.180
  824    H    VAL  43           H        VAL  43  -3.101  -5.408   9.792
  825    HA   VAL  43           HA       VAL  43  -2.491  -3.224  11.589
  826    HB   VAL  43           HB       VAL  43  -5.141  -4.151  10.375
  827   HG11  VAL  43          HG11      VAL  43  -6.046  -1.923  10.999
  828   HG12  VAL  43          HG12      VAL  43  -4.547  -1.560  11.863
  829   HG13  VAL  43          HG13      VAL  43  -5.591  -2.871  12.415
  830   HG21  VAL  43          HG21      VAL  43  -3.527  -3.411   8.672
  831   HG22  VAL  43          HG22      VAL  43  -3.285  -1.884   9.524
  832   HG23  VAL  43          HG23      VAL  43  -4.854  -2.257   8.805
  833    HA   PRO  44           HA       PRO  44  -3.457  -5.827  15.268
  834    HB2  PRO  44           HB2      PRO  44  -3.039  -3.257  16.749
  835    HB3  PRO  44           HB3      PRO  44  -2.242  -4.822  16.964
  836    HG2  PRO  44           HG2      PRO  44  -0.943  -2.757  15.844
  837    HG3  PRO  44           HG3      PRO  44  -0.692  -4.414  15.255
  838    HD2  PRO  44           HD2      PRO  44  -2.418  -2.225  14.078
  839    HD3  PRO  44           HD3      PRO  44  -1.300  -3.340  13.255
  840    H    ARG  45           H        ARG  45  -5.229  -6.055  16.648
  841    HA   ARG  45           HA       ARG  45  -7.664  -4.643  16.070
  842    HB2  ARG  45           HB2      ARG  45  -7.593  -7.049  16.652
  843    HB3  ARG  45           HB3      ARG  45  -7.037  -6.648  18.274
  844    HG2  ARG  45           HG2      ARG  45  -9.152  -5.541  18.774
  845    HG3  ARG  45           HG3      ARG  45  -9.701  -5.771  17.113
  846    HD2  ARG  45           HD2      ARG  45  -9.094  -8.003  19.073
  847    HD3  ARG  45           HD3      ARG  45 -10.706  -7.401  18.683
  848    HE   ARG  45           HE       ARG  45  -9.580  -8.105  16.269
  849   HH11  ARG  45          HH11      ARG  45 -10.309  -9.842  19.189
  850   HH12  ARG  45          HH12      ARG  45 -10.629 -11.313  18.345
  851   HH21  ARG  45          HH21      ARG  45 -10.001  -9.993  15.241
  852   HH22  ARG  45          HH22      ARG  45 -10.449 -11.394  16.143
  853    H    GLY  46           H        GLY  46  -7.686  -2.509  16.674
  854    HA2  GLY  46           HA2      GLY  46  -8.123  -0.801  18.248
  855    HA3  GLY  46           HA3      GLY  46  -7.395  -1.773  19.519
  856    H    THR  47           H        THR  47  -6.644   0.128  16.602
  857    HA   THR  47           HA       THR  47  -4.073   1.036  17.748
  858    HB   THR  47           HB       THR  47  -3.512  -0.894  16.279
  859    HG1  THR  47           HG1      THR  47  -1.838   0.133  15.354
  860   HG21  THR  47          HG21      THR  47  -3.852  -0.790  13.845
  861   HG22  THR  47          HG22      THR  47  -4.728   0.732  14.013
  862   HG23  THR  47          HG23      THR  47  -5.404  -0.753  14.687
  863    H    GLN  48           H        GLN  48  -3.091   2.813  16.247
  864    HA   GLN  48           HA       GLN  48  -5.212   4.574  15.141
  865    HB2  GLN  48           HB2      GLN  48  -3.865   6.532  15.928
  866    HB3  GLN  48           HB3      GLN  48  -4.475   5.541  17.242
  867    HG2  GLN  48           HG2      GLN  48  -2.264   4.530  17.553
  868    HG3  GLN  48           HG3      GLN  48  -1.633   5.435  16.183
  869   HE21  GLN  48          HE21      GLN  48  -2.658   5.631  19.502
  870   HE22  GLN  48          HE22      GLN  48  -2.006   7.194  19.828
  871    H    LEU  49           H        LEU  49  -5.001   4.695  12.997
  872    HA   LEU  49           HA       LEU  49  -2.318   4.832  11.710
  873    HB2  LEU  49           HB2      LEU  49  -4.739   3.323  10.630
  874    HB3  LEU  49           HB3      LEU  49  -3.184   3.472   9.834
  875    HG   LEU  49           HG       LEU  49  -3.716   1.935  12.405
  876   HD11  LEU  49          HD11      LEU  49  -4.659   0.814  10.438
  877   HD12  LEU  49          HD12      LEU  49  -3.279  -0.081  11.071
  878   HD13  LEU  49          HD13      LEU  49  -3.098   0.906   9.618
  879   HD21  LEU  49          HD21      LEU  49  -1.400   1.115  12.214
  880   HD22  LEU  49          HD22      LEU  49  -1.446   2.861  12.435
  881   HD23  LEU  49          HD23      LEU  49  -1.127   2.186  10.835
  882    H    SER  50           H        SER  50  -2.302   7.004  11.160
  883    HA   SER  50           HA       SER  50  -4.620   8.387  10.109
  884    HB2  SER  50           HB2      SER  50  -1.728   9.340  10.288
  885    HB3  SER  50           HB3      SER  50  -3.130  10.355   9.941
  886    HG   SER  50           HG       SER  50  -2.360   9.114  12.349
  887    H    GLN  51           H        GLN  51  -1.332   8.197   8.648
  888    HA   GLN  51           HA       GLN  51  -2.415   7.349   6.045
  889    HB2  GLN  51           HB2      GLN  51  -0.916   9.982   6.413
  890    HB3  GLN  51           HB3      GLN  51  -1.154   9.213   4.848
  891    HG2  GLN  51           HG2      GLN  51  -3.594   9.490   5.080
  892    HG3  GLN  51           HG3      GLN  51  -3.360  10.254   6.650
  893   HE21  GLN  51          HE21      GLN  51  -2.996  10.643   3.198
  894   HE22  GLN  51          HE22      GLN  51  -2.705  12.341   3.218
  895    H    VAL  52           H        VAL  52   0.552   8.636   7.599
  896    HA   VAL  52           HA       VAL  52   2.450   7.287   6.002
  897    HB   VAL  52           HB       VAL  52   2.804   8.193   8.905
  898   HG11  VAL  52          HG11      VAL  52   4.893   7.745   6.738
  899   HG12  VAL  52          HG12      VAL  52   4.619   6.709   8.142
  900   HG13  VAL  52          HG13      VAL  52   5.210   8.356   8.367
  901   HG21  VAL  52          HG21      VAL  52   3.680  10.312   7.989
  902   HG22  VAL  52          HG22      VAL  52   2.000  10.056   7.511
  903   HG23  VAL  52          HG23      VAL  52   3.302   9.771   6.351
  904    H    GLU  53           H        GLU  53   0.984   6.471   9.097
  905    HA   GLU  53           HA       GLU  53   2.401   4.125   9.714
  906    HB2  GLU  53           HB2      GLU  53  -0.431   4.743  10.645
  907    HB3  GLU  53           HB3      GLU  53   0.778   3.768  11.462
  908    HG2  GLU  53           HG2      GLU  53   1.073   5.625  12.738
  909    HG3  GLU  53           HG3      GLU  53   2.083   6.169  11.405
  910    H    ILE  54           H        ILE  54  -0.635   4.682   7.952
  911    HA   ILE  54           HA       ILE  54  -1.413   2.025   7.436
  912    HB   ILE  54           HB       ILE  54  -1.840   4.564   5.795
  913   HG12  ILE  54          HG12      ILE  54  -3.718   2.953   7.595
  914   HG13  ILE  54          HG13      ILE  54  -3.003   4.516   7.972
  915   HG21  ILE  54          HG21      ILE  54  -3.020   1.812   5.205
  916   HG22  ILE  54          HG22      ILE  54  -1.950   2.762   4.167
  917   HG23  ILE  54          HG23      ILE  54  -3.587   3.322   4.481
  918   HD11  ILE  54          HD11      ILE  54  -5.335   4.724   7.367
  919   HD12  ILE  54          HD12      ILE  54  -5.025   3.975   5.802
  920   HD13  ILE  54          HD13      ILE  54  -4.315   5.547   6.185
  921    H    LEU  55           H        LEU  55   0.660   4.203   5.450
  922    HA   LEU  55           HA       LEU  55   1.373   2.444   3.398
  923    HB2  LEU  55           HB2      LEU  55   3.028   4.646   4.677
  924    HB3  LEU  55           HB3      LEU  55   3.464   3.845   3.177
  925    HG   LEU  55           HG       LEU  55   0.968   5.537   3.595
  926   HD11  LEU  55          HD11      LEU  55   2.056   7.193   2.137
  927   HD12  LEU  55          HD12      LEU  55   3.512   6.196   2.075
  928   HD13  LEU  55          HD13      LEU  55   2.997   6.915   3.602
  929   HD21  LEU  55          HD21      LEU  55   0.568   3.770   1.938
  930   HD22  LEU  55          HD22      LEU  55   2.029   4.234   1.059
  931   HD23  LEU  55          HD23      LEU  55   0.658   5.344   1.152
  932    H    GLN  56           H        GLN  56   2.907   2.882   6.568
  933    HA   GLN  56           HA       GLN  56   5.081   1.092   6.256
  934    HB2  GLN  56           HB2      GLN  56   3.664   2.012   8.791
  935    HB3  GLN  56           HB3      GLN  56   5.238   1.221   8.741
  936    HG2  GLN  56           HG2      GLN  56   6.229   3.107   7.598
  937    HG3  GLN  56           HG3      GLN  56   4.656   3.879   7.401
  938   HE21  GLN  56          HE21      GLN  56   7.048   4.900   8.671
  939   HE22  GLN  56          HE22      GLN  56   6.582   5.335  10.265
  940    H    ARG  57           H        ARG  57   1.742   0.600   7.443
  941    HA   ARG  57           HA       ARG  57   2.064  -2.150   8.202
  942    HB2  ARG  57           HB2      ARG  57  -0.462  -0.600   7.498
  943    HB3  ARG  57           HB3      ARG  57  -0.460  -2.238   8.131
  944    HG2  ARG  57           HG2      ARG  57   0.432   0.272   9.579
  945    HG3  ARG  57           HG3      ARG  57  -1.008  -0.690   9.898
  946    HD2  ARG  57           HD2      ARG  57   0.471  -1.331  11.608
  947    HD3  ARG  57           HD3      ARG  57   0.650  -2.627  10.421
  948    HE   ARG  57           HE       ARG  57   2.551  -0.424  10.219
  949   HH11  ARG  57          HH11      ARG  57   2.036  -3.628  11.445
  950   HH12  ARG  57          HH12      ARG  57   3.725  -3.912  11.673
  951   HH21  ARG  57          HH21      ARG  57   4.682  -0.820  10.524
  952   HH22  ARG  57          HH22      ARG  57   5.197  -2.341  11.162
  953    H    VAL  58           H        VAL  58   1.180  -0.540   5.173
  954    HA   VAL  58           HA       VAL  58   0.427  -2.865   3.711
  955    HB   VAL  58           HB       VAL  58   1.458  -0.178   2.685
  956   HG11  VAL  58          HG11      VAL  58   0.125  -2.422   1.116
  957   HG12  VAL  58          HG12      VAL  58   1.801  -1.891   0.965
  958   HG13  VAL  58          HG13      VAL  58   0.493  -0.809   0.489
  959   HG21  VAL  58          HG21      VAL  58  -1.397  -1.228   2.913
  960   HG22  VAL  58          HG22      VAL  58  -0.922   0.328   2.223
  961   HG23  VAL  58          HG23      VAL  58  -0.660   0.007   3.936
  962    H    ILE  59           H        ILE  59   3.552  -1.092   3.964
  963    HA   ILE  59           HA       ILE  59   5.115  -2.787   2.330
  964    HB   ILE  59           HB       ILE  59   6.034  -1.220   4.793
  965   HG12  ILE  59          HG12      ILE  59   6.104  -0.400   1.844
  966   HG13  ILE  59          HG13      ILE  59   4.982   0.227   3.045
  967   HG21  ILE  59          HG21      ILE  59   8.310  -1.330   3.803
  968   HG22  ILE  59          HG22      ILE  59   7.699  -2.351   2.500
  969   HG23  ILE  59          HG23      ILE  59   7.686  -2.937   4.164
  970   HD11  ILE  59          HD11      ILE  59   6.782   1.779   2.593
  971   HD12  ILE  59          HD12      ILE  59   7.974   0.580   3.087
  972   HD13  ILE  59          HD13      ILE  59   6.832   1.233   4.268
  973    H    ASP  60           H        ASP  60   4.498  -2.852   5.849
  974    HA   ASP  60           HA       ASP  60   5.938  -5.118   6.612
  975    HB2  ASP  60           HB2      ASP  60   4.903  -3.516   8.193
  976    HB3  ASP  60           HB3      ASP  60   3.299  -4.063   7.720
  977    H    TYR  61           H        TYR  61   2.671  -4.881   5.272
  978    HA   TYR  61           HA       TYR  61   1.873  -7.585   5.451
  979    HB2  TYR  61           HB2      TYR  61   0.197  -5.895   5.038
  980    HB3  TYR  61           HB3      TYR  61   1.021  -5.332   3.590
  981    HD1  TYR  61           HD1      TYR  61  -0.831  -8.270   4.996
  982    HD2  TYR  61           HD2      TYR  61   0.449  -6.259   1.443
  983    HE1  TYR  61           HE1      TYR  61  -2.217  -9.776   3.644
  984    HE2  TYR  61           HE2      TYR  61  -0.952  -7.768   0.102
  985    HH   TYR  61           HH       TYR  61  -3.345  -9.722   1.426
  986    H    ILE  62           H        ILE  62   3.475  -5.796   2.790
  987    HA   ILE  62           HA       ILE  62   3.551  -7.994   0.961
  988    HB   ILE  62           HB       ILE  62   5.361  -5.524   0.967
  989   HG12  ILE  62          HG12      ILE  62   2.686  -5.874  -0.496
  990   HG13  ILE  62          HG13      ILE  62   2.885  -4.947   0.984
  991   HG21  ILE  62          HG21      ILE  62   4.585  -7.401  -1.307
  992   HG22  ILE  62          HG22      ILE  62   6.166  -7.311  -0.529
  993   HG23  ILE  62          HG23      ILE  62   5.575  -5.944  -1.468
  994   HD11  ILE  62          HD11      ILE  62   2.792  -3.493  -0.943
  995   HD12  ILE  62          HD12      ILE  62   4.158  -4.326  -1.682
  996   HD13  ILE  62          HD13      ILE  62   4.387  -3.400  -0.196
  997    H    LEU  63           H        LEU  63   5.901  -6.685   3.299
  998    HA   LEU  63           HA       LEU  63   8.053  -8.478   2.899
  999    HB2  LEU  63           HB2      LEU  63   7.193  -6.992   5.417
 1000    HB3  LEU  63           HB3      LEU  63   8.732  -7.817   5.238
 1001    HG   LEU  63           HG       LEU  63   7.852  -5.409   3.592
 1002   HD11  LEU  63          HD11      LEU  63   9.821  -5.531   5.898
 1003   HD12  LEU  63          HD12      LEU  63   8.232  -4.764   5.918
 1004   HD13  LEU  63          HD13      LEU  63   9.502  -4.117   4.884
 1005   HD21  LEU  63          HD21      LEU  63  10.174  -5.323   2.795
 1006   HD22  LEU  63          HD22      LEU  63   9.400  -6.839   2.341
 1007   HD23  LEU  63          HD23      LEU  63  10.545  -6.805   3.685
 1008    H    ASP  64           H        ASP  64   5.092  -8.736   4.793
 1009    HA   ASP  64           HA       ASP  64   5.643 -11.045   6.331
 1010    HB2  ASP  64           HB2      ASP  64   3.770  -9.499   6.793
 1011    HB3  ASP  64           HB3      ASP  64   2.999  -9.948   5.281
 1012    H    LEU  65           H        LEU  65   4.370 -10.630   3.058
 1013    HA   LEU  65           HA       LEU  65   3.863 -13.458   2.637
 1014    HB2  LEU  65           HB2      LEU  65   3.877 -11.227   0.570
 1015    HB3  LEU  65           HB3      LEU  65   3.142 -12.814   0.407
 1016    HG   LEU  65           HG       LEU  65   2.198 -10.527   2.175
 1017   HD11  LEU  65          HD11      LEU  65   0.142 -10.639   0.838
 1018   HD12  LEU  65          HD12      LEU  65   0.846 -11.925  -0.145
 1019   HD13  LEU  65          HD13      LEU  65   1.554 -10.308  -0.165
 1020   HD21  LEU  65          HD21      LEU  65   0.344 -11.979   2.928
 1021   HD22  LEU  65          HD22      LEU  65   1.909 -12.573   3.475
 1022   HD23  LEU  65          HD23      LEU  65   1.096 -13.357   2.117
 1023    H    GLN  66           H        GLN  66   6.370 -11.130   1.704
 1024    HA   GLN  66           HA       GLN  66   7.743 -13.007  -0.071
 1025    HB2  GLN  66           HB2      GLN  66   8.445 -10.143   0.705
 1026    HB3  GLN  66           HB3      GLN  66   9.291 -11.096  -0.510
 1027    HG2  GLN  66           HG2      GLN  66   7.251 -11.169  -1.890
 1028    HG3  GLN  66           HG3      GLN  66   6.380 -10.239  -0.669
 1029   HE21  GLN  66          HE21      GLN  66   6.817  -9.525  -3.446
 1030   HE22  GLN  66          HE22      GLN  66   7.681  -8.033  -3.443
 1031    H    VAL  67           H        VAL  67   8.863 -10.968   2.676
 1032    HA   VAL  67           HA       VAL  67  11.342 -12.434   2.897
 1033    HB   VAL  67           HB       VAL  67  10.298 -10.178   4.675
 1034   HG11  VAL  67          HG11      VAL  67  12.671  -9.820   5.298
 1035   HG12  VAL  67          HG12      VAL  67  13.138 -11.226   4.338
 1036   HG13  VAL  67          HG13      VAL  67  12.117 -11.430   5.761
 1037   HG21  VAL  67          HG21      VAL  67  10.421  -9.448   2.330
 1038   HG22  VAL  67          HG22      VAL  67  12.093 -10.003   2.220
 1039   HG23  VAL  67          HG23      VAL  67  11.676  -8.658   3.286
 1040    H    VAL  68           H        VAL  68  11.292 -14.393   3.835
 1041    HA   VAL  68           HA       VAL  68   9.500 -15.181   5.931
 1042    HB   VAL  68           HB       VAL  68  10.806 -17.334   5.965
 1043   HG11  VAL  68          HG11      VAL  68  10.114 -18.069   3.701
 1044   HG12  VAL  68          HG12      VAL  68   9.897 -16.385   3.217
 1045   HG13  VAL  68          HG13      VAL  68   8.878 -17.080   4.478
 1046   HG21  VAL  68          HG21      VAL  68  12.473 -16.065   3.744
 1047   HG22  VAL  68          HG22      VAL  68  12.541 -17.755   4.251
 1048   HG23  VAL  68          HG23      VAL  68  13.048 -16.482   5.360
  Start of MODEL   18
    1    H1   MET   1           H1       MET   1 -42.203  29.016  11.313
    2    H2   MET   1           H2       MET   1 -42.155  27.839  10.101
    3    H3   MET   1           H3       MET   1 -40.718  28.425  10.766
    4    HA   MET   1           HA       MET   1 -41.256  27.490  12.889
    5    HB2  MET   1           HB2      MET   1 -43.751  26.506  11.449
    6    HB3  MET   1           HB3      MET   1 -43.219  25.856  12.996
    7    HG2  MET   1           HG2      MET   1 -44.988  27.490  13.321
    8    HG3  MET   1           HG3      MET   1 -43.479  28.078  14.022
    9    HE1  MET   1           HE1      MET   1 -45.252  31.373  12.788
   10    HE2  MET   1           HE2      MET   1 -44.567  30.524  14.172
   11    HE3  MET   1           HE3      MET   1 -46.058  29.942  13.429
   12    H    GLY   2           H        GLY   2 -40.286  25.573  13.393
   13    HA2  GLY   2           HA2      GLY   2 -40.146  23.141  12.193
   14    HA3  GLY   2           HA3      GLY   2 -38.984  24.088  11.270
   15    H    HIS   3           H        HIS   3 -39.811  24.156  14.717
   16    HA   HIS   3           HA       HIS   3 -37.159  24.478  15.624
   17    HB2  HIS   3           HB2      HIS   3 -38.169  24.088  17.919
   18    HB3  HIS   3           HB3      HIS   3 -38.959  25.337  16.971
   19    HD2  HIS   3           HD2      HIS   3 -39.911  22.270  18.977
   20    HE1  HIS   3           HE1      HIS   3 -43.146  23.090  16.376
   21    HE2  HIS   3           HE2      HIS   3 -42.299  21.595  18.229
   22    H    HIS   4           H        HIS   4 -35.579  23.071  16.048
   23    HA   HIS   4           HA       HIS   4 -36.143  20.267  16.719
   24    HB2  HIS   4           HB2      HIS   4 -35.791  20.490  14.184
   25    HB3  HIS   4           HB3      HIS   4 -34.130  20.960  14.530
   26    HD2  HIS   4           HD2      HIS   4 -36.371  17.784  14.416
   27    HE1  HIS   4           HE1      HIS   4 -32.436  16.606  15.429
   28    HE2  HIS   4           HE2      HIS   4 -34.770  15.798  14.894
   29    H    HIS   5           H        HIS   5 -34.270  19.176  17.693
   30    HA   HIS   5           HA       HIS   5 -33.006  21.052  19.554
   31    HB2  HIS   5           HB2      HIS   5 -33.260  18.015  19.661
   32    HB3  HIS   5           HB3      HIS   5 -32.657  19.041  20.966
   33    HD2  HIS   5           HD2      HIS   5 -36.032  17.971  19.343
   34    HE1  HIS   5           HE1      HIS   5 -36.864  20.558  22.587
   35    HE2  HIS   5           HE2      HIS   5 -37.865  19.131  20.759
   36    H    HIS   6           H        HIS   6 -31.993  19.602  16.735
   37    HA   HIS   6           HA       HIS   6 -29.187  19.228  17.515
   38    HB2  HIS   6           HB2      HIS   6 -30.061  17.573  15.967
   39    HB3  HIS   6           HB3      HIS   6 -30.659  18.819  14.874
   40    HD2  HIS   6           HD2      HIS   6 -29.072  18.828  12.704
   41    HE1  HIS   6           HE1      HIS   6 -25.393  18.202  14.687
   42    HE2  HIS   6           HE2      HIS   6 -26.539  18.394  12.445
   43    H    HIS   7           H        HIS   7 -27.531  20.620  16.989
   44    HA   HIS   7           HA       HIS   7 -28.128  23.120  15.482
   45    HB2  HIS   7           HB2      HIS   7 -26.364  22.860  17.960
   46    HB3  HIS   7           HB3      HIS   7 -26.623  24.339  17.043
   47    HD2  HIS   7           HD2      HIS   7 -29.281  25.428  17.299
   48    HE1  HIS   7           HE1      HIS   7 -30.087  23.229  20.821
   49    HE2  HIS   7           HE2      HIS   7 -30.916  25.044  19.272
   50    H    HIS   8           H        HIS   8 -26.961  23.071  13.614
   51    HA   HIS   8           HA       HIS   8 -24.107  22.840  13.563
   52    HB2  HIS   8           HB2      HIS   8 -24.573  20.431  13.691
   53    HB3  HIS   8           HB3      HIS   8 -25.701  20.544  12.350
   54    HD2  HIS   8           HD2      HIS   8 -24.450  19.115  10.422
   55    HE1  HIS   8           HE1      HIS   8 -20.671  20.982  10.742
   56    HE2  HIS   8           HE2      HIS   8 -21.981  19.122   9.639
   57    H    SER   9           H        SER   9 -23.215  23.654  11.668
   58    HA   SER   9           HA       SER   9 -24.761  23.934   9.213
   59    HB2  SER   9           HB2      SER   9 -23.688  26.410  10.641
   60    HB3  SER   9           HB3      SER   9 -24.299  26.394   8.989
   61    HG   SER   9           HG       SER   9 -26.204  25.330  10.391
   62    H    HIS  10           H        HIS  10 -21.731  24.804  10.909
   63    HA   HIS  10           HA       HIS  10 -19.536  24.898  10.329
   64    HB2  HIS  10           HB2      HIS  10 -19.963  22.469   9.786
   65    HB3  HIS  10           HB3      HIS  10 -20.274  22.923   8.121
   66    HD1  HIS  10           HD1      HIS  10 -18.227  23.401   6.625
   67    HD2  HIS  10           HD2      HIS  10 -17.207  22.471  10.543
   68    HE1  HIS  10           HE1      HIS  10 -15.765  22.980   6.595
   69    HE2  HIS  10           HE2      HIS  10 -15.228  22.187   8.911
   70    H    MET  11           H        MET  11 -21.503  26.768   9.078
   71    HA   MET  11           HA       MET  11 -20.723  27.285   6.362
   72    HB2  MET  11           HB2      MET  11 -23.003  27.778   7.318
   73    HB3  MET  11           HB3      MET  11 -22.298  29.087   8.253
   74    HG2  MET  11           HG2      MET  11 -22.298  28.941   5.225
   75    HG3  MET  11           HG3      MET  11 -23.475  29.838   6.181
   76    HE1  MET  11           HE1      MET  11 -21.243  32.682   4.542
   77    HE2  MET  11           HE2      MET  11 -22.886  32.074   4.734
   78    HE3  MET  11           HE3      MET  11 -21.707  31.152   3.797
   79    H    GLY  12           H        GLY  12 -18.992  28.399   5.676
   80    HA2  GLY  12           HA2      GLY  12 -17.951  30.775   6.932
   81    HA3  GLY  12           HA3      GLY  12 -16.887  29.386   7.144
   82    H    GLY  13           H        GLY  13 -17.730  31.936   5.081
   83    HA2  GLY  13           HA2      GLY  13 -16.006  30.894   2.909
   84    HA3  GLY  13           HA3      GLY  13 -17.601  31.516   2.517
   85    H    GLY  14           H        GLY  14 -14.619  32.456   4.235
   86    HA2  GLY  14           HA2      GLY  14 -14.937  35.269   3.295
   87    HA3  GLY  14           HA3      GLY  14 -14.126  34.798   4.779
   88    H    LYS  15           H        LYS  15 -12.295  36.068   4.018
   89    HA   LYS  15           HA       LYS  15 -10.791  35.219   1.689
   90    HB2  LYS  15           HB2      LYS  15 -10.787  37.590   2.408
   91    HB3  LYS  15           HB3      LYS  15 -10.068  37.139   3.948
   92    HG2  LYS  15           HG2      LYS  15  -8.371  38.103   2.502
   93    HG3  LYS  15           HG3      LYS  15  -8.015  36.396   2.776
   94    HD2  LYS  15           HD2      LYS  15  -8.961  35.844   0.551
   95    HD3  LYS  15           HD3      LYS  15  -9.324  37.551   0.280
   96    HE2  LYS  15           HE2      LYS  15  -6.552  36.362   0.647
   97    HE3  LYS  15           HE3      LYS  15  -7.263  36.870  -0.883
   98    HZ1  LYS  15           HZ1      LYS  15  -6.655  38.645   1.418
   99    HZ2  LYS  15           HZ2      LYS  15  -7.354  39.136  -0.041
  100    HZ3  LYS  15           HZ3      LYS  15  -5.777  38.540  -0.019
  101    H    GLY  16           H        GLY  16  -9.453  33.484   1.659
  102    HA2  GLY  16           HA2      GLY  16  -8.653  32.041   4.036
  103    HA3  GLY  16           HA3      GLY  16  -8.243  31.649   2.374
  104    HA   PRO  17           HA       PRO  17  -4.508  33.643   4.582
  105    HB2  PRO  17           HB2      PRO  17  -3.182  31.573   5.674
  106    HB3  PRO  17           HB3      PRO  17  -4.615  32.241   6.470
  107    HG2  PRO  17           HG2      PRO  17  -4.372  29.762   4.775
  108    HG3  PRO  17           HG3      PRO  17  -5.258  29.997   6.297
  109    HD2  PRO  17           HD2      PRO  17  -6.414  30.111   3.754
  110    HD3  PRO  17           HD3      PRO  17  -7.114  30.841   5.215
  111    H    ALA  18           H        ALA  18  -2.092  33.174   4.206
  112    HA   ALA  18           HA       ALA  18  -1.574  32.340   1.449
  113    HB1  ALA  18           HB1      ALA  18   0.690  33.248   1.848
  114    HB2  ALA  18           HB2      ALA  18   0.291  33.508   3.547
  115    HB3  ALA  18           HB3      ALA  18  -0.557  34.415   2.296
  116    H    ALA  19           H        ALA  19  -0.408  30.513   0.844
  117    HA   ALA  19           HA       ALA  19  -0.349  28.313   2.702
  118    HB1  ALA  19           HB1      ALA  19  -0.994  27.993   0.354
  119    HB2  ALA  19           HB2      ALA  19   0.372  26.964   0.785
  120    HB3  ALA  19           HB3      ALA  19   0.634  28.430  -0.165
  121    H    GLU  20           H        GLU  20   1.205  28.251   4.209
  122    HA   GLU  20           HA       GLU  20   3.987  28.917   3.831
  123    HB2  GLU  20           HB2      GLU  20   4.246  27.870   6.101
  124    HB3  GLU  20           HB3      GLU  20   3.001  29.109   6.048
  125    HG2  GLU  20           HG2      GLU  20   1.272  27.291   5.862
  126    HG3  GLU  20           HG3      GLU  20   2.558  26.104   6.067
  127    H    GLU  21           H        GLU  21   5.514  26.867   4.819
  128    HA   GLU  21           HA       GLU  21   5.764  24.963   2.757
  129    HB2  GLU  21           HB2      GLU  21   7.346  23.764   4.290
  130    HB3  GLU  21           HB3      GLU  21   7.689  25.480   4.128
  131    HG2  GLU  21           HG2      GLU  21   6.699  25.934   6.308
  132    HG3  GLU  21           HG3      GLU  21   6.211  24.252   6.475
  133    HA   PRO  22           HA       PRO  22   2.255  22.409   3.798
  134    HB2  PRO  22           HB2      PRO  22   3.240  20.371   1.876
  135    HB3  PRO  22           HB3      PRO  22   1.810  21.403   1.773
  136    HG2  PRO  22           HG2      PRO  22   3.952  21.799   0.165
  137    HG3  PRO  22           HG3      PRO  22   2.982  23.160   0.776
  138    HD2  PRO  22           HD2      PRO  22   5.617  22.093   1.831
  139    HD3  PRO  22           HD3      PRO  22   5.148  23.776   1.497
  140    H    LEU  23           H        LEU  23   3.167  21.988   5.969
  141    HA   LEU  23           HA       LEU  23   3.575  20.691   7.755
  142    HB2  LEU  23           HB2      LEU  23   2.536  18.486   5.948
  143    HB3  LEU  23           HB3      LEU  23   2.694  18.357   7.691
  144    HG   LEU  23           HG       LEU  23   0.860  20.335   6.274
  145   HD11  LEU  23          HD11      LEU  23   0.061  18.054   5.917
  146   HD12  LEU  23          HD12      LEU  23  -1.006  18.923   7.017
  147   HD13  LEU  23          HD13      LEU  23   0.135  17.737   7.652
  148   HD21  LEU  23          HD21      LEU  23  -0.113  20.715   8.511
  149   HD22  LEU  23          HD22      LEU  23   1.589  21.165   8.461
  150   HD23  LEU  23          HD23      LEU  23   1.103  19.647   9.222
  151    H    SER  24           H        SER  24   4.392  18.013   5.561
  152    HA   SER  24           HA       SER  24   7.052  17.805   6.822
  153    HB2  SER  24           HB2      SER  24   5.461  15.756   5.216
  154    HB3  SER  24           HB3      SER  24   7.034  15.463   5.958
  155    HG   SER  24           HG       SER  24   5.983  15.002   7.712
  156    H    LEU  25           H        LEU  25   8.095  19.425   5.606
  157    HA   LEU  25           HA       LEU  25   8.399  19.362   2.751
  158    HB2  LEU  25           HB2      LEU  25   8.932  21.221   4.713
  159    HB3  LEU  25           HB3      LEU  25  10.551  20.621   4.432
  160    HG   LEU  25           HG       LEU  25   8.753  21.890   2.318
  161   HD11  LEU  25          HD11      LEU  25  10.248  23.833   2.443
  162   HD12  LEU  25          HD12      LEU  25  11.162  23.064   3.744
  163   HD13  LEU  25          HD13      LEU  25   9.477  23.523   3.996
  164   HD21  LEU  25          HD21      LEU  25  10.315  20.292   1.295
  165   HD22  LEU  25          HD22      LEU  25  11.672  21.085   2.094
  166   HD23  LEU  25          HD23      LEU  25  10.737  21.950   0.869
  167    H    LEU  26           H        LEU  26   9.877  17.650   5.399
  168    HA   LEU  26           HA       LEU  26  12.198  16.569   4.191
  169    HB2  LEU  26           HB2      LEU  26  11.553  16.517   6.628
  170    HB3  LEU  26           HB3      LEU  26  10.370  15.282   6.269
  171    HG   LEU  26           HG       LEU  26  13.338  14.818   5.758
  172   HD11  LEU  26          HD11      LEU  26  13.127  15.471   8.110
  173   HD12  LEU  26          HD12      LEU  26  13.510  13.758   7.982
  174   HD13  LEU  26          HD13      LEU  26  11.860  14.266   8.355
  175   HD21  LEU  26          HD21      LEU  26  11.054  12.878   6.276
  176   HD22  LEU  26          HD22      LEU  26  12.749  12.424   6.062
  177   HD23  LEU  26          HD23      LEU  26  11.861  13.157   4.731
  178    H    ASP  27           H        ASP  27   8.802  15.696   3.982
  179    HA   ASP  27           HA       ASP  27   7.557  14.204   2.857
  180    HB2  ASP  27           HB2      ASP  27   9.959  14.038   0.986
  181    HB3  ASP  27           HB3      ASP  27   8.355  13.413   0.624
  182    H    ASP  28           H        ASP  28   8.194  13.008   5.001
  183    HA   ASP  28           HA       ASP  28   9.714  10.625   4.902
  184    HB2  ASP  28           HB2      ASP  28   8.913  11.711   7.013
  185    HB3  ASP  28           HB3      ASP  28   7.272  11.187   6.647
  186    H    MET  29           H        MET  29   6.448  11.351   3.879
  187    HA   MET  29           HA       MET  29   5.428   8.739   3.536
  188    HB2  MET  29           HB2      MET  29   4.677  11.166   1.855
  189    HB3  MET  29           HB3      MET  29   3.685   9.753   2.194
  190    HG2  MET  29           HG2      MET  29   3.767  10.477   4.649
  191    HG3  MET  29           HG3      MET  29   4.437  11.996   4.064
  192    HE1  MET  29           HE1      MET  29   1.280   9.695   4.313
  193    HE2  MET  29           HE2      MET  29   1.580   9.628   2.574
  194    HE3  MET  29           HE3      MET  29   0.159  10.468   3.192
  195    H    ASN  30           H        ASN  30   7.399  10.821   1.435
  196    HA   ASN  30           HA       ASN  30   7.161   9.372  -0.990
  197    HB2  ASN  30           HB2      ASN  30   8.084  11.759  -0.620
  198    HB3  ASN  30           HB3      ASN  30   9.604  10.999  -0.181
  199   HD21  ASN  30          HD21      ASN  30   9.109  12.818  -2.346
  200   HD22  ASN  30          HD22      ASN  30   9.515  11.996  -3.808
  201    H    HIS  31           H        HIS  31   9.369   8.959   1.773
  202    HA   HIS  31           HA       HIS  31  11.092   6.987   0.682
  203    HB2  HIS  31           HB2      HIS  31  10.220   7.388   3.577
  204    HB3  HIS  31           HB3      HIS  31  11.560   6.365   3.067
  205    HD2  HIS  31           HD2      HIS  31  10.759  10.087   3.714
  206    HE1  HIS  31           HE1      HIS  31  14.809   9.777   2.564
  207    HE2  HIS  31           HE2      HIS  31  12.972  11.351   3.294
  208    H    CYS  32           H        CYS  32   7.947   6.749   2.273
  209    HA   CYS  32           HA       CYS  32   7.741   3.898   2.309
  210    HB2  CYS  32           HB2      CYS  32   5.531   5.983   2.433
  211    HB3  CYS  32           HB3      CYS  32   5.396   4.294   2.913
  212    HG   CYS  32           HG       CYS  32   7.795   5.099   4.716
  213    H    TYR  33           H        TYR  33   6.501   6.403   0.089
  214    HA   TYR  33           HA       TYR  33   5.081   4.722  -1.695
  215    HB2  TYR  33           HB2      TYR  33   6.190   7.536  -1.916
  216    HB3  TYR  33           HB3      TYR  33   5.451   6.767  -3.318
  217    HD1  TYR  33           HD1      TYR  33   3.105   5.596  -2.747
  218    HD2  TYR  33           HD2      TYR  33   4.715   8.923  -0.620
  219    HE1  TYR  33           HE1      TYR  33   0.866   6.202  -2.030
  220    HE2  TYR  33           HE2      TYR  33   2.453   9.535   0.124
  221    HH   TYR  33           HH       TYR  33   0.170   9.192  -0.448
  222    H    SER  34           H        SER  34   8.447   5.752  -1.595
  223    HA   SER  34           HA       SER  34   9.453   4.786  -4.007
  224    HB2  SER  34           HB2      SER  34  10.856   6.062  -2.457
  225    HB3  SER  34           HB3      SER  34  10.746   4.789  -1.244
  226    HG   SER  34           HG       SER  34  12.115   3.558  -2.372
  227    H    ARG  35           H        ARG  35   8.965   3.075  -0.926
  228    HA   ARG  35           HA       ARG  35   9.923   0.558  -1.918
  229    HB2  ARG  35           HB2      ARG  35   9.528   1.649   0.653
  230    HB3  ARG  35           HB3      ARG  35   8.330   0.369   0.569
  231    HG2  ARG  35           HG2      ARG  35  11.308   0.032   0.070
  232    HG3  ARG  35           HG3      ARG  35  10.458  -0.411   1.554
  233    HD2  ARG  35           HD2      ARG  35   9.191  -2.109   0.382
  234    HD3  ARG  35           HD3      ARG  35   9.855  -1.594  -1.174
  235    HE   ARG  35           HE       ARG  35  11.935  -2.321   0.606
  236   HH11  ARG  35          HH11      ARG  35   9.532  -3.764  -1.412
  237   HH12  ARG  35          HH12      ARG  35  10.410  -5.239  -1.577
  238   HH21  ARG  35          HH21      ARG  35  13.053  -4.204   0.348
  239   HH22  ARG  35          HH22      ARG  35  12.378  -5.480  -0.604
  240    H    LEU  36           H        LEU  36   6.687   2.018  -1.587
  241    HA   LEU  36           HA       LEU  36   5.172  -0.307  -2.154
  242    HB2  LEU  36           HB2      LEU  36   4.502   2.558  -2.872
  243    HB3  LEU  36           HB3      LEU  36   3.380   1.222  -2.957
  244    HG   LEU  36           HG       LEU  36   4.631   2.293  -0.399
  245   HD11  LEU  36          HD11      LEU  36   1.789   2.534  -1.427
  246   HD12  LEU  36          HD12      LEU  36   2.972   3.839  -1.316
  247   HD13  LEU  36          HD13      LEU  36   2.368   3.075   0.153
  248   HD21  LEU  36          HD21      LEU  36   4.231  -0.126  -0.221
  249   HD22  LEU  36          HD22      LEU  36   2.565   0.091  -0.764
  250   HD23  LEU  36          HD23      LEU  36   3.087   0.767   0.781
  251    H    ARG  37           H        ARG  37   7.010   1.828  -4.284
  252    HA   ARG  37           HA       ARG  37   6.046   0.806  -6.774
  253    HB2  ARG  37           HB2      ARG  37   8.728   2.060  -6.107
  254    HB3  ARG  37           HB3      ARG  37   8.151   1.720  -7.737
  255    HG2  ARG  37           HG2      ARG  37   6.229   3.245  -7.351
  256    HG3  ARG  37           HG3      ARG  37   6.880   3.627  -5.757
  257    HD2  ARG  37           HD2      ARG  37   8.213   4.182  -8.422
  258    HD3  ARG  37           HD3      ARG  37   7.448   5.363  -7.366
  259    HE   ARG  37           HE       ARG  37   9.712   3.819  -6.309
  260   HH11  ARG  37          HH11      ARG  37   8.584   6.919  -7.402
  261   HH12  ARG  37          HH12      ARG  37   9.998   7.728  -6.830
  262   HH21  ARG  37          HH21      ARG  37  11.485   4.898  -5.623
  263   HH22  ARG  37          HH22      ARG  37  11.601   6.610  -5.844
  264    H    GLU  38           H        GLU  38   8.345  -0.379  -4.441
  265    HA   GLU  38           HA       GLU  38   9.716  -2.239  -6.222
  266    HB2  GLU  38           HB2      GLU  38   9.924  -1.869  -3.205
  267    HB3  GLU  38           HB3      GLU  38  11.013  -2.838  -4.188
  268    HG2  GLU  38           HG2      GLU  38  11.826  -0.817  -5.328
  269    HG3  GLU  38           HG3      GLU  38  10.675   0.169  -4.427
  270    H    LEU  39           H        LEU  39   7.236  -2.282  -3.765
  271    HA   LEU  39           HA       LEU  39   7.043  -5.120  -3.371
  272    HB2  LEU  39           HB2      LEU  39   5.114  -2.865  -2.752
  273    HB3  LEU  39           HB3      LEU  39   4.938  -4.514  -2.167
  274    HG   LEU  39           HG       LEU  39   7.322  -2.754  -1.486
  275   HD11  LEU  39          HD11      LEU  39   4.822  -3.208   0.147
  276   HD12  LEU  39          HD12      LEU  39   5.298  -1.702  -0.643
  277   HD13  LEU  39          HD13      LEU  39   6.271  -2.347   0.678
  278   HD21  LEU  39          HD21      LEU  39   6.340  -5.318  -0.179
  279   HD22  LEU  39          HD22      LEU  39   7.742  -4.362   0.308
  280   HD23  LEU  39          HD23      LEU  39   7.739  -5.185  -1.250
  281    H    VAL  40           H        VAL  40   5.829  -2.954  -5.756
  282    HA   VAL  40           HA       VAL  40   3.828  -4.923  -6.729
  283    HB   VAL  40           HB       VAL  40   3.960  -1.975  -7.513
  284   HG11  VAL  40          HG11      VAL  40   1.720  -4.017  -7.741
  285   HG12  VAL  40          HG12      VAL  40   2.693  -3.380  -9.067
  286   HG13  VAL  40          HG13      VAL  40   1.597  -2.312  -8.187
  287   HG21  VAL  40          HG21      VAL  40   2.278  -3.171  -5.278
  288   HG22  VAL  40          HG22      VAL  40   2.163  -1.514  -5.887
  289   HG23  VAL  40          HG23      VAL  40   3.641  -2.055  -5.084
  290    HA   PRO  41           HA       PRO  41   7.100  -5.169 -10.035
  291    HB2  PRO  41           HB2      PRO  41   6.622  -7.757 -10.769
  292    HB3  PRO  41           HB3      PRO  41   7.586  -7.344  -9.346
  293    HG2  PRO  41           HG2      PRO  41   4.680  -8.147  -9.492
  294    HG3  PRO  41           HG3      PRO  41   5.938  -8.712  -8.372
  295    HD2  PRO  41           HD2      PRO  41   4.112  -6.793  -7.694
  296    HD3  PRO  41           HD3      PRO  41   5.756  -6.825  -7.019
  297    H    GLY  42           H        GLY  42   3.645  -5.642 -10.079
  298    HA2  GLY  42           HA2      GLY  42   3.355  -5.763 -12.977
  299    HA3  GLY  42           HA3      GLY  42   2.070  -5.719 -11.783
  300    H    VAL  43           H        VAL  43   4.728  -3.568 -12.765
  301    HA   VAL  43           HA       VAL  43   2.975  -1.220 -12.754
  302    HB   VAL  43           HB       VAL  43   5.983  -1.412 -13.279
  303   HG11  VAL  43          HG11      VAL  43   5.025   0.602 -14.317
  304   HG12  VAL  43          HG12      VAL  43   6.022   1.037 -12.932
  305   HG13  VAL  43          HG13      VAL  43   4.264   1.054 -12.787
  306   HG21  VAL  43          HG21      VAL  43   5.445  -2.086 -10.972
  307   HG22  VAL  43          HG22      VAL  43   4.522  -0.602 -10.726
  308   HG23  VAL  43          HG23      VAL  43   6.268  -0.525 -10.981
  309    HA   PRO  44           HA       PRO  44   2.139  -2.003 -17.196
  310    HB2  PRO  44           HB2      PRO  44   1.111   0.830 -17.025
  311    HB3  PRO  44           HB3      PRO  44   0.329  -0.616 -17.686
  312    HG2  PRO  44           HG2      PRO  44  -0.434   0.327 -15.316
  313    HG3  PRO  44           HG3      PRO  44  -0.260  -1.428 -15.551
  314    HD2  PRO  44           HD2      PRO  44   1.633   0.500 -14.194
  315    HD3  PRO  44           HD3      PRO  44   1.138  -1.131 -13.685
  316    H    ARG  45           H        ARG  45   3.626  -1.852 -18.795
  317    HA   ARG  45           HA       ARG  45   5.808  -0.029 -18.831
  318    HB2  ARG  45           HB2      ARG  45   6.029  -2.251 -19.820
  319    HB3  ARG  45           HB3      ARG  45   4.739  -1.926 -20.970
  320    HG2  ARG  45           HG2      ARG  45   6.895  -1.830 -22.096
  321    HG3  ARG  45           HG3      ARG  45   6.161  -0.228 -22.087
  322    HD2  ARG  45           HD2      ARG  45   7.635   0.364 -20.123
  323    HD3  ARG  45           HD3      ARG  45   8.433  -1.206 -20.312
  324    HE   ARG  45           HE       ARG  45   8.395   0.298 -22.749
  325   HH11  ARG  45          HH11      ARG  45  10.195  -0.047 -19.797
  326   HH12  ARG  45          HH12      ARG  45  11.609   0.672 -20.479
  327   HH21  ARG  45          HH21      ARG  45  10.198   1.198 -23.565
  328   HH22  ARG  45          HH22      ARG  45  11.610   1.369 -22.584
  329    H    GLY  46           H        GLY  46   5.433   2.103 -19.094
  330    HA2  GLY  46           HA2      GLY  46   5.201   3.856 -20.816
  331    HA3  GLY  46           HA3      GLY  46   3.706   3.082 -21.320
  332    H    THR  47           H        THR  47   4.691   3.571 -17.951
  333    HA   THR  47           HA       THR  47   2.538   5.600 -17.584
  334    HB   THR  47           HB       THR  47   2.033   3.426 -16.434
  335    HG1  THR  47           HG1      THR  47   1.081   4.626 -14.978
  336   HG21  THR  47          HG21      THR  47   3.310   2.749 -14.440
  337   HG22  THR  47          HG22      THR  47   4.478   4.036 -14.736
  338   HG23  THR  47          HG23      THR  47   4.332   2.702 -15.881
  339    H    GLN  48           H        GLN  48   2.902   7.057 -15.665
  340    HA   GLN  48           HA       GLN  48   5.770   7.735 -15.282
  341    HB2  GLN  48           HB2      GLN  48   3.381   9.624 -15.379
  342    HB3  GLN  48           HB3      GLN  48   5.014  10.110 -14.931
  343    HG2  GLN  48           HG2      GLN  48   5.782   9.313 -17.204
  344    HG3  GLN  48           HG3      GLN  48   4.088   9.084 -17.632
  345   HE21  GLN  48          HE21      GLN  48   2.785  10.948 -17.928
  346   HE22  GLN  48          HE22      GLN  48   3.475  12.516 -18.147
  347    H    LEU  49           H        LEU  49   2.572   7.892 -13.688
  348    HA   LEU  49           HA       LEU  49   1.826   7.601 -11.582
  349    HB2  LEU  49           HB2      LEU  49   4.553   6.396 -10.989
  350    HB3  LEU  49           HB3      LEU  49   3.137   6.253  -9.962
  351    HG   LEU  49           HG       LEU  49   3.275   5.126 -12.787
  352   HD11  LEU  49          HD11      LEU  49   3.588   2.910 -11.780
  353   HD12  LEU  49          HD12      LEU  49   3.715   3.646 -10.181
  354   HD13  LEU  49          HD13      LEU  49   4.934   3.986 -11.410
  355   HD21  LEU  49          HD21      LEU  49   1.272   4.619 -10.554
  356   HD22  LEU  49          HD22      LEU  49   1.288   3.830 -12.134
  357   HD23  LEU  49          HD23      LEU  49   0.980   5.560 -12.022
  358    H    SER  50           H        SER  50   1.545   8.924  -9.802
  359    HA   SER  50           HA       SER  50   3.762  10.720  -8.985
  360    HB2  SER  50           HB2      SER  50   0.884  11.638  -9.416
  361    HB3  SER  50           HB3      SER  50   2.220  12.643  -8.847
  362    HG   SER  50           HG       SER  50   1.682  11.638 -11.402
  363    H    GLN  51           H        GLN  51   0.331  10.240  -7.917
  364    HA   GLN  51           HA       GLN  51   1.328  10.011  -5.121
  365    HB2  GLN  51           HB2      GLN  51  -1.011  11.718  -6.069
  366    HB3  GLN  51           HB3      GLN  51  -0.542  11.493  -4.388
  367    HG2  GLN  51           HG2      GLN  51   1.544  12.679  -4.750
  368    HG3  GLN  51           HG3      GLN  51   1.254  12.758  -6.481
  369   HE21  GLN  51          HE21      GLN  51   0.297  14.044  -3.361
  370   HE22  GLN  51          HE22      GLN  51  -0.535  15.424  -3.979
  371    H    VAL  52           H        VAL  52  -1.964  10.026  -6.554
  372    HA   VAL  52           HA       VAL  52  -2.903   8.109  -4.619
  373    HB   VAL  52           HB       VAL  52  -4.464   8.936  -7.103
  374   HG11  VAL  52          HG11      VAL  52  -5.500   7.210  -5.701
  375   HG12  VAL  52          HG12      VAL  52  -6.432   8.703  -5.618
  376   HG13  VAL  52          HG13      VAL  52  -5.369   8.251  -4.279
  377   HG21  VAL  52          HG21      VAL  52  -3.566  11.019  -6.181
  378   HG22  VAL  52          HG22      VAL  52  -4.166  10.598  -4.579
  379   HG23  VAL  52          HG23      VAL  52  -5.305  10.923  -5.889
  380    H    GLU  53           H        GLU  53  -1.987   8.020  -7.947
  381    HA   GLU  53           HA       GLU  53  -3.012   5.623  -8.913
  382    HB2  GLU  53           HB2      GLU  53  -0.318   6.813  -9.699
  383    HB3  GLU  53           HB3      GLU  53  -1.317   5.742 -10.670
  384    HG2  GLU  53           HG2      GLU  53  -1.635   7.846 -11.652
  385    HG3  GLU  53           HG3      GLU  53  -3.071   7.642 -10.653
  386    H    ILE  54           H        ILE  54  -0.158   6.245  -6.965
  387    HA   ILE  54           HA       ILE  54   1.074   3.684  -7.139
  388    HB   ILE  54           HB       ILE  54   1.274   5.811  -4.960
  389   HG12  ILE  54          HG12      ILE  54   3.088   5.262  -7.367
  390   HG13  ILE  54          HG13      ILE  54   1.987   6.624  -7.204
  391   HG21  ILE  54          HG21      ILE  54   2.018   3.682  -4.041
  392   HG22  ILE  54          HG22      ILE  54   3.420   4.710  -4.316
  393   HG23  ILE  54          HG23      ILE  54   3.063   3.394  -5.439
  394   HD11  ILE  54          HD11      ILE  54   4.433   6.102  -5.517
  395   HD12  ILE  54          HD12      ILE  54   3.317   7.457  -5.315
  396   HD13  ILE  54          HD13      ILE  54   4.263   7.304  -6.796
  397    H    LEU  55           H        LEU  55  -1.111   5.124  -4.686
  398    HA   LEU  55           HA       LEU  55  -1.353   2.942  -2.930
  399    HB2  LEU  55           HB2      LEU  55  -3.429   5.054  -3.634
  400    HB3  LEU  55           HB3      LEU  55  -3.504   4.003  -2.232
  401    HG   LEU  55           HG       LEU  55  -1.376   6.126  -2.713
  402   HD11  LEU  55          HD11      LEU  55  -3.717   6.136  -0.776
  403   HD12  LEU  55          HD12      LEU  55  -3.565   7.133  -2.224
  404   HD13  LEU  55          HD13      LEU  55  -2.451   7.365  -0.879
  405   HD21  LEU  55          HD21      LEU  55  -1.839   4.356  -0.290
  406   HD22  LEU  55          HD22      LEU  55  -0.656   5.660  -0.412
  407   HD23  LEU  55          HD23      LEU  55  -0.491   4.230  -1.425
  408    H    GLN  56           H        GLN  56  -3.390   3.852  -5.697
  409    HA   GLN  56           HA       GLN  56  -5.216   1.716  -5.672
  410    HB2  GLN  56           HB2      GLN  56  -4.226   3.419  -7.999
  411    HB3  GLN  56           HB3      GLN  56  -5.640   2.369  -8.065
  412    HG2  GLN  56           HG2      GLN  56  -6.772   3.718  -6.364
  413    HG3  GLN  56           HG3      GLN  56  -5.336   4.717  -6.162
  414   HE21  GLN  56          HE21      GLN  56  -4.852   6.258  -7.756
  415   HE22  GLN  56          HE22      GLN  56  -5.990   6.743  -8.955
  416    H    ARG  57           H        ARG  57  -2.044   2.038  -7.265
  417    HA   ARG  57           HA       ARG  57  -2.077  -0.367  -8.775
  418    HB2  ARG  57           HB2      ARG  57  -0.536   1.644  -9.067
  419    HB3  ARG  57           HB3      ARG  57   0.379   1.061  -7.687
  420    HG2  ARG  57           HG2      ARG  57   0.713  -1.112  -9.030
  421    HG3  ARG  57           HG3      ARG  57   0.100  -0.215 -10.421
  422    HD2  ARG  57           HD2      ARG  57   2.541  -0.163 -10.419
  423    HD3  ARG  57           HD3      ARG  57   1.924   1.464 -10.100
  424    HE   ARG  57           HE       ARG  57   3.024  -0.370  -8.049
  425   HH11  ARG  57          HH11      ARG  57   2.482   2.860  -9.127
  426   HH12  ARG  57          HH12      ARG  57   3.256   3.557  -7.753
  427   HH21  ARG  57          HH21      ARG  57   3.971   0.544  -6.279
  428   HH22  ARG  57          HH22      ARG  57   4.079   2.265  -6.161
  429    H    VAL  58           H        VAL  58  -1.120   0.316  -5.441
  430    HA   VAL  58           HA       VAL  58  -0.037  -2.256  -4.793
  431    HB   VAL  58           HB       VAL  58  -1.229  -0.086  -2.994
  432   HG11  VAL  58          HG11      VAL  58  -1.322  -2.237  -1.814
  433   HG12  VAL  58          HG12      VAL  58  -0.084  -1.202  -1.107
  434   HG13  VAL  58          HG13      VAL  58   0.382  -2.531  -2.171
  435   HG21  VAL  58          HG21      VAL  58   1.129   0.483  -2.498
  436   HG22  VAL  58          HG22      VAL  58   0.789   0.630  -4.221
  437   HG23  VAL  58          HG23      VAL  58   1.675  -0.769  -3.619
  438    H    ILE  59           H        ILE  59  -3.309  -0.839  -4.506
  439    HA   ILE  59           HA       ILE  59  -4.647  -3.074  -3.404
  440    HB   ILE  59           HB       ILE  59  -5.751  -0.929  -5.285
  441   HG12  ILE  59          HG12      ILE  59  -5.806  -1.032  -2.223
  442   HG13  ILE  59          HG13      ILE  59  -4.717  -0.029  -3.171
  443   HG21  ILE  59          HG21      ILE  59  -7.983  -1.482  -4.352
  444   HG22  ILE  59          HG22      ILE  59  -7.270  -2.805  -3.428
  445   HG23  ILE  59          HG23      ILE  59  -7.276  -2.862  -5.190
  446   HD11  ILE  59          HD11      ILE  59  -6.644   1.207  -4.057
  447   HD12  ILE  59          HD12      ILE  59  -6.552   1.272  -2.296
  448   HD13  ILE  59          HD13      ILE  59  -7.721   0.206  -3.078
  449    H    ASP  60           H        ASP  60  -3.921  -2.201  -6.799
  450    HA   ASP  60           HA       ASP  60  -5.157  -4.357  -8.117
  451    HB2  ASP  60           HB2      ASP  60  -2.699  -2.735  -8.879
  452    HB3  ASP  60           HB3      ASP  60  -3.385  -3.957  -9.943
  453    H    TYR  61           H        TYR  61  -1.872  -4.114  -6.719
  454    HA   TYR  61           HA       TYR  61  -0.865  -6.609  -7.509
  455    HB2  TYR  61           HB2      TYR  61   0.641  -4.952  -6.590
  456    HB3  TYR  61           HB3      TYR  61  -0.247  -4.893  -5.073
  457    HD1  TYR  61           HD1      TYR  61   1.857  -7.186  -7.174
  458    HD2  TYR  61           HD2      TYR  61   0.432  -6.285  -3.249
  459    HE1  TYR  61           HE1      TYR  61   3.349  -8.895  -6.244
  460    HE2  TYR  61           HE2      TYR  61   1.931  -7.995  -2.322
  461    HH   TYR  61           HH       TYR  61   3.054 -10.106  -3.144
  462    H    ILE  62           H        ILE  62  -2.519  -5.749  -4.450
  463    HA   ILE  62           HA       ILE  62  -2.319  -8.320  -3.257
  464    HB   ILE  62           HB       ILE  62  -4.264  -6.059  -2.583
  465   HG12  ILE  62          HG12      ILE  62  -1.515  -6.668  -1.372
  466   HG13  ILE  62          HG13      ILE  62  -1.844  -5.365  -2.504
  467   HG21  ILE  62          HG21      ILE  62  -3.375  -8.413  -0.863
  468   HG22  ILE  62          HG22      ILE  62  -4.981  -8.186  -1.558
  469   HG23  ILE  62          HG23      ILE  62  -4.392  -7.075  -0.324
  470   HD11  ILE  62          HD11      ILE  62  -2.962  -5.614   0.292
  471   HD12  ILE  62          HD12      ILE  62  -3.321  -4.309  -0.843
  472   HD13  ILE  62          HD13      ILE  62  -1.677  -4.527  -0.240
  473    H    LEU  63           H        LEU  63  -5.049  -6.725  -4.970
  474    HA   LEU  63           HA       LEU  63  -6.873  -8.906  -4.712
  475    HB2  LEU  63           HB2      LEU  63  -6.883  -6.586  -6.671
  476    HB3  LEU  63           HB3      LEU  63  -8.196  -7.737  -6.492
  477    HG   LEU  63           HG       LEU  63  -7.255  -5.742  -4.396
  478   HD11  LEU  63          HD11      LEU  63  -9.484  -4.735  -4.680
  479   HD12  LEU  63          HD12      LEU  63  -9.863  -5.916  -5.935
  480   HD13  LEU  63          HD13      LEU  63  -8.579  -4.736  -6.195
  481   HD21  LEU  63          HD21      LEU  63  -9.439  -7.847  -4.152
  482   HD22  LEU  63          HD22      LEU  63  -9.119  -6.562  -2.986
  483   HD23  LEU  63          HD23      LEU  63  -7.915  -7.815  -3.263
  484    H    ASP  64           H        ASP  64  -4.402  -8.150  -7.130
  485    HA   ASP  64           HA       ASP  64  -5.126 -10.000  -9.145
  486    HB2  ASP  64           HB2      ASP  64  -3.427  -8.224  -9.458
  487    HB3  ASP  64           HB3      ASP  64  -2.355  -9.029  -8.322
  488    H    LEU  65           H        LEU  65  -3.224 -10.381  -6.178
  489    HA   LEU  65           HA       LEU  65  -2.410 -13.091  -6.602
  490    HB2  LEU  65           HB2      LEU  65  -2.680 -11.581  -3.975
  491    HB3  LEU  65           HB3      LEU  65  -1.777 -13.068  -4.221
  492    HG   LEU  65           HG       LEU  65  -1.094 -10.332  -5.358
  493   HD11  LEU  65          HD11      LEU  65  -0.545 -10.537  -2.990
  494   HD12  LEU  65          HD12      LEU  65   0.924 -10.493  -3.961
  495   HD13  LEU  65          HD13      LEU  65   0.350 -12.027  -3.305
  496   HD21  LEU  65          HD21      LEU  65   0.358 -12.960  -5.809
  497   HD22  LEU  65          HD22      LEU  65   0.937 -11.366  -6.299
  498   HD23  LEU  65          HD23      LEU  65  -0.526 -12.028  -7.024
  499    H    GLN  66           H        GLN  66  -5.159 -11.584  -4.967
  500    HA   GLN  66           HA       GLN  66  -6.145 -14.017  -3.753
  501    HB2  GLN  66           HB2      GLN  66  -7.353 -11.233  -3.956
  502    HB3  GLN  66           HB3      GLN  66  -8.082 -12.553  -3.046
  503    HG2  GLN  66           HG2      GLN  66  -6.068 -12.657  -1.605
  504    HG3  GLN  66           HG3      GLN  66  -5.373 -11.305  -2.495
  505   HE21  GLN  66          HE21      GLN  66  -8.794 -11.547  -1.585
  506   HE22  GLN  66          HE22      GLN  66  -8.763 -10.231  -0.475
  507    H    VAL  67           H        VAL  67  -6.911 -12.236  -6.693
  508    HA   VAL  67           HA       VAL  67  -9.267 -13.968  -7.257
  509    HB   VAL  67           HB       VAL  67  -8.796 -11.099  -8.207
  510   HG11  VAL  67          HG11      VAL  67 -10.123 -12.375  -9.831
  511   HG12  VAL  67          HG12      VAL  67 -11.132 -11.174  -9.025
  512   HG13  VAL  67          HG13      VAL  67 -11.239 -12.873  -8.558
  513   HG21  VAL  67          HG21      VAL  67 -10.648 -10.461  -6.678
  514   HG22  VAL  67          HG22      VAL  67  -9.282 -11.139  -5.795
  515   HG23  VAL  67          HG23      VAL  67 -10.720 -12.120  -6.076
  516    H    VAL  68           H        VAL  68  -9.162 -15.225  -9.056
  517    HA   VAL  68           HA       VAL  68  -6.980 -14.858 -10.985
  518    HB   VAL  68           HB       VAL  68  -7.763 -17.073 -11.959
  519   HG11  VAL  68          HG11      VAL  68  -6.952 -17.076  -9.030
  520   HG12  VAL  68          HG12      VAL  68  -5.864 -16.945 -10.413
  521   HG13  VAL  68          HG13      VAL  68  -6.774 -18.431 -10.150
  522   HG21  VAL  68          HG21      VAL  68  -9.218 -18.529 -10.565
  523   HG22  VAL  68          HG22      VAL  68 -10.094 -17.119 -11.162
  524   HG23  VAL  68          HG23      VAL  68  -9.544 -17.168  -9.487
  525    H1   MET   1           H1       MET   1 -28.215   8.871  12.160
  526    H2   MET   1           H2       MET   1 -27.460  10.365  12.388
  527    H3   MET   1           H3       MET   1 -28.880  10.271  11.476
  528    HA   MET   1           HA       MET   1 -28.617   9.720  14.374
  529    HB2  MET   1           HB2      MET   1 -29.916  12.040  12.877
  530    HB3  MET   1           HB3      MET   1 -30.089  11.766  14.608
  531    HG2  MET   1           HG2      MET   1 -27.636  12.021  14.868
  532    HG3  MET   1           HG3      MET   1 -27.509  12.376  13.142
  533    HE1  MET   1           HE1      MET   1 -26.201  14.648  13.831
  534    HE2  MET   1           HE2      MET   1 -26.413  14.234  15.535
  535    HE3  MET   1           HE3      MET   1 -26.875  15.831  14.950
  536    H    GLY   2           H        GLY   2 -30.356   8.726  15.351
  537    HA2  GLY   2           HA2      GLY   2 -32.448   7.803  15.646
  538    HA3  GLY   2           HA3      GLY   2 -32.965   8.509  14.126
  539    H    HIS   3           H        HIS   3 -33.284   5.771  15.338
  540    HA   HIS   3           HA       HIS   3 -31.980   3.992  13.414
  541    HB2  HIS   3           HB2      HIS   3 -32.308   3.340  15.823
  542    HB3  HIS   3           HB3      HIS   3 -34.049   3.366  15.577
  543    HD2  HIS   3           HD2      HIS   3 -35.090   1.184  14.127
  544    HE1  HIS   3           HE1      HIS   3 -31.479  -1.011  14.190
  545    HE2  HIS   3           HE2      HIS   3 -33.894  -1.013  13.466
  546    H    HIS   4           H        HIS   4 -35.174   5.354  14.085
  547    HA   HIS   4           HA       HIS   4 -36.403   3.984  11.763
  548    HB2  HIS   4           HB2      HIS   4 -37.719   5.445  14.100
  549    HB3  HIS   4           HB3      HIS   4 -38.572   4.583  12.824
  550    HD2  HIS   4           HD2      HIS   4 -36.406   3.804  16.002
  551    HE1  HIS   4           HE1      HIS   4 -38.350   0.272  14.727
  552    HE2  HIS   4           HE2      HIS   4 -37.104   1.394  16.615
  553    H    HIS   5           H        HIS   5 -35.862   5.283  10.012
  554    HA   HIS   5           HA       HIS   5 -36.224   8.195  10.109
  555    HB2  HIS   5           HB2      HIS   5 -35.222   6.434   7.828
  556    HB3  HIS   5           HB3      HIS   5 -35.187   8.194   7.868
  557    HD2  HIS   5           HD2      HIS   5 -33.457   9.209  10.054
  558    HE1  HIS   5           HE1      HIS   5 -31.026   5.757   9.783
  559    HE2  HIS   5           HE2      HIS   5 -31.304   8.024  10.861
  560    H    HIS   6           H        HIS   6 -38.475   8.372  10.256
  561    HA   HIS   6           HA       HIS   6 -40.196   7.215   8.168
  562    HB2  HIS   6           HB2      HIS   6 -40.794   8.633  10.788
  563    HB3  HIS   6           HB3      HIS   6 -42.053   8.254   9.618
  564    HD2  HIS   6           HD2      HIS   6 -39.453   6.266  11.834
  565    HE1  HIS   6           HE1      HIS   6 -42.773   3.803  10.924
  566    HE2  HIS   6           HE2      HIS   6 -40.686   4.041  12.331
  567    H    HIS   7           H        HIS   7 -40.320   8.366   6.334
  568    HA   HIS   7           HA       HIS   7 -40.842  11.288   6.437
  569    HB2  HIS   7           HB2      HIS   7 -38.954  10.674   4.975
  570    HB3  HIS   7           HB3      HIS   7 -39.954   9.507   4.120
  571    HD2  HIS   7           HD2      HIS   7 -40.400  13.415   4.738
  572    HE1  HIS   7           HE1      HIS   7 -41.096  12.480   0.673
  573    HE2  HIS   7           HE2      HIS   7 -41.149  14.293   2.426
  574    H    HIS   8           H        HIS   8 -43.018  11.411   6.848
  575    HA   HIS   8           HA       HIS   8 -44.928   9.486   5.854
  576    HB2  HIS   8           HB2      HIS   8 -44.956  10.723   8.141
  577    HB3  HIS   8           HB3      HIS   8 -45.621  12.093   7.261
  578    HD2  HIS   8           HD2      HIS   8 -47.103   8.805   5.991
  579    HE1  HIS   8           HE1      HIS   8 -49.719  10.273   8.966
  580    HE2  HIS   8           HE2      HIS   8 -49.283   8.407   7.322
  581    H    SER   9           H        SER   9 -44.678  13.047   5.469
  582    HA   SER   9           HA       SER   9 -44.786  14.446   3.713
  583    HB2  SER   9           HB2      SER   9 -43.356  12.859   2.518
  584    HB3  SER   9           HB3      SER   9 -44.768  11.949   1.986
  585    HG   SER   9           HG       SER   9 -44.182  13.307   0.334
  586    H    HIS  10           H        HIS  10 -46.511  15.689   3.305
  587    HA   HIS  10           HA       HIS  10 -48.926  14.551   2.009
  588    HB2  HIS  10           HB2      HIS  10 -48.906  16.499   4.358
  589    HB3  HIS  10           HB3      HIS  10 -50.340  16.155   3.391
  590    HD1  HIS  10           HD1      HIS  10 -48.036  14.585   5.922
  591    HD2  HIS  10           HD2      HIS  10 -51.610  13.737   3.977
  592    HE1  HIS  10           HE1      HIS  10 -48.954  12.553   7.056
  593    HE2  HIS  10           HE2      HIS  10 -51.219  12.223   6.030
  594    H    MET  11           H        MET  11 -50.043  15.962   0.621
  595    HA   MET  11           HA       MET  11 -48.337  17.617  -0.948
  596    HB2  MET  11           HB2      MET  11 -51.358  17.283  -1.164
  597    HB3  MET  11           HB3      MET  11 -50.290  17.912  -2.414
  598    HG2  MET  11           HG2      MET  11 -50.322  15.079  -1.348
  599    HG3  MET  11           HG3      MET  11 -50.933  15.618  -2.917
  600    HE1  MET  11           HE1      MET  11 -47.766  13.560  -3.969
  601    HE2  MET  11           HE2      MET  11 -49.498  13.792  -4.219
  602    HE3  MET  11           HE3      MET  11 -48.905  13.176  -2.676
  603    H    GLY  12           H        GLY  12 -47.696  19.547  -0.034
  604    HA2  GLY  12           HA2      GLY  12 -47.879  21.853   0.118
  605    HA3  GLY  12           HA3      GLY  12 -49.619  21.729  -0.026
  606    H    GLY  13           H        GLY  13 -49.565  19.754   2.364
  607    HA2  GLY  13           HA2      GLY  13 -50.107  21.701   4.411
  608    HA3  GLY  13           HA3      GLY  13 -50.197  19.955   4.561
  609    H    GLY  14           H        GLY  14 -47.962  22.701   4.602
  610    HA2  GLY  14           HA2      GLY  14 -46.081  23.127   5.862
  611    HA3  GLY  14           HA3      GLY  14 -46.409  21.673   6.786
  612    H    LYS  15           H        LYS  15 -44.828  22.964   3.895
  613    HA   LYS  15           HA       LYS  15 -43.360  20.463   3.426
  614    HB2  LYS  15           HB2      LYS  15 -43.300  23.113   1.934
  615    HB3  LYS  15           HB3      LYS  15 -42.320  21.715   1.508
  616    HG2  LYS  15           HG2      LYS  15 -44.468  20.422   1.152
  617    HG3  LYS  15           HG3      LYS  15 -45.343  21.944   1.363
  618    HD2  LYS  15           HD2      LYS  15 -44.100  22.920  -0.555
  619    HD3  LYS  15           HD3      LYS  15 -43.222  21.401  -0.754
  620    HE2  LYS  15           HE2      LYS  15 -45.412  20.265  -1.180
  621    HE3  LYS  15           HE3      LYS  15 -46.196  21.843  -1.142
  622    HZ1  LYS  15           HZ1      LYS  15 -44.081  20.990  -3.045
  623    HZ2  LYS  15           HZ2      LYS  15 -44.808  22.514  -3.015
  624    HZ3  LYS  15           HZ3      LYS  15 -45.728  21.149  -3.392
  625    H    GLY  16           H        GLY  16 -41.203  20.138   3.876
  626    HA2  GLY  16           HA2      GLY  16 -39.572  22.165   5.195
  627    HA3  GLY  16           HA3      GLY  16 -39.058  20.562   4.680
  628    HA   PRO  17           HA       PRO  17 -38.146  24.227   1.436
  629    HB2  PRO  17           HB2      PRO  17 -35.499  24.477   2.850
  630    HB3  PRO  17           HB3      PRO  17 -36.496  25.728   2.087
  631    HG2  PRO  17           HG2      PRO  17 -36.423  25.510   4.745
  632    HG3  PRO  17           HG3      PRO  17 -37.964  25.853   3.924
  633    HD2  PRO  17           HD2      PRO  17 -36.950  23.234   5.055
  634    HD3  PRO  17           HD3      PRO  17 -38.581  23.940   5.143
  635    H    ALA  18           H        ALA  18 -38.074  22.647  -0.122
  636    HA   ALA  18           HA       ALA  18 -36.232  20.451  -0.188
  637    HB1  ALA  18           HB1      ALA  18 -37.338  19.868  -2.297
  638    HB2  ALA  18           HB2      ALA  18 -38.137  21.444  -2.335
  639    HB3  ALA  18           HB3      ALA  18 -38.524  20.288  -1.061
  640    H    ALA  19           H        ALA  19 -34.110  20.922  -0.509
  641    HA   ALA  19           HA       ALA  19 -33.240  21.642  -3.150
  642    HB1  ALA  19           HB1      ALA  19 -32.386  23.488  -0.880
  643    HB2  ALA  19           HB2      ALA  19 -33.482  23.921  -2.191
  644    HB3  ALA  19           HB3      ALA  19 -31.796  23.542  -2.542
  645    H    GLU  20           H        GLU  20 -31.304  20.701  -3.611
  646    HA   GLU  20           HA       GLU  20 -30.085  18.873  -1.790
  647    HB2  GLU  20           HB2      GLU  20 -28.481  18.385  -3.573
  648    HB3  GLU  20           HB3      GLU  20 -30.105  18.442  -4.234
  649    HG2  GLU  20           HG2      GLU  20 -28.184  20.783  -4.431
  650    HG3  GLU  20           HG3      GLU  20 -28.222  19.492  -5.622
  651    H    GLU  21           H        GLU  21 -28.114  18.967  -0.727
  652    HA   GLU  21           HA       GLU  21 -27.122  21.569   0.035
  653    HB2  GLU  21           HB2      GLU  21 -25.569  20.237   1.528
  654    HB3  GLU  21           HB3      GLU  21 -27.281  19.933   1.785
  655    HG2  GLU  21           HG2      GLU  21 -27.066  17.848   0.396
  656    HG3  GLU  21           HG3      GLU  21 -25.329  18.136   0.312
  657    HA   PRO  22           HA       PRO  22 -23.906  21.696  -3.113
  658    HB2  PRO  22           HB2      PRO  22 -22.634  23.978  -2.409
  659    HB3  PRO  22           HB3      PRO  22 -24.301  23.992  -3.003
  660    HG2  PRO  22           HG2      PRO  22 -23.294  24.169  -0.169
  661    HG3  PRO  22           HG3      PRO  22 -24.594  25.090  -0.954
  662    HD2  PRO  22           HD2      PRO  22 -25.001  22.866   0.668
  663    HD3  PRO  22           HD3      PRO  22 -26.154  23.432  -0.557
  664    H    LEU  23           H        LEU  23 -22.256  20.319  -3.215
  665    HA   LEU  23           HA       LEU  23 -20.297  19.249  -2.972
  666    HB2  LEU  23           HB2      LEU  23 -19.548  21.571  -1.175
  667    HB3  LEU  23           HB3      LEU  23 -18.413  20.350  -1.727
  668    HG   LEU  23           HG       LEU  23 -19.902  22.313  -3.524
  669   HD11  LEU  23          HD11      LEU  23 -18.176  23.437  -2.200
  670   HD12  LEU  23          HD12      LEU  23 -17.711  23.359  -3.898
  671   HD13  LEU  23          HD13      LEU  23 -16.977  22.255  -2.733
  672   HD21  LEU  23          HD21      LEU  23 -19.513  20.186  -4.686
  673   HD22  LEU  23          HD22      LEU  23 -17.802  20.236  -4.245
  674   HD23  LEU  23          HD23      LEU  23 -18.470  21.449  -5.339
  675    H    SER  24           H        SER  24 -18.787  18.119  -1.425
  676    HA   SER  24           HA       SER  24 -19.625  17.609   1.293
  677    HB2  SER  24           HB2      SER  24 -21.266  16.221  -0.034
  678    HB3  SER  24           HB3      SER  24 -19.910  15.325  -0.714
  679    HG   SER  24           HG       SER  24 -21.187  14.900   1.576
  680    H    LEU  25           H        LEU  25 -18.239  15.696   2.209
  681    HA   LEU  25           HA       LEU  25 -15.472  16.259   1.569
  682    HB2  LEU  25           HB2      LEU  25 -16.739  14.477   3.678
  683    HB3  LEU  25           HB3      LEU  25 -15.002  14.597   3.457
  684    HG   LEU  25           HG       LEU  25 -15.220  17.112   3.913
  685   HD11  LEU  25          HD11      LEU  25 -17.983  16.356   4.913
  686   HD12  LEU  25          HD12      LEU  25 -17.628  17.385   3.525
  687   HD13  LEU  25          HD13      LEU  25 -17.181  17.913   5.144
  688   HD21  LEU  25          HD21      LEU  25 -15.268  16.828   6.351
  689   HD22  LEU  25          HD22      LEU  25 -14.327  15.557   5.574
  690   HD23  LEU  25          HD23      LEU  25 -15.957  15.212   6.158
  691    H    LEU  26           H        LEU  26 -14.215  15.153   0.234
  692    HA   LEU  26           HA       LEU  26 -14.463  12.290  -0.223
  693    HB2  LEU  26           HB2      LEU  26 -16.006  13.703  -1.914
  694    HB3  LEU  26           HB3      LEU  26 -14.489  13.957  -2.751
  695    HG   LEU  26           HG       LEU  26 -15.744  11.235  -2.188
  696   HD11  LEU  26          HD11      LEU  26 -17.051  12.517  -3.805
  697   HD12  LEU  26          HD12      LEU  26 -16.256  11.152  -4.584
  698   HD13  LEU  26          HD13      LEU  26 -15.608  12.781  -4.790
  699   HD21  LEU  26          HD21      LEU  26 -13.296  11.038  -2.325
  700   HD22  LEU  26          HD22      LEU  26 -13.292  11.893  -3.867
  701   HD23  LEU  26          HD23      LEU  26 -14.054  10.306  -3.738
  702    H    ASP  27           H        ASP  27 -12.396  11.780   0.225
  703    HA   ASP  27           HA       ASP  27 -10.192  13.215  -1.173
  704    HB2  ASP  27           HB2      ASP  27 -10.101  11.762   1.514
  705    HB3  ASP  27           HB3      ASP  27  -8.714  12.493   0.711
  706    H    ASP  28           H        ASP  28  -9.967  11.959  -2.962
  707    HA   ASP  28           HA       ASP  28 -10.432   9.267  -3.360
  708    HB2  ASP  28           HB2      ASP  28  -8.253  10.924  -4.701
  709    HB3  ASP  28           HB3      ASP  28  -8.981   9.457  -5.352
  710    H    MET  29           H        MET  29  -7.469  10.749  -2.097
  711    HA   MET  29           HA       MET  29  -5.820   8.438  -2.035
  712    HB2  MET  29           HB2      MET  29  -5.691  10.853  -0.179
  713    HB3  MET  29           HB3      MET  29  -4.402   9.690  -0.466
  714    HG2  MET  29           HG2      MET  29  -4.637  10.460  -2.968
  715    HG3  MET  29           HG3      MET  29  -5.420  11.868  -2.260
  716    HE1  MET  29           HE1      MET  29  -2.166   9.755  -2.564
  717    HE2  MET  29           HE2      MET  29  -2.426   9.698  -0.818
  718    HE3  MET  29           HE3      MET  29  -1.058  10.602  -1.478
  719    H    ASN  30           H        ASN  30  -7.975   9.889   0.420
  720    HA   ASN  30           HA       ASN  30  -7.439   8.059   2.529
  721    HB2  ASN  30           HB2      ASN  30  -8.410  10.284   2.934
  722    HB3  ASN  30           HB3      ASN  30  -9.861   9.840   2.046
  723   HD21  ASN  30          HD21      ASN  30  -8.032   9.277   4.987
  724   HD22  ASN  30          HD22      ASN  30  -9.348   8.625   5.898
  725    H    HIS  31           H        HIS  31  -9.818   8.034  -0.104
  726    HA   HIS  31           HA       HIS  31 -11.303   5.745   0.667
  727    HB2  HIS  31           HB2      HIS  31 -10.805   7.012  -2.055
  728    HB3  HIS  31           HB3      HIS  31 -11.884   5.635  -1.832
  729    HD2  HIS  31           HD2      HIS  31 -14.339   6.727  -2.105
  730    HE1  HIS  31           HE1      HIS  31 -13.769  10.011   0.498
  731    HE2  HIS  31           HE2      HIS  31 -15.470   8.631  -0.762
  732    H    CYS  32           H        CYS  32  -8.302   6.083  -1.231
  733    HA   CYS  32           HA       CYS  32  -7.939   3.295  -1.782
  734    HB2  CYS  32           HB2      CYS  32  -5.873   5.527  -1.621
  735    HB3  CYS  32           HB3      CYS  32  -5.597   3.927  -2.313
  736    HG   CYS  32           HG       CYS  32  -8.102   5.823  -3.590
  737    H    TYR  33           H        TYR  33  -6.765   5.440   0.811
  738    HA   TYR  33           HA       TYR  33  -5.261   3.616   2.325
  739    HB2  TYR  33           HB2      TYR  33  -6.671   6.205   3.035
  740    HB3  TYR  33           HB3      TYR  33  -5.888   5.255   4.295
  741    HD1  TYR  33           HD1      TYR  33  -3.403   4.377   3.308
  742    HD2  TYR  33           HD2      TYR  33  -5.326   8.088   2.438
  743    HE1  TYR  33           HE1      TYR  33  -1.232   5.404   2.896
  744    HE2  TYR  33           HE2      TYR  33  -3.142   9.124   2.006
  745    HH   TYR  33           HH       TYR  33  -0.334   7.395   1.545
  746    H    SER  34           H        SER  34  -8.735   4.202   2.220
  747    HA   SER  34           HA       SER  34  -9.587   2.789   4.479
  748    HB2  SER  34           HB2      SER  34 -10.993   3.009   1.778
  749    HB3  SER  34           HB3      SER  34 -11.760   2.490   3.286
  750    HG   SER  34           HG       SER  34 -11.891   4.825   2.561
  751    H    ARG  35           H        ARG  35  -9.020   1.600   1.151
  752    HA   ARG  35           HA       ARG  35  -9.589  -1.151   1.803
  753    HB2  ARG  35           HB2      ARG  35  -8.373   0.112  -0.679
  754    HB3  ARG  35           HB3      ARG  35  -8.796  -1.595  -0.546
  755    HG2  ARG  35           HG2      ARG  35 -10.748   0.705  -0.252
  756    HG3  ARG  35           HG3      ARG  35 -10.542  -0.270  -1.707
  757    HD2  ARG  35           HD2      ARG  35 -11.326  -2.255  -0.551
  758    HD3  ARG  35           HD3      ARG  35 -11.369  -1.397   0.991
  759    HE   ARG  35           HE       ARG  35 -13.052  -0.122  -0.906
  760   HH11  ARG  35          HH11      ARG  35 -12.967  -2.965   1.085
  761   HH12  ARG  35          HH12      ARG  35 -14.688  -3.038   1.226
  762   HH21  ARG  35          HH21      ARG  35 -15.249  -0.244  -0.699
  763   HH22  ARG  35          HH22      ARG  35 -15.957  -1.513   0.239
  764    H    LEU  36           H        LEU  36  -6.613   0.757   1.628
  765    HA   LEU  36           HA       LEU  36  -4.822  -1.424   2.096
  766    HB2  LEU  36           HB2      LEU  36  -4.497   1.471   2.921
  767    HB3  LEU  36           HB3      LEU  36  -3.224   0.274   2.877
  768    HG   LEU  36           HG       LEU  36  -4.690   1.394   0.462
  769   HD11  LEU  36          HD11      LEU  36  -1.817   1.765   1.348
  770   HD12  LEU  36          HD12      LEU  36  -3.097   2.976   1.442
  771   HD13  LEU  36          HD13      LEU  36  -2.541   2.405  -0.131
  772   HD21  LEU  36          HD21      LEU  36  -2.459  -0.671   0.533
  773   HD22  LEU  36          HD22      LEU  36  -3.108   0.091  -0.921
  774   HD23  LEU  36          HD23      LEU  36  -4.134  -0.960   0.051
  775    H    ARG  37           H        ARG  37  -7.021   0.332   4.143
  776    HA   ARG  37           HA       ARG  37  -6.002  -0.847   6.609
  777    HB2  ARG  37           HB2      ARG  37  -7.759   1.389   5.907
  778    HB3  ARG  37           HB3      ARG  37  -8.560   0.373   7.086
  779    HG2  ARG  37           HG2      ARG  37  -5.727   1.167   7.675
  780    HG3  ARG  37           HG3      ARG  37  -6.952   2.429   7.774
  781    HD2  ARG  37           HD2      ARG  37  -6.459   1.276   9.957
  782    HD3  ARG  37           HD3      ARG  37  -8.159   1.236   9.478
  783    HE   ARG  37           HE       ARG  37  -6.755  -1.107   8.618
  784   HH11  ARG  37          HH11      ARG  37  -8.157   0.256  11.474
  785   HH12  ARG  37          HH12      ARG  37  -8.617  -1.289  12.087
  786   HH21  ARG  37          HH21      ARG  37  -7.403  -3.040   9.401
  787   HH22  ARG  37          HH22      ARG  37  -8.191  -3.131  10.934
  788    H    GLU  38           H        GLU  38  -8.229  -1.759   4.116
  789    HA   GLU  38           HA       GLU  38  -9.792  -3.588   5.806
  790    HB2  GLU  38           HB2      GLU  38  -9.867  -3.102   2.799
  791    HB3  GLU  38           HB3      GLU  38 -10.946  -4.200   3.646
  792    HG2  GLU  38           HG2      GLU  38 -10.805  -1.200   4.050
  793    HG3  GLU  38           HG3      GLU  38 -12.021  -2.050   3.110
  794    H    LEU  39           H        LEU  39  -7.223  -3.756   3.374
  795    HA   LEU  39           HA       LEU  39  -7.328  -6.663   3.151
  796    HB2  LEU  39           HB2      LEU  39  -5.544  -4.621   1.786
  797    HB3  LEU  39           HB3      LEU  39  -5.548  -6.339   1.422
  798    HG   LEU  39           HG       LEU  39  -7.930  -4.477   1.011
  799   HD11  LEU  39          HD11      LEU  39  -6.041  -5.617  -1.067
  800   HD12  LEU  39          HD12      LEU  39  -6.128  -3.930  -0.555
  801   HD13  LEU  39          HD13      LEU  39  -7.495  -4.667  -1.391
  802   HD21  LEU  39          HD21      LEU  39  -7.572  -7.385   0.185
  803   HD22  LEU  39          HD22      LEU  39  -8.945  -6.355  -0.223
  804   HD23  LEU  39          HD23      LEU  39  -8.645  -6.789   1.457
  805    H    VAL  40           H        VAL  40  -5.772  -4.561   5.281
  806    HA   VAL  40           HA       VAL  40  -3.507  -6.430   5.742
  807    HB   VAL  40           HB       VAL  40  -3.749  -3.562   6.774
  808   HG11  VAL  40          HG11      VAL  40  -2.280  -4.978   8.160
  809   HG12  VAL  40          HG12      VAL  40  -1.332  -3.775   7.286
  810   HG13  VAL  40          HG13      VAL  40  -1.358  -5.452   6.733
  811   HG21  VAL  40          HG21      VAL  40  -2.239  -4.597   4.345
  812   HG22  VAL  40          HG22      VAL  40  -2.072  -2.974   5.026
  813   HG23  VAL  40          HG23      VAL  40  -3.622  -3.485   4.351
  814    HA   PRO  41           HA       PRO  41  -5.950  -7.290   9.580
  815    HB2  PRO  41           HB2      PRO  41  -5.256  -9.883   9.886
  816    HB3  PRO  41           HB3      PRO  41  -6.429  -9.393   8.655
  817    HG2  PRO  41           HG2      PRO  41  -3.487  -9.982   8.330
  818    HG3  PRO  41           HG3      PRO  41  -4.851 -10.540   7.336
  819    HD2  PRO  41           HD2      PRO  41  -3.268  -8.391   6.660
  820    HD3  PRO  41           HD3      PRO  41  -4.961  -8.546   6.151
  821    H    GLY  42           H        GLY  42  -2.630  -7.008   8.922
  822    HA2  GLY  42           HA2      GLY  42  -1.564  -7.758  11.523
  823    HA3  GLY  42           HA3      GLY  42  -0.689  -7.019  10.196
  824    H    VAL  43           H        VAL  43  -3.483  -6.027  12.151
  825    HA   VAL  43           HA       VAL  43  -2.312  -3.353  12.635
  826    HB   VAL  43           HB       VAL  43  -5.212  -4.317  12.853
  827   HG11  VAL  43          HG11      VAL  43  -4.802  -2.422  14.361
  828   HG12  VAL  43          HG12      VAL  43  -5.845  -1.941  13.023
  829   HG13  VAL  43          HG13      VAL  43  -4.141  -1.475  13.025
  830   HG21  VAL  43          HG21      VAL  43  -4.452  -4.322  10.514
  831   HG22  VAL  43          HG22      VAL  43  -3.909  -2.647  10.662
  832   HG23  VAL  43          HG23      VAL  43  -5.626  -3.034  10.782
  833    HA   PRO  44           HA       PRO  44  -1.688  -4.644  16.943
  834    HB2  PRO  44           HB2      PRO  44  -1.715  -1.752  17.674
  835    HB3  PRO  44           HB3      PRO  44  -0.421  -2.940  17.859
  836    HG2  PRO  44           HG2      PRO  44  -0.261  -1.001  16.004
  837    HG3  PRO  44           HG3      PRO  44   0.351  -2.636  15.666
  838    HD2  PRO  44           HD2      PRO  44  -2.278  -1.387  14.831
  839    HD3  PRO  44           HD3      PRO  44  -1.132  -2.344  13.862
  840    H    ARG  45           H        ARG  45  -2.689  -4.486  19.105
  841    HA   ARG  45           HA       ARG  45  -5.543  -4.170  19.118
  842    HB2  ARG  45           HB2      ARG  45  -3.544  -4.618  21.372
  843    HB3  ARG  45           HB3      ARG  45  -5.285  -4.598  21.615
  844    HG2  ARG  45           HG2      ARG  45  -4.011  -6.524  19.652
  845    HG3  ARG  45           HG3      ARG  45  -4.091  -6.893  21.375
  846    HD2  ARG  45           HD2      ARG  45  -5.954  -7.938  20.193
  847    HD3  ARG  45           HD3      ARG  45  -6.546  -6.717  21.316
  848    HE   ARG  45           HE       ARG  45  -6.233  -5.800  18.586
  849   HH11  ARG  45          HH11      ARG  45  -8.437  -7.265  20.822
  850   HH12  ARG  45          HH12      ARG  45  -9.830  -6.781  19.917
  851   HH21  ARG  45          HH21      ARG  45  -8.023  -5.186  17.465
  852   HH22  ARG  45          HH22      ARG  45  -9.596  -5.623  18.035
  853    H    GLY  46           H        GLY  46  -6.243  -2.130  18.744
  854    HA2  GLY  46           HA2      GLY  46  -6.747   0.103  19.487
  855    HA3  GLY  46           HA3      GLY  46  -5.191   0.165  20.302
  856    H    THR  47           H        THR  47  -5.227   2.271  19.048
  857    HA   THR  47           HA       THR  47  -4.297   3.660  17.539
  858    HB   THR  47           HB       THR  47  -2.886   1.214  16.375
  859    HG1  THR  47           HG1      THR  47  -1.153   2.408  17.787
  860   HG21  THR  47          HG21      THR  47  -1.191   2.824  15.564
  861   HG22  THR  47          HG22      THR  47  -2.162   4.166  16.174
  862   HG23  THR  47          HG23      THR  47  -2.769   3.166  14.853
  863    H    GLN  48           H        GLN  48  -5.699   4.584  16.162
  864    HA   GLN  48           HA       GLN  48  -7.395   3.227  14.307
  865    HB2  GLN  48           HB2      GLN  48  -7.971   5.364  15.437
  866    HB3  GLN  48           HB3      GLN  48  -6.708   6.192  14.542
  867    HG2  GLN  48           HG2      GLN  48  -7.937   5.768  12.432
  868    HG3  GLN  48           HG3      GLN  48  -9.196   4.932  13.340
  869   HE21  GLN  48          HE21      GLN  48 -10.764   6.414  12.595
  870   HE22  GLN  48          HE22      GLN  48 -10.862   8.024  13.205
  871    H    LEU  49           H        LEU  49  -4.158   4.158  14.088
  872    HA   LEU  49           HA       LEU  49  -2.528   3.996  12.573
  873    HB2  LEU  49           HB2      LEU  49  -4.641   2.969  10.655
  874    HB3  LEU  49           HB3      LEU  49  -2.929   3.048  10.281
  875    HG   LEU  49           HG       LEU  49  -4.198   1.314  12.436
  876   HD11  LEU  49          HD11      LEU  49  -4.639   0.480  10.169
  877   HD12  LEU  49          HD12      LEU  49  -3.538  -0.586  11.038
  878   HD13  LEU  49          HD13      LEU  49  -2.911   0.515   9.809
  879   HD21  LEU  49          HD21      LEU  49  -1.923   0.336  12.690
  880   HD22  LEU  49          HD22      LEU  49  -2.006   2.025  13.189
  881   HD23  LEU  49          HD23      LEU  49  -1.283   1.603  11.634
  882    H    SER  50           H        SER  50  -1.729   5.926  12.207
  883    HA   SER  50           HA       SER  50  -3.037   8.107  10.888
  884    HB2  SER  50           HB2      SER  50  -1.298   8.515  12.580
  885    HB3  SER  50           HB3      SER  50  -0.097   7.675  11.598
  886    HG   SER  50           HG       SER  50  -0.991  10.258  11.435
  887    H    GLN  51           H        GLN  51  -2.110   9.198   8.918
  888    HA   GLN  51           HA       GLN  51  -2.532   7.644   6.681
  889    HB2  GLN  51           HB2      GLN  51  -1.661   9.599   5.355
  890    HB3  GLN  51           HB3      GLN  51  -2.849  10.026   6.578
  891    HG2  GLN  51           HG2      GLN  51  -1.048  10.818   8.069
  892    HG3  GLN  51           HG3      GLN  51   0.151  10.368   6.861
  893   HE21  GLN  51          HE21      GLN  51   0.929  12.484   6.732
  894   HE22  GLN  51          HE22      GLN  51   0.039  13.753   5.975
  895    H    VAL  52           H        VAL  52   0.697   8.686   7.874
  896    HA   VAL  52           HA       VAL  52   2.150   7.329   5.787
  897    HB   VAL  52           HB       VAL  52   3.379   8.270   8.412
  898   HG11  VAL  52          HG11      VAL  52   4.513   8.044   5.600
  899   HG12  VAL  52          HG12      VAL  52   4.847   6.964   6.954
  900   HG13  VAL  52          HG13      VAL  52   5.386   8.641   7.014
  901   HG21  VAL  52          HG21      VAL  52   2.030  10.146   7.609
  902   HG22  VAL  52          HG22      VAL  52   2.739  10.012   6.001
  903   HG23  VAL  52          HG23      VAL  52   3.744  10.501   7.367
  904    H    GLU  53           H        GLU  53   1.254   6.587   9.133
  905    HA   GLU  53           HA       GLU  53   2.792   4.264   9.564
  906    HB2  GLU  53           HB2      GLU  53   1.007   5.729  11.111
  907    HB3  GLU  53           HB3      GLU  53   0.088   4.270  10.856
  908    HG2  GLU  53           HG2      GLU  53   2.931   4.098  11.857
  909    HG3  GLU  53           HG3      GLU  53   1.636   4.521  12.963
  910    H    ILE  54           H        ILE  54  -0.414   4.679   8.066
  911    HA   ILE  54           HA       ILE  54  -1.079   2.010   7.566
  912    HB   ILE  54           HB       ILE  54  -1.716   4.504   5.924
  913   HG12  ILE  54          HG12      ILE  54  -3.439   2.962   7.927
  914   HG13  ILE  54          HG13      ILE  54  -2.631   4.489   8.253
  915   HG21  ILE  54          HG21      ILE  54  -2.920   1.721   5.626
  916   HG22  ILE  54          HG22      ILE  54  -1.954   2.593   4.430
  917   HG23  ILE  54          HG23      ILE  54  -3.556   3.183   4.863
  918   HD11  ILE  54          HD11      ILE  54  -4.851   4.049   6.255
  919   HD12  ILE  54          HD12      ILE  54  -4.038   5.585   6.568
  920   HD13  ILE  54          HD13      ILE  54  -4.990   4.817   7.837
  921    H    LEU  55           H        LEU  55   0.753   4.316   5.497
  922    HA   LEU  55           HA       LEU  55   1.368   2.688   3.322
  923    HB2  LEU  55           HB2      LEU  55   3.088   4.828   4.630
  924    HB3  LEU  55           HB3      LEU  55   3.413   4.141   3.048
  925    HG   LEU  55           HG       LEU  55   0.928   5.747   3.758
  926   HD11  LEU  55          HD11      LEU  55   2.935   7.168   3.777
  927   HD12  LEU  55          HD12      LEU  55   1.907   7.548   2.398
  928   HD13  LEU  55          HD13      LEU  55   3.373   6.592   2.166
  929   HD21  LEU  55          HD21      LEU  55   0.504   5.751   1.332
  930   HD22  LEU  55          HD22      LEU  55   0.497   4.115   1.982
  931   HD23  LEU  55          HD23      LEU  55   1.899   4.697   1.081
  932    H    GLN  56           H        GLN  56   3.256   3.122   6.312
  933    HA   GLN  56           HA       GLN  56   5.419   1.401   5.652
  934    HB2  GLN  56           HB2      GLN  56   4.457   2.455   8.341
  935    HB3  GLN  56           HB3      GLN  56   5.994   1.629   8.099
  936    HG2  GLN  56           HG2      GLN  56   6.756   3.422   6.607
  937    HG3  GLN  56           HG3      GLN  56   5.194   4.228   6.749
  938   HE21  GLN  56          HE21      GLN  56   6.281   6.103   7.491
  939   HE22  GLN  56          HE22      GLN  56   6.871   6.219   9.106
  940    H    ARG  57           H        ARG  57   2.377   0.854   7.347
  941    HA   ARG  57           HA       ARG  57   2.974  -1.793   8.295
  942    HB2  ARG  57           HB2      ARG  57   1.353  -0.228   9.370
  943    HB3  ARG  57           HB3      ARG  57   0.278  -0.411   7.990
  944    HG2  ARG  57           HG2      ARG  57  -0.258  -2.655   8.560
  945    HG3  ARG  57           HG3      ARG  57   1.139  -2.806   9.627
  946    HD2  ARG  57           HD2      ARG  57  -1.308  -1.081  10.140
  947    HD3  ARG  57           HD3      ARG  57  -0.927  -2.607  10.949
  948    HE   ARG  57           HE       ARG  57   0.322   0.002  11.397
  949   HH11  ARG  57          HH11      ARG  57   0.486  -3.406  12.062
  950   HH12  ARG  57          HH12      ARG  57   1.566  -3.187  13.392
  951   HH21  ARG  57          HH21      ARG  57   1.693   0.238  13.080
  952   HH22  ARG  57          HH22      ARG  57   2.253  -1.151  13.953
  953    H    VAL  58           H        VAL  58   1.346  -0.495   5.422
  954    HA   VAL  58           HA       VAL  58   0.550  -2.977   4.277
  955    HB   VAL  58           HB       VAL  58   1.147  -0.287   2.954
  956   HG11  VAL  58          HG11      VAL  58  -0.188  -2.723   1.708
  957   HG12  VAL  58          HG12      VAL  58   1.379  -2.046   1.259
  958   HG13  VAL  58          HG13      VAL  58  -0.092  -1.118   0.972
  959   HG21  VAL  58          HG21      VAL  58  -0.768  -0.260   4.523
  960   HG22  VAL  58          HG22      VAL  58  -1.518  -1.593   3.645
  961   HG23  VAL  58          HG23      VAL  58  -1.303  -0.028   2.859
  962    H    ILE  59           H        ILE  59   3.552  -1.033   4.004
  963    HA   ILE  59           HA       ILE  59   4.984  -2.636   2.207
  964    HB   ILE  59           HB       ILE  59   6.074  -1.039   4.572
  965   HG12  ILE  59          HG12      ILE  59   5.945  -0.260   1.615
  966   HG13  ILE  59          HG13      ILE  59   4.809   0.293   2.835
  967   HG21  ILE  59          HG21      ILE  59   8.271  -1.076   3.406
  968   HG22  ILE  59          HG22      ILE  59   7.601  -2.153   2.178
  969   HG23  ILE  59          HG23      ILE  59   7.747  -2.701   3.849
  970   HD11  ILE  59          HD11      ILE  59   6.467   1.979   2.327
  971   HD12  ILE  59          HD12      ILE  59   7.765   0.881   2.791
  972   HD13  ILE  59          HD13      ILE  59   6.611   1.451   4.002
  973    H    ASP  60           H        ASP  60   4.928  -2.780   5.766
  974    HA   ASP  60           HA       ASP  60   6.520  -5.011   6.218
  975    HB2  ASP  60           HB2      ASP  60   5.818  -3.487   7.991
  976    HB3  ASP  60           HB3      ASP  60   4.134  -3.941   7.769
  977    H    TYR  61           H        TYR  61   3.000  -4.895   5.624
  978    HA   TYR  61           HA       TYR  61   2.370  -7.616   5.974
  979    HB2  TYR  61           HB2      TYR  61   0.623  -5.915   5.922
  980    HB3  TYR  61           HB3      TYR  61   1.032  -5.473   4.269
  981    HD1  TYR  61           HD1      TYR  61  -0.244  -8.337   6.326
  982    HD2  TYR  61           HD2      TYR  61  -0.124  -6.533   2.445
  983    HE1  TYR  61           HE1      TYR  61  -1.878  -9.979   5.509
  984    HE2  TYR  61           HE2      TYR  61  -1.776  -8.170   1.640
  985    HH   TYR  61           HH       TYR  61  -2.538 -10.475   2.244
  986    H    ILE  62           H        ILE  62   3.235  -5.836   2.998
  987    HA   ILE  62           HA       ILE  62   2.958  -8.114   1.269
  988    HB   ILE  62           HB       ILE  62   4.279  -5.414   0.735
  989   HG12  ILE  62          HG12      ILE  62   1.459  -6.413   0.054
  990   HG13  ILE  62          HG13      ILE  62   1.849  -5.242   1.307
  991   HG21  ILE  62          HG21      ILE  62   3.429  -7.570  -1.238
  992   HG22  ILE  62          HG22      ILE  62   5.086  -7.083  -0.875
  993   HG23  ILE  62          HG23      ILE  62   3.994  -5.957  -1.675
  994   HD11  ILE  62          HD11      ILE  62   2.221  -4.850  -1.665
  995   HD12  ILE  62          HD12      ILE  62   2.635  -3.674  -0.412
  996   HD13  ILE  62          HD13      ILE  62   0.955  -4.149  -0.656
  997    H    LEU  63           H        LEU  63   5.664  -6.748   3.096
  998    HA   LEU  63           HA       LEU  63   7.811  -8.168   1.942
  999    HB2  LEU  63           HB2      LEU  63   7.341  -7.212   4.784
 1000    HB3  LEU  63           HB3      LEU  63   8.845  -7.962   4.282
 1001    HG   LEU  63           HG       LEU  63   7.730  -5.358   3.169
 1002   HD11  LEU  63          HD11      LEU  63  10.066  -5.820   5.046
 1003   HD12  LEU  63          HD12      LEU  63   8.510  -5.104   5.477
 1004   HD13  LEU  63          HD13      LEU  63   9.581  -4.266   4.357
 1005   HD21  LEU  63          HD21      LEU  63  10.374  -6.734   2.576
 1006   HD22  LEU  63          HD22      LEU  63   9.903  -5.126   2.020
 1007   HD23  LEU  63          HD23      LEU  63   9.021  -6.542   1.456
 1008    H    ASP  64           H        ASP  64   5.400  -9.157   4.352
 1009    HA   ASP  64           HA       ASP  64   6.435 -11.731   4.968
 1010    HB2  ASP  64           HB2      ASP  64   4.715 -10.589   6.331
 1011    HB3  ASP  64           HB3      ASP  64   3.564 -10.707   5.008
 1012    H    LEU  65           H        LEU  65   4.426 -10.558   2.305
 1013    HA   LEU  65           HA       LEU  65   3.803 -13.154   1.186
 1014    HB2  LEU  65           HB2      LEU  65   3.575 -10.392  -0.070
 1015    HB3  LEU  65           HB3      LEU  65   2.841 -11.865  -0.689
 1016    HG   LEU  65           HG       LEU  65   2.113 -10.459   1.912
 1017   HD11  LEU  65          HD11      LEU  65   1.283  -9.266  -0.052
 1018   HD12  LEU  65          HD12      LEU  65  -0.050 -10.010   0.827
 1019   HD13  LEU  65          HD13      LEU  65   0.540 -10.748  -0.664
 1020   HD21  LEU  65          HD21      LEU  65   0.305 -12.127   2.125
 1021   HD22  LEU  65          HD22      LEU  65   1.896 -12.878   2.205
 1022   HD23  LEU  65          HD23      LEU  65   0.939 -12.999   0.725
 1023    H    GLN  66           H        GLN  66   6.325 -10.777   0.770
 1024    HA   GLN  66           HA       GLN  66   7.507 -12.210  -1.549
 1025    HB2  GLN  66           HB2      GLN  66   7.975  -9.354  -0.583
 1026    HB3  GLN  66           HB3      GLN  66   8.724 -10.092  -1.997
 1027    HG2  GLN  66           HG2      GLN  66   6.426 -10.384  -2.980
 1028    HG3  GLN  66           HG3      GLN  66   5.777  -9.473  -1.618
 1029   HE21  GLN  66          HE21      GLN  66   5.623  -8.838  -4.422
 1030   HE22  GLN  66          HE22      GLN  66   6.370  -7.298  -4.628
 1031    H    VAL  67           H        VAL  67  10.153 -11.099  -1.279
 1032    HA   VAL  67           HA       VAL  67  11.204 -12.901   0.787
 1033    HB   VAL  67           HB       VAL  67  12.622 -11.473  -1.506
 1034   HG11  VAL  67          HG11      VAL  67  14.208 -11.945   0.303
 1035   HG12  VAL  67          HG12      VAL  67  14.534 -12.988  -1.080
 1036   HG13  VAL  67          HG13      VAL  67  13.703 -13.636   0.337
 1037   HG21  VAL  67          HG21      VAL  67  11.751 -14.382  -1.286
 1038   HG22  VAL  67          HG22      VAL  67  12.664 -13.678  -2.624
 1039   HG23  VAL  67          HG23      VAL  67  11.010 -13.153  -2.312
 1040    H    VAL  68           H        VAL  68  11.720 -12.075   2.750
 1041    HA   VAL  68           HA       VAL  68  12.971  -9.396   3.001
 1042    HB   VAL  68           HB       VAL  68  12.109 -11.318   5.225
 1043   HG11  VAL  68          HG11      VAL  68  12.400  -9.382   6.750
 1044   HG12  VAL  68          HG12      VAL  68  13.023  -8.419   5.407
 1045   HG13  VAL  68          HG13      VAL  68  13.915  -9.833   5.966
 1046   HG21  VAL  68          HG21      VAL  68  10.689  -8.830   4.196
 1047   HG22  VAL  68          HG22      VAL  68  10.209  -9.778   5.605
 1048   HG23  VAL  68          HG23      VAL  68  10.149 -10.499   3.999
  Start of MODEL   19
    1    H1   MET   1           H1       MET   1 -50.589 -11.604 -11.186
    2    H2   MET   1           H2       MET   1 -50.056 -10.486 -10.039
    3    H3   MET   1           H3       MET   1 -50.423 -12.059  -9.566
    4    HA   MET   1           HA       MET   1 -48.046 -11.727  -9.659
    5    HB2  MET   1           HB2      MET   1 -49.186 -13.569 -11.807
    6    HB3  MET   1           HB3      MET   1 -47.512 -13.628 -11.271
    7    HG2  MET   1           HG2      MET   1 -48.797 -15.379 -10.193
    8    HG3  MET   1           HG3      MET   1 -48.273 -14.198  -8.989
    9    HE1  MET   1           HE1      MET   1 -51.756 -15.381  -7.579
   10    HE2  MET   1           HE2      MET   1 -50.039 -15.200  -7.232
   11    HE3  MET   1           HE3      MET   1 -50.575 -16.381  -8.429
   12    H    GLY   2           H        GLY   2 -46.168 -11.913 -11.423
   13    HA2  GLY   2           HA2      GLY   2 -45.105 -11.031 -13.335
   14    HA3  GLY   2           HA3      GLY   2 -46.509 -10.030 -13.664
   15    H    HIS   3           H        HIS   3 -44.583 -10.343 -10.679
   16    HA   HIS   3           HA       HIS   3 -44.223  -7.415 -10.557
   17    HB2  HIS   3           HB2      HIS   3 -43.839  -9.564  -8.427
   18    HB3  HIS   3           HB3      HIS   3 -43.635  -7.835  -8.163
   19    HD2  HIS   3           HD2      HIS   3 -45.955  -6.406  -7.748
   20    HE1  HIS   3           HE1      HIS   3 -48.578  -9.685  -8.190
   21    HE2  HIS   3           HE2      HIS   3 -48.313  -7.351  -7.292
   22    H    HIS   4           H        HIS   4 -42.527  -7.399 -12.195
   23    HA   HIS   4           HA       HIS   4 -39.850  -8.138 -11.129
   24    HB2  HIS   4           HB2      HIS   4 -40.539  -8.869 -13.525
   25    HB3  HIS   4           HB3      HIS   4 -40.425  -7.173 -13.969
   26    HD2  HIS   4           HD2      HIS   4 -37.721  -6.100 -13.758
   27    HE1  HIS   4           HE1      HIS   4 -35.983  -9.948 -13.913
   28    HE2  HIS   4           HE2      HIS   4 -35.532  -7.464 -13.957
   29    H    HIS   5           H        HIS   5 -40.601  -6.336  -9.605
   30    HA   HIS   5           HA       HIS   5 -40.509  -3.597 -10.551
   31    HB2  HIS   5           HB2      HIS   5 -40.847  -3.015  -8.155
   32    HB3  HIS   5           HB3      HIS   5 -42.012  -4.211  -8.707
   33    HD2  HIS   5           HD2      HIS   5 -39.313  -3.777  -6.001
   34    HE1  HIS   5           HE1      HIS   5 -40.726  -7.760  -5.811
   35    HE2  HIS   5           HE2      HIS   5 -39.179  -6.048  -4.771
   36    H    HIS   6           H        HIS   6 -38.196  -5.857  -9.241
   37    HA   HIS   6           HA       HIS   6 -36.258  -3.896  -8.379
   38    HB2  HIS   6           HB2      HIS   6 -36.453  -6.179  -7.347
   39    HB3  HIS   6           HB3      HIS   6 -35.878  -6.887  -8.852
   40    HD2  HIS   6           HD2      HIS   6 -33.121  -6.693  -9.288
   41    HE1  HIS   6           HE1      HIS   6 -32.260  -4.857  -5.577
   42    HE2  HIS   6           HE2      HIS   6 -31.298  -6.097  -7.559
   43    H    HIS   7           H        HIS   7 -35.612  -2.583 -10.035
   44    HA   HIS   7           HA       HIS   7 -34.612  -3.643 -12.586
   45    HB2  HIS   7           HB2      HIS   7 -34.850  -0.781 -11.548
   46    HB3  HIS   7           HB3      HIS   7 -34.335  -1.226 -13.177
   47    HD2  HIS   7           HD2      HIS   7 -36.396  -2.281 -14.838
   48    HE1  HIS   7           HE1      HIS   7 -39.512  -1.034 -12.270
   49    HE2  HIS   7           HE2      HIS   7 -38.950  -2.086 -14.496
   50    H    HIS   8           H        HIS   8 -33.399  -1.821  -9.776
   51    HA   HIS   8           HA       HIS   8 -31.389  -1.441  -8.843
   52    HB2  HIS   8           HB2      HIS   8 -31.309  -3.927  -8.707
   53    HB3  HIS   8           HB3      HIS   8 -30.514  -3.982 -10.276
   54    HD2  HIS   8           HD2      HIS   8 -29.711  -2.994  -6.566
   55    HE1  HIS   8           HE1      HIS   8 -26.101  -3.214  -8.758
   56    HE2  HIS   8           HE2      HIS   8 -27.129  -3.134  -6.457
   57    H    SER   9           H        SER   9 -31.221   0.510 -10.094
   58    HA   SER   9           HA       SER   9 -28.751   0.823 -11.491
   59    HB2  SER   9           HB2      SER   9 -30.038  -0.141 -13.382
   60    HB3  SER   9           HB3      SER   9 -31.270   1.105 -13.194
   61    HG   SER   9           HG       SER   9 -30.007   2.515 -14.160
   62    H    HIS  10           H        HIS  10 -28.635   2.323  -9.689
   63    HA   HIS  10           HA       HIS  10 -29.145   5.006 -10.561
   64    HB2  HIS  10           HB2      HIS  10 -31.363   4.483  -9.489
   65    HB3  HIS  10           HB3      HIS  10 -30.536   4.152  -7.972
   66    HD1  HIS  10           HD1      HIS  10 -29.634   6.191  -6.635
   67    HD2  HIS  10           HD2      HIS  10 -31.590   7.240 -10.152
   68    HE1  HIS  10           HE1      HIS  10 -29.919   8.670  -6.533
   69    HE2  HIS  10           HE2      HIS  10 -30.976   9.300  -8.717
   70    H    MET  11           H        MET  11 -27.280   5.992 -10.098
   71    HA   MET  11           HA       MET  11 -26.185   5.857  -7.350
   72    HB2  MET  11           HB2      MET  11 -23.872   6.069  -8.281
   73    HB3  MET  11           HB3      MET  11 -24.650   4.557  -8.716
   74    HG2  MET  11           HG2      MET  11 -23.447   5.304 -10.629
   75    HG3  MET  11           HG3      MET  11 -25.155   5.554 -10.973
   76    HE1  MET  11           HE1      MET  11 -21.727   7.260 -10.060
   77    HE2  MET  11           HE2      MET  11 -22.736   7.827  -8.727
   78    HE3  MET  11           HE3      MET  11 -22.179   8.962  -9.955
   79    H    GLY  12           H        GLY  12 -24.600   7.807  -7.074
   80    HA2  GLY  12           HA2      GLY  12 -25.286  10.266  -8.438
   81    HA3  GLY  12           HA3      GLY  12 -25.979  10.133  -6.829
   82    H    GLY  13           H        GLY  13 -23.262   8.455  -6.392
   83    HA2  GLY  13           HA2      GLY  13 -21.803  10.535  -5.077
   84    HA3  GLY  13           HA3      GLY  13 -21.297   8.869  -5.286
   85    H    GLY  14           H        GLY  14 -21.146  12.106  -6.594
   86    HA2  GLY  14           HA2      GLY  14 -18.889  11.377  -8.366
   87    HA3  GLY  14           HA3      GLY  14 -20.278  12.183  -9.073
   88    H    LYS  15           H        LYS  15 -17.306  12.612  -7.512
   89    HA   LYS  15           HA       LYS  15 -15.957  14.396  -7.214
   90    HB2  LYS  15           HB2      LYS  15 -17.219  15.239  -9.338
   91    HB3  LYS  15           HB3      LYS  15 -18.112  16.283  -8.245
   92    HG2  LYS  15           HG2      LYS  15 -15.807  17.206  -7.511
   93    HG3  LYS  15           HG3      LYS  15 -15.150  16.348  -8.906
   94    HD2  LYS  15           HD2      LYS  15 -15.545  18.638  -9.569
   95    HD3  LYS  15           HD3      LYS  15 -16.752  17.633 -10.374
   96    HE2  LYS  15           HE2      LYS  15 -18.394  18.257  -8.591
   97    HE3  LYS  15           HE3      LYS  15 -17.181  19.334  -7.892
   98    HZ1  LYS  15           HZ1      LYS  15 -18.675  20.565  -9.277
   99    HZ2  LYS  15           HZ2      LYS  15 -18.388  19.542 -10.594
  100    HZ3  LYS  15           HZ3      LYS  15 -17.153  20.538 -10.009
  101    H    GLY  16           H        GLY  16 -15.762  16.563  -5.971
  102    HA2  GLY  16           HA2      GLY  16 -17.600  17.829  -4.424
  103    HA3  GLY  16           HA3      GLY  16 -17.134  16.452  -3.433
  104    HA   PRO  17           HA       PRO  17 -13.547  18.872  -2.198
  105    HB2  PRO  17           HB2      PRO  17 -12.052  17.042  -0.958
  106    HB3  PRO  17           HB3      PRO  17 -13.715  17.328  -0.407
  107    HG2  PRO  17           HG2      PRO  17 -12.687  15.157  -2.241
  108    HG3  PRO  17           HG3      PRO  17 -13.728  15.002  -0.811
  109    HD2  PRO  17           HD2      PRO  17 -14.688  15.115  -3.408
  110    HD3  PRO  17           HD3      PRO  17 -15.638  15.617  -1.990
  111    H    ALA  18           H        ALA  18 -11.162  18.955  -2.259
  112    HA   ALA  18           HA       ALA  18  -9.546  17.237  -3.865
  113    HB1  ALA  18           HB1      ALA  18 -10.513  18.603  -5.705
  114    HB2  ALA  18           HB2      ALA  18  -8.781  18.898  -5.540
  115    HB3  ALA  18           HB3      ALA  18  -9.942  20.072  -4.914
  116    H    ALA  19           H        ALA  19  -8.968  17.284  -1.480
  117    HA   ALA  19           HA       ALA  19  -8.030  19.626  -0.186
  118    HB1  ALA  19           HB1      ALA  19  -7.314  18.139   1.621
  119    HB2  ALA  19           HB2      ALA  19  -7.498  16.736   0.565
  120    HB3  ALA  19           HB3      ALA  19  -8.912  17.682   1.027
  121    H    GLU  20           H        GLU  20  -6.113  20.613  -0.146
  122    HA   GLU  20           HA       GLU  20  -3.830  19.509  -1.648
  123    HB2  GLU  20           HB2      GLU  20  -4.387  22.335  -0.657
  124    HB3  GLU  20           HB3      GLU  20  -3.002  21.858  -1.639
  125    HG2  GLU  20           HG2      GLU  20  -4.528  21.188  -3.470
  126    HG3  GLU  20           HG3      GLU  20  -5.911  21.661  -2.484
  127    H    GLU  21           H        GLU  21  -1.657  19.745  -0.813
  128    HA   GLU  21           HA       GLU  21  -1.448  18.790   1.892
  129    HB2  GLU  21           HB2      GLU  21   0.904  18.386   1.453
  130    HB3  GLU  21           HB3      GLU  21  -0.034  17.836   0.076
  131    HG2  GLU  21           HG2      GLU  21   1.510  20.450   0.171
  132    HG3  GLU  21           HG3      GLU  21   2.126  18.954  -0.523
  133    HA   PRO  22           HA       PRO  22  -0.220  22.834   3.642
  134    HB2  PRO  22           HB2      PRO  22  -0.420  22.204   6.255
  135    HB3  PRO  22           HB3      PRO  22  -1.855  22.395   5.242
  136    HG2  PRO  22           HG2      PRO  22  -0.569  19.886   6.252
  137    HG3  PRO  22           HG3      PRO  22  -2.287  20.239   5.978
  138    HD2  PRO  22           HD2      PRO  22  -0.544  18.830   4.221
  139    HD3  PRO  22           HD3      PRO  22  -2.175  19.420   3.833
  140    H    LEU  23           H        LEU  23   1.886  22.679   2.742
  141    HA   LEU  23           HA       LEU  23   4.135  22.836   2.776
  142    HB2  LEU  23           HB2      LEU  23   3.910  22.245   5.745
  143    HB3  LEU  23           HB3      LEU  23   5.399  22.725   4.952
  144    HG   LEU  23           HG       LEU  23   2.894  24.456   5.133
  145   HD11  LEU  23          HD11      LEU  23   3.907  24.194   7.342
  146   HD12  LEU  23          HD12      LEU  23   4.141  25.835   6.743
  147   HD13  LEU  23          HD13      LEU  23   5.478  24.684   6.701
  148   HD21  LEU  23          HD21      LEU  23   5.663  25.132   4.067
  149   HD22  LEU  23          HD22      LEU  23   4.332  26.274   4.267
  150   HD23  LEU  23          HD23      LEU  23   4.188  24.957   3.110
  151    H    SER  24           H        SER  24   6.074  21.588   2.659
  152    HA   SER  24           HA       SER  24   5.874  18.690   3.262
  153    HB2  SER  24           HB2      SER  24   7.228  19.977   0.851
  154    HB3  SER  24           HB3      SER  24   7.332  18.265   1.265
  155    HG   SER  24           HG       SER  24   4.952  18.306   1.161
  156    H    LEU  25           H        LEU  25   7.479  17.897   4.492
  157    HA   LEU  25           HA       LEU  25   9.483  19.827   5.534
  158    HB2  LEU  25           HB2      LEU  25   8.380  17.290   6.806
  159    HB3  LEU  25           HB3      LEU  25   9.398  18.489   7.591
  160    HG   LEU  25           HG       LEU  25   6.549  18.983   6.622
  161   HD11  LEU  25          HD11      LEU  25   5.906  19.033   8.987
  162   HD12  LEU  25          HD12      LEU  25   7.554  18.618   9.462
  163   HD13  LEU  25          HD13      LEU  25   6.577  17.464   8.550
  164   HD21  LEU  25          HD21      LEU  25   8.377  20.825   8.215
  165   HD22  LEU  25          HD22      LEU  25   6.687  21.136   7.819
  166   HD23  LEU  25          HD23      LEU  25   7.885  21.051   6.531
  167    H    LEU  26           H        LEU  26   9.107  16.366   4.860
  168    HA   LEU  26           HA       LEU  26  11.663  15.888   3.699
  169    HB2  LEU  26           HB2      LEU  26  12.305  16.172   6.147
  170    HB3  LEU  26           HB3      LEU  26  11.294  14.803   6.541
  171    HG   LEU  26           HG       LEU  26  13.645  14.510   4.634
  172   HD11  LEU  26          HD11      LEU  26  15.089  13.834   6.512
  173   HD12  LEU  26          HD12      LEU  26  13.814  14.263   7.657
  174   HD13  LEU  26          HD13      LEU  26  14.570  15.509   6.665
  175   HD21  LEU  26          HD21      LEU  26  12.105  12.599   4.686
  176   HD22  LEU  26          HD22      LEU  26  12.276  12.473   6.436
  177   HD23  LEU  26          HD23      LEU  26  13.659  12.149   5.383
  178    H    ASP  27           H        ASP  27   9.196  14.449   5.765
  179    HA   ASP  27           HA       ASP  27   7.487  13.083   5.460
  180    HB2  ASP  27           HB2      ASP  27   7.944  13.592   2.490
  181    HB3  ASP  27           HB3      ASP  27   6.515  12.814   3.166
  182    H    ASP  28           H        ASP  28   8.176  11.213   6.356
  183    HA   ASP  28           HA       ASP  28   9.797   9.238   5.142
  184    HB2  ASP  28           HB2      ASP  28   9.372   9.300   7.583
  185    HB3  ASP  28           HB3      ASP  28   7.674   8.912   7.314
  186    H    MET  29           H        MET  29   6.344   9.972   4.862
  187    HA   MET  29           HA       MET  29   5.497   7.578   3.604
  188    HB2  MET  29           HB2      MET  29   3.572   8.837   2.734
  189    HB3  MET  29           HB3      MET  29   3.827   9.098   4.447
  190    HG2  MET  29           HG2      MET  29   4.466  11.328   4.144
  191    HG3  MET  29           HG3      MET  29   4.871  11.082   2.443
  192    HE1  MET  29           HE1      MET  29   1.727  10.429   4.794
  193    HE2  MET  29           HE2      MET  29   1.571   9.306   3.442
  194    HE3  MET  29           HE3      MET  29   0.424  10.638   3.615
  195    H    ASN  30           H        ASN  30   7.156  10.407   2.337
  196    HA   ASN  30           HA       ASN  30   6.771   9.966  -0.445
  197    HB2  ASN  30           HB2      ASN  30   7.659  12.084   0.676
  198    HB3  ASN  30           HB3      ASN  30   9.198  11.264   0.887
  199   HD21  ASN  30          HD21      ASN  30   8.775  13.680  -0.533
  200   HD22  ASN  30          HD22      ASN  30   9.210  13.408  -2.179
  201    H    HIS  31           H        HIS  31   9.416   9.014   1.772
  202    HA   HIS  31           HA       HIS  31  10.917   7.400  -0.005
  203    HB2  HIS  31           HB2      HIS  31  10.687   7.177   3.030
  204    HB3  HIS  31           HB3      HIS  31  11.939   6.422   2.046
  205    HD2  HIS  31           HD2      HIS  31  10.991   9.917   3.489
  206    HE1  HIS  31           HE1      HIS  31  14.832  10.138   1.741
  207    HE2  HIS  31           HE2      HIS  31  13.021  11.425   2.943
  208    H    CYS  32           H        CYS  32   8.277   6.604   2.231
  209    HA   CYS  32           HA       CYS  32   8.168   3.810   1.852
  210    HB2  CYS  32           HB2      CYS  32   6.022   5.759   2.761
  211    HB3  CYS  32           HB3      CYS  32   5.792   4.011   2.733
  212    HG   CYS  32           HG       CYS  32   7.282   5.894   5.019
  213    H    TYR  33           H        TYR  33   6.646   6.452   0.065
  214    HA   TYR  33           HA       TYR  33   4.847   4.941  -1.523
  215    HB2  TYR  33           HB2      TYR  33   5.896   7.742  -1.560
  216    HB3  TYR  33           HB3      TYR  33   5.304   7.158  -3.106
  217    HD1  TYR  33           HD1      TYR  33   2.957   5.724  -2.715
  218    HD2  TYR  33           HD2      TYR  33   4.256   9.074  -0.407
  219    HE1  TYR  33           HE1      TYR  33   0.635   6.244  -2.184
  220    HE2  TYR  33           HE2      TYR  33   1.922   9.595   0.139
  221    HH   TYR  33           HH       TYR  33  -0.291   9.195  -0.677
  222    H    SER  34           H        SER  34   8.140   6.108  -2.157
  223    HA   SER  34           HA       SER  34   8.526   4.914  -4.694
  224    HB2  SER  34           HB2      SER  34  10.565   5.602  -2.530
  225    HB3  SER  34           HB3      SER  34  10.960   5.218  -4.212
  226    HG   SER  34           HG       SER  34  10.521   7.564  -3.352
  227    H    ARG  35           H        ARG  35   9.069   3.735  -1.396
  228    HA   ARG  35           HA       ARG  35  10.356   1.280  -2.033
  229    HB2  ARG  35           HB2      ARG  35  10.066   2.763   0.232
  230    HB3  ARG  35           HB3      ARG  35   8.824   1.567   0.553
  231    HG2  ARG  35           HG2      ARG  35  11.692   0.860  -0.092
  232    HG3  ARG  35           HG3      ARG  35  11.119   1.146   1.550
  233    HD2  ARG  35           HD2      ARG  35   9.382  -0.724   1.023
  234    HD3  ARG  35           HD3      ARG  35  10.460  -1.133  -0.321
  235    HE   ARG  35           HE       ARG  35  11.483  -0.963   2.444
  236   HH11  ARG  35          HH11      ARG  35  11.134  -2.835  -0.431
  237   HH12  ARG  35          HH12      ARG  35  11.992  -4.174   0.232
  238   HH21  ARG  35          HH21      ARG  35  12.572  -2.665   3.245
  239   HH22  ARG  35          HH22      ARG  35  12.790  -4.085   2.285
  240    H    LEU  36           H        LEU  36   6.946   2.172  -1.679
  241    HA   LEU  36           HA       LEU  36   5.756  -0.382  -1.802
  242    HB2  LEU  36           HB2      LEU  36   4.748   2.262  -2.953
  243    HB3  LEU  36           HB3      LEU  36   3.785   0.796  -2.879
  244    HG   LEU  36           HG       LEU  36   4.795   2.397  -0.504
  245   HD11  LEU  36          HD11      LEU  36   2.431   2.884  -0.060
  246   HD12  LEU  36          HD12      LEU  36   1.974   2.044  -1.543
  247   HD13  LEU  36          HD13      LEU  36   2.947   3.516  -1.624
  248   HD21  LEU  36          HD21      LEU  36   4.804   0.027   0.082
  249   HD22  LEU  36          HD22      LEU  36   3.150  -0.156  -0.507
  250   HD23  LEU  36          HD23      LEU  36   3.480   0.846   0.909
  251    H    ARG  37           H        ARG  37   6.526   1.947  -4.393
  252    HA   ARG  37           HA       ARG  37   5.834   0.466  -6.632
  253    HB2  ARG  37           HB2      ARG  37   7.969   2.592  -6.289
  254    HB3  ARG  37           HB3      ARG  37   7.504   1.941  -7.858
  255    HG2  ARG  37           HG2      ARG  37   5.174   2.706  -7.472
  256    HG3  ARG  37           HG3      ARG  37   5.674   3.401  -5.929
  257    HD2  ARG  37           HD2      ARG  37   6.843   4.212  -8.608
  258    HD3  ARG  37           HD3      ARG  37   5.501   5.038  -7.824
  259    HE   ARG  37           HE       ARG  37   7.323   5.174  -5.901
  260   HH11  ARG  37          HH11      ARG  37   7.818   5.758  -9.284
  261   HH12  ARG  37          HH12      ARG  37   8.951   7.028  -8.993
  262   HH21  ARG  37          HH21      ARG  37   8.786   6.797  -5.593
  263   HH22  ARG  37          HH22      ARG  37   9.489   7.588  -6.956
  264    H    GLU  38           H        GLU  38   8.689   0.070  -4.611
  265    HA   GLU  38           HA       GLU  38  10.295  -1.348  -6.574
  266    HB2  GLU  38           HB2      GLU  38  10.651  -1.239  -3.541
  267    HB3  GLU  38           HB3      GLU  38  11.854  -1.770  -4.710
  268    HG2  GLU  38           HG2      GLU  38  10.803   1.038  -4.314
  269    HG3  GLU  38           HG3      GLU  38  12.409   0.442  -3.918
  270    H    LEU  39           H        LEU  39   8.082  -2.208  -3.974
  271    HA   LEU  39           HA       LEU  39   8.624  -5.090  -4.158
  272    HB2  LEU  39           HB2      LEU  39   6.774  -3.488  -2.354
  273    HB3  LEU  39           HB3      LEU  39   7.022  -5.224  -2.244
  274    HG   LEU  39           HG       LEU  39   9.173  -3.122  -1.763
  275   HD11  LEU  39          HD11      LEU  39   7.492  -3.119   0.026
  276   HD12  LEU  39          HD12      LEU  39   9.020  -3.779   0.608
  277   HD13  LEU  39          HD13      LEU  39   7.682  -4.865   0.228
  278   HD21  LEU  39          HD21      LEU  39  10.577  -5.008  -0.966
  279   HD22  LEU  39          HD22      LEU  39  10.162  -5.199  -2.668
  280   HD23  LEU  39          HD23      LEU  39   9.321  -6.154  -1.444
  281    H    VAL  40           H        VAL  40   6.291  -2.835  -5.369
  282    HA   VAL  40           HA       VAL  40   4.138  -4.809  -5.675
  283    HB   VAL  40           HB       VAL  40   4.163  -1.797  -6.199
  284   HG11  VAL  40          HG11      VAL  40   1.793  -3.707  -6.297
  285   HG12  VAL  40          HG12      VAL  40   2.493  -2.828  -7.655
  286   HG13  VAL  40          HG13      VAL  40   1.686  -1.944  -6.363
  287   HG21  VAL  40          HG21      VAL  40   2.958  -3.388  -3.895
  288   HG22  VAL  40          HG22      VAL  40   2.766  -1.650  -4.153
  289   HG23  VAL  40          HG23      VAL  40   4.366  -2.316  -3.826
  290    HA   PRO  41           HA       PRO  41   5.368  -5.247 -10.127
  291    HB2  PRO  41           HB2      PRO  41   3.574  -7.622 -10.038
  292    HB3  PRO  41           HB3      PRO  41   5.287  -7.532 -10.466
  293    HG2  PRO  41           HG2      PRO  41   4.476  -8.677  -8.154
  294    HG3  PRO  41           HG3      PRO  41   5.996  -7.760  -8.261
  295    HD2  PRO  41           HD2      PRO  41   3.302  -6.838  -7.223
  296    HD3  PRO  41           HD3      PRO  41   4.909  -6.655  -6.482
  297    H    GLY  42           H        GLY  42   2.292  -4.917  -8.524
  298    HA2  GLY  42           HA2      GLY  42   0.517  -4.481 -10.662
  299    HA3  GLY  42           HA3      GLY  42   0.418  -3.706  -9.089
  300    H    VAL  43           H        VAL  43   2.980  -2.350  -9.270
  301    HA   VAL  43           HA       VAL  43   2.562  -0.169 -11.112
  302    HB   VAL  43           HB       VAL  43   5.022  -0.909  -9.439
  303   HG11  VAL  43          HG11      VAL  43   5.717   0.516 -11.306
  304   HG12  VAL  43          HG12      VAL  43   5.787   1.437  -9.803
  305   HG13  VAL  43          HG13      VAL  43   4.451   1.686 -10.930
  306   HG21  VAL  43          HG21      VAL  43   4.252   0.867  -7.883
  307   HG22  VAL  43          HG22      VAL  43   3.064  -0.426  -8.037
  308   HG23  VAL  43          HG23      VAL  43   2.807   1.108  -8.871
  309    HA   PRO  44           HA       PRO  44   4.404  -2.751 -14.466
  310    HB2  PRO  44           HB2      PRO  44   3.728  -0.447 -16.235
  311    HB3  PRO  44           HB3      PRO  44   3.177  -2.125 -16.329
  312    HG2  PRO  44           HG2      PRO  44   1.510  -0.155 -15.558
  313    HG3  PRO  44           HG3      PRO  44   1.423  -1.769 -14.821
  314    HD2  PRO  44           HD2      PRO  44   2.754   0.731 -13.742
  315    HD3  PRO  44           HD3      PRO  44   1.674  -0.415 -12.908
  316    H    ARG  45           H        ARG  45   5.924  -2.096 -16.461
  317    HA   ARG  45           HA       ARG  45   8.432  -1.417 -15.460
  318    HB2  ARG  45           HB2      ARG  45   8.062  -2.760 -17.502
  319    HB3  ARG  45           HB3      ARG  45   7.487  -1.333 -18.354
  320    HG2  ARG  45           HG2      ARG  45   9.766  -0.307 -18.068
  321    HG3  ARG  45           HG3      ARG  45  10.308  -1.817 -17.333
  322    HD2  ARG  45           HD2      ARG  45   9.803  -3.025 -19.425
  323    HD3  ARG  45           HD3      ARG  45   9.223  -1.527 -20.159
  324    HE   ARG  45           HE       ARG  45  11.995  -1.630 -19.198
  325   HH11  ARG  45          HH11      ARG  45   9.868  -1.528 -21.942
  326   HH12  ARG  45          HH12      ARG  45  11.159  -1.211 -23.046
  327   HH21  ARG  45          HH21      ARG  45  13.609  -1.208 -20.658
  328   HH22  ARG  45          HH22      ARG  45  13.227  -1.040 -22.338
  329    H    GLY  46           H        GLY  46   8.900   0.514 -14.546
  330    HA2  GLY  46           HA2      GLY  46   9.343   2.757 -14.300
  331    HA3  GLY  46           HA3      GLY  46   8.980   2.982 -16.003
  332    H    THR  47           H        THR  47   6.915   3.573 -16.646
  333    HA   THR  47           HA       THR  47   4.769   4.257 -16.659
  334    HB   THR  47           HB       THR  47   4.415   3.206 -13.815
  335    HG1  THR  47           HG1      THR  47   5.084   1.430 -14.802
  336   HG21  THR  47          HG21      THR  47   2.069   2.814 -14.506
  337   HG22  THR  47          HG22      THR  47   2.416   3.469 -16.108
  338   HG23  THR  47          HG23      THR  47   2.486   4.519 -14.692
  339    H    GLN  48           H        GLN  48   3.539   6.104 -16.153
  340    HA   GLN  48           HA       GLN  48   4.692   8.078 -14.284
  341    HB2  GLN  48           HB2      GLN  48   2.488   8.380 -16.373
  342    HB3  GLN  48           HB3      GLN  48   3.175   9.693 -15.416
  343    HG2  GLN  48           HG2      GLN  48   5.360   9.335 -16.497
  344    HG3  GLN  48           HG3      GLN  48   4.677   8.009 -17.441
  345   HE21  GLN  48          HE21      GLN  48   5.892  10.459 -18.415
  346   HE22  GLN  48          HE22      GLN  48   4.697  11.254 -19.370
  347    H    LEU  49           H        LEU  49   3.991   7.476 -12.263
  348    HA   LEU  49           HA       LEU  49   1.066   7.262 -11.775
  349    HB2  LEU  49           HB2      LEU  49   3.323   5.949 -10.209
  350    HB3  LEU  49           HB3      LEU  49   1.625   5.902  -9.756
  351    HG   LEU  49           HG       LEU  49   2.847   4.637 -12.237
  352   HD11  LEU  49          HD11      LEU  49   2.233   2.504 -11.205
  353   HD12  LEU  49          HD12      LEU  49   1.646   3.353  -9.772
  354   HD13  LEU  49          HD13      LEU  49   3.361   3.405 -10.194
  355   HD21  LEU  49          HD21      LEU  49   0.612   3.696 -12.701
  356   HD22  LEU  49          HD22      LEU  49   0.581   5.455 -12.774
  357   HD23  LEU  49          HD23      LEU  49  -0.072   4.620 -11.362
  358    H    SER  50           H        SER  50   0.251   8.939 -10.718
  359    HA   SER  50           HA       SER  50   1.765  10.765  -9.060
  360    HB2  SER  50           HB2      SER  50  -1.242  10.460  -9.470
  361    HB3  SER  50           HB3      SER  50  -0.466  11.799  -8.620
  362    HG   SER  50           HG       SER  50  -0.715  11.321 -11.309
  363    H    GLN  51           H        GLN  51   0.604  11.276  -6.785
  364    HA   GLN  51           HA       GLN  51   1.360   9.243  -5.011
  365    HB2  GLN  51           HB2      GLN  51  -0.476  11.608  -4.472
  366    HB3  GLN  51           HB3      GLN  51   0.297  10.634  -3.232
  367    HG2  GLN  51           HG2      GLN  51   1.918  12.149  -5.287
  368    HG3  GLN  51           HG3      GLN  51   1.340  12.918  -3.817
  369   HE21  GLN  51          HE21      GLN  51   2.531   9.559  -3.929
  370   HE22  GLN  51          HE22      GLN  51   3.917   9.868  -2.977
  371    H    VAL  52           H        VAL  52  -1.887  10.090  -6.200
  372    HA   VAL  52           HA       VAL  52  -3.364   8.225  -4.609
  373    HB   VAL  52           HB       VAL  52  -4.281   9.094  -7.399
  374   HG11  VAL  52          HG11      VAL  52  -5.820   8.472  -4.839
  375   HG12  VAL  52          HG12      VAL  52  -5.668   7.416  -6.246
  376   HG13  VAL  52          HG13      VAL  52  -6.543   8.939  -6.386
  377   HG21  VAL  52          HG21      VAL  52  -3.522  11.147  -6.297
  378   HG22  VAL  52          HG22      VAL  52  -4.495  10.772  -4.878
  379   HG23  VAL  52          HG23      VAL  52  -5.284  11.130  -6.415
  380    H    GLU  53           H        GLU  53  -2.013   8.100  -7.881
  381    HA   GLU  53           HA       GLU  53  -3.010   5.649  -8.784
  382    HB2  GLU  53           HB2      GLU  53  -0.479   7.168  -9.516
  383    HB3  GLU  53           HB3      GLU  53  -1.048   5.763 -10.405
  384    HG2  GLU  53           HG2      GLU  53  -2.613   8.341 -10.071
  385    HG3  GLU  53           HG3      GLU  53  -1.634   7.924 -11.478
  386    H    ILE  54           H        ILE  54  -0.050   6.317  -6.911
  387    HA   ILE  54           HA       ILE  54   1.037   3.699  -6.978
  388    HB   ILE  54           HB       ILE  54   1.331   5.819  -4.800
  389   HG12  ILE  54          HG12      ILE  54   3.168   5.172  -7.170
  390   HG13  ILE  54          HG13      ILE  54   2.122   6.582  -7.052
  391   HG21  ILE  54          HG21      ILE  54   2.972   3.287  -5.266
  392   HG22  ILE  54          HG22      ILE  54   1.941   3.646  -3.874
  393   HG23  ILE  54          HG23      ILE  54   3.410   4.581  -4.141
  394   HD11  ILE  54          HD11      ILE  54   4.491   5.968  -5.289
  395   HD12  ILE  54          HD12      ILE  54   3.437   7.379  -5.136
  396   HD13  ILE  54          HD13      ILE  54   4.416   7.161  -6.586
  397    H    LEU  55           H        LEU  55  -1.157   5.269  -4.596
  398    HA   LEU  55           HA       LEU  55  -1.594   3.155  -2.816
  399    HB2  LEU  55           HB2      LEU  55  -3.601   5.246  -3.759
  400    HB3  LEU  55           HB3      LEU  55  -3.803   4.237  -2.338
  401    HG   LEU  55           HG       LEU  55  -1.616   6.325  -2.688
  402   HD11  LEU  55          HD11      LEU  55  -3.821   7.387  -2.474
  403   HD12  LEU  55          HD12      LEU  55  -2.858   7.655  -1.025
  404   HD13  LEU  55          HD13      LEU  55  -4.149   6.453  -1.011
  405   HD21  LEU  55          HD21      LEU  55  -0.889   4.477  -1.236
  406   HD22  LEU  55          HD22      LEU  55  -2.346   4.651  -0.255
  407   HD23  LEU  55          HD23      LEU  55  -1.146   5.945  -0.295
  408    H    GLN  56           H        GLN  56  -3.279   3.893  -5.858
  409    HA   GLN  56           HA       GLN  56  -5.237   1.819  -5.642
  410    HB2  GLN  56           HB2      GLN  56  -4.408   3.441  -8.086
  411    HB3  GLN  56           HB3      GLN  56  -5.866   2.460  -7.950
  412    HG2  GLN  56           HG2      GLN  56  -6.584   3.923  -6.030
  413    HG3  GLN  56           HG3      GLN  56  -5.204   4.961  -6.367
  414   HE21  GLN  56          HE21      GLN  56  -7.977   5.646  -6.360
  415   HE22  GLN  56          HE22      GLN  56  -8.365   6.242  -7.929
  416    H    ARG  57           H        ARG  57  -2.108   2.059  -7.345
  417    HA   ARG  57           HA       ARG  57  -2.237  -0.467  -8.669
  418    HB2  ARG  57           HB2      ARG  57  -0.117   1.578  -8.187
  419    HB3  ARG  57           HB3      ARG  57   0.483  -0.054  -8.423
  420    HG2  ARG  57           HG2      ARG  57   0.542   1.103 -10.527
  421    HG3  ARG  57           HG3      ARG  57  -0.678  -0.159 -10.611
  422    HD2  ARG  57           HD2      ARG  57  -1.378   2.735 -10.055
  423    HD3  ARG  57           HD3      ARG  57  -1.245   2.094 -11.691
  424    HE   ARG  57           HE       ARG  57  -3.018   0.500 -10.158
  425   HH11  ARG  57          HH11      ARG  57  -2.927   3.631 -11.649
  426   HH12  ARG  57          HH12      ARG  57  -4.620   3.628 -11.959
  427   HH21  ARG  57          HH21      ARG  57  -5.157   0.543 -10.551
  428   HH22  ARG  57          HH22      ARG  57  -5.871   1.901 -11.347
  429    H    VAL  58           H        VAL  58  -1.205   0.471  -5.422
  430    HA   VAL  58           HA       VAL  58  -0.246  -2.080  -4.594
  431    HB   VAL  58           HB       VAL  58  -1.459   0.191  -2.941
  432   HG11  VAL  58          HG11      VAL  58  -0.535  -0.937  -0.934
  433   HG12  VAL  58          HG12      VAL  58  -0.055  -2.318  -1.924
  434   HG13  VAL  58          HG13      VAL  58  -1.763  -1.928  -1.720
  435   HG21  VAL  58          HG21      VAL  58   0.888   0.648  -2.280
  436   HG22  VAL  58          HG22      VAL  58   0.683   0.761  -4.027
  437   HG23  VAL  58          HG23      VAL  58   1.445  -0.664  -3.326
  438    H    ILE  59           H        ILE  59  -3.512  -0.572  -4.455
  439    HA   ILE  59           HA       ILE  59  -4.906  -2.698  -3.244
  440    HB   ILE  59           HB       ILE  59  -5.942  -0.673  -5.285
  441   HG12  ILE  59          HG12      ILE  59  -6.091  -0.636  -2.224
  442   HG13  ILE  59          HG13      ILE  59  -5.003   0.343  -3.196
  443   HG21  ILE  59          HG21      ILE  59  -7.498  -2.576  -5.185
  444   HG22  ILE  59          HG22      ILE  59  -8.228  -1.172  -4.407
  445   HG23  ILE  59          HG23      ILE  59  -7.554  -2.471  -3.422
  446   HD11  ILE  59          HD11      ILE  59  -8.013   0.532  -3.181
  447   HD12  ILE  59          HD12      ILE  59  -6.919   1.522  -4.154
  448   HD13  ILE  59          HD13      ILE  59  -6.882   1.633  -2.394
  449    H    ASP  60           H        ASP  60  -4.189  -2.099  -6.710
  450    HA   ASP  60           HA       ASP  60  -5.446  -4.345  -7.849
  451    HB2  ASP  60           HB2      ASP  60  -2.952  -2.848  -8.753
  452    HB3  ASP  60           HB3      ASP  60  -3.747  -4.082  -9.728
  453    H    TYR  61           H        TYR  61  -2.123  -3.987  -6.603
  454    HA   TYR  61           HA       TYR  61  -1.137  -6.560  -7.071
  455    HB2  TYR  61           HB2      TYR  61   0.416  -4.886  -6.366
  456    HB3  TYR  61           HB3      TYR  61  -0.521  -4.496  -4.929
  457    HD1  TYR  61           HD1      TYR  61   1.505  -7.267  -6.452
  458    HD2  TYR  61           HD2      TYR  61   0.080  -5.493  -2.830
  459    HE1  TYR  61           HE1      TYR  61   2.881  -8.825  -5.145
  460    HE2  TYR  61           HE2      TYR  61   1.470  -7.046  -1.533
  461    HH   TYR  61           HH       TYR  61   2.489  -9.281  -1.813
  462    H    ILE  62           H        ILE  62  -2.977  -5.349  -4.254
  463    HA   ILE  62           HA       ILE  62  -2.905  -7.819  -2.810
  464    HB   ILE  62           HB       ILE  62  -4.920  -5.552  -2.407
  465   HG12  ILE  62          HG12      ILE  62  -2.200  -5.904  -1.025
  466   HG13  ILE  62          HG13      ILE  62  -2.522  -4.730  -2.290
  467   HG21  ILE  62          HG21      ILE  62  -3.936  -7.718  -0.489
  468   HG22  ILE  62          HG22      ILE  62  -5.530  -7.653  -1.244
  469   HG23  ILE  62          HG23      ILE  62  -5.061  -6.418  -0.081
  470   HD11  ILE  62          HD11      ILE  62  -4.144  -3.603  -0.820
  471   HD12  ILE  62          HD12      ILE  62  -2.530  -3.680  -0.116
  472   HD13  ILE  62          HD13      ILE  62  -3.787  -4.778   0.452
  473    H    LEU  63           H        LEU  63  -5.096  -6.491  -5.264
  474    HA   LEU  63           HA       LEU  63  -7.197  -8.380  -5.072
  475    HB2  LEU  63           HB2      LEU  63  -6.153  -6.857  -7.486
  476    HB3  LEU  63           HB3      LEU  63  -7.614  -7.832  -7.518
  477    HG   LEU  63           HG       LEU  63  -7.210  -5.380  -5.757
  478   HD11  LEU  63          HD11      LEU  63  -7.316  -4.718  -8.108
  479   HD12  LEU  63          HD12      LEU  63  -8.783  -4.224  -7.267
  480   HD13  LEU  63          HD13      LEU  63  -8.807  -5.638  -8.323
  481   HD21  LEU  63          HD21      LEU  63  -9.629  -5.560  -5.290
  482   HD22  LEU  63          HD22      LEU  63  -8.759  -6.988  -4.737
  483   HD23  LEU  63          HD23      LEU  63  -9.700  -7.058  -6.228
  484    H    ASP  64           H        ASP  64  -4.069  -8.520  -6.810
  485    HA   ASP  64           HA       ASP  64  -4.374 -11.003  -8.100
  486    HB2  ASP  64           HB2      ASP  64  -1.867  -9.653  -7.006
  487    HB3  ASP  64           HB3      ASP  64  -1.829 -11.106  -7.988
  488    H    LEU  65           H        LEU  65  -3.351 -10.228  -4.820
  489    HA   LEU  65           HA       LEU  65  -2.547 -12.838  -3.986
  490    HB2  LEU  65           HB2      LEU  65  -3.485 -10.495  -2.287
  491    HB3  LEU  65           HB3      LEU  65  -2.537 -11.864  -1.728
  492    HG   LEU  65           HG       LEU  65  -1.568  -9.781  -3.721
  493   HD11  LEU  65          HD11      LEU  65  -1.853  -8.768  -1.525
  494   HD12  LEU  65          HD12      LEU  65  -0.141  -8.940  -1.899
  495   HD13  LEU  65          HD13      LEU  65  -0.911 -10.060  -0.776
  496   HD21  LEU  65          HD21      LEU  65   0.656 -10.785  -3.428
  497   HD22  LEU  65          HD22      LEU  65  -0.488 -11.963  -4.065
  498   HD23  LEU  65          HD23      LEU  65  -0.027 -12.020  -2.363
  499    H    GLN  66           H        GLN  66  -5.527 -10.979  -3.555
  500    HA   GLN  66           HA       GLN  66  -6.876 -12.861  -1.879
  501    HB2  GLN  66           HB2      GLN  66  -7.969 -10.502  -3.466
  502    HB3  GLN  66           HB3      GLN  66  -8.887 -11.411  -2.265
  503    HG2  GLN  66           HG2      GLN  66  -7.350 -10.698  -0.497
  504    HG3  GLN  66           HG3      GLN  66  -6.352  -9.843  -1.674
  505   HE21  GLN  66          HE21      GLN  66  -7.177  -7.922  -2.611
  506   HE22  GLN  66          HE22      GLN  66  -8.473  -7.041  -1.885
  507    H    VAL  67           H        VAL  67  -7.566 -11.856  -5.253
  508    HA   VAL  67           HA       VAL  67  -8.809 -14.500  -5.791
  509    HB   VAL  67           HB       VAL  67 -10.194 -13.392  -7.547
  510   HG11  VAL  67          HG11      VAL  67 -11.763 -12.222  -6.037
  511   HG12  VAL  67          HG12      VAL  67 -10.511 -12.112  -4.799
  512   HG13  VAL  67          HG13      VAL  67 -11.132 -13.689  -5.285
  513   HG21  VAL  67          HG21      VAL  67 -10.340 -10.910  -7.667
  514   HG22  VAL  67          HG22      VAL  67  -8.732 -11.482  -8.105
  515   HG23  VAL  67          HG23      VAL  67  -9.007 -10.773  -6.514
  516    H    VAL  68           H        VAL  68  -8.338 -15.532  -7.755
  517    HA   VAL  68           HA       VAL  68  -5.751 -14.805  -8.948
  518    HB   VAL  68           HB       VAL  68  -5.943 -17.112 -10.076
  519   HG11  VAL  68          HG11      VAL  68  -5.900 -16.989  -7.031
  520   HG12  VAL  68          HG12      VAL  68  -4.533 -16.695  -8.105
  521   HG13  VAL  68          HG13      VAL  68  -5.250 -18.303  -8.018
  522   HG21  VAL  68          HG21      VAL  68  -8.383 -17.460  -9.878
  523   HG22  VAL  68          HG22      VAL  68  -8.265 -17.456  -8.118
  524   HG23  VAL  68          HG23      VAL  68  -7.510 -18.751  -9.053
  525    H1   MET   1           H1       MET   1  -6.581  16.172  10.762
  526    H2   MET   1           H2       MET   1  -7.489  16.199  12.183
  527    H3   MET   1           H3       MET   1  -6.022  15.367  12.139
  528    HA   MET   1           HA       MET   1  -5.837  17.458  13.323
  529    HB2  MET   1           HB2      MET   1  -3.830  18.311  12.111
  530    HB3  MET   1           HB3      MET   1  -3.840  16.558  12.233
  531    HG2  MET   1           HG2      MET   1  -4.588  16.387   9.904
  532    HG3  MET   1           HG3      MET   1  -4.614  18.146   9.774
  533    HE1  MET   1           HE1      MET   1  -2.404  19.684   9.799
  534    HE2  MET   1           HE2      MET   1  -0.785  19.041  10.067
  535    HE3  MET   1           HE3      MET   1  -1.967  19.021  11.374
  536    H    GLY   2           H        GLY   2  -5.697  19.809  13.199
  537    HA2  GLY   2           HA2      GLY   2  -7.055  21.176  10.965
  538    HA3  GLY   2           HA3      GLY   2  -7.748  21.324  12.575
  539    H    HIS   3           H        HIS   3  -5.238  22.347  10.445
  540    HA   HIS   3           HA       HIS   3  -3.707  23.808  12.507
  541    HB2  HIS   3           HB2      HIS   3  -1.998  24.088  10.726
  542    HB3  HIS   3           HB3      HIS   3  -2.417  22.392  10.943
  543    HD2  HIS   3           HD2      HIS   3  -3.766  21.193   8.784
  544    HE1  HIS   3           HE1      HIS   3  -3.327  24.527   6.225
  545    HE2  HIS   3           HE2      HIS   3  -4.270  22.196   6.449
  546    H    HIS   4           H        HIS   4  -2.696  25.871  10.691
  547    HA   HIS   4           HA       HIS   4  -4.567  27.911  11.282
  548    HB2  HIS   4           HB2      HIS   4  -2.942  29.429  10.177
  549    HB3  HIS   4           HB3      HIS   4  -2.152  28.336  11.300
  550    HD2  HIS   4           HD2      HIS   4  -1.574  29.616   7.844
  551    HE1  HIS   4           HE1      HIS   4   0.177  25.765   7.884
  552    HE2  HIS   4           HE2      HIS   4   0.108  28.005   6.718
  553    H    HIS   5           H        HIS   5  -6.464  28.104  10.235
  554    HA   HIS   5           HA       HIS   5  -8.027  28.631   8.713
  555    HB2  HIS   5           HB2      HIS   5  -5.686  29.487   6.962
  556    HB3  HIS   5           HB3      HIS   5  -7.372  29.943   6.715
  557    HD2  HIS   5           HD2      HIS   5  -8.344  31.934   8.438
  558    HE1  HIS   5           HE1      HIS   5  -4.605  32.712  10.248
  559    HE2  HIS   5           HE2      HIS   5  -7.053  33.336  10.186
  560    H    HIS   6           H        HIS   6  -5.588  27.556   6.312
  561    HA   HIS   6           HA       HIS   6  -5.679  26.248   4.486
  562    HB2  HIS   6           HB2      HIS   6  -5.671  24.469   6.295
  563    HB3  HIS   6           HB3      HIS   6  -7.418  24.367   6.133
  564    HD2  HIS   6           HD2      HIS   6  -4.205  23.591   3.984
  565    HE1  HIS   6           HE1      HIS   6  -7.474  21.367   2.488
  566    HE2  HIS   6           HE2      HIS   6  -4.961  21.663   2.429
  567    H    HIS   7           H        HIS   7  -6.788  27.689   3.189
  568    HA   HIS   7           HA       HIS   7  -9.615  28.080   3.202
  569    HB2  HIS   7           HB2      HIS   7  -7.553  28.886   1.106
  570    HB3  HIS   7           HB3      HIS   7  -9.207  29.481   1.175
  571    HD2  HIS   7           HD2      HIS   7  -5.853  30.649   2.223
  572    HE1  HIS   7           HE1      HIS   7  -8.527  32.336   5.034
  573    HE2  HIS   7           HE2      HIS   7  -6.120  32.213   4.271
  574    H    HIS   8           H        HIS   8 -10.930  27.945   1.113
  575    HA   HIS   8           HA       HIS   8 -11.664  25.360   0.598
  576    HB2  HIS   8           HB2      HIS   8 -12.088  27.850  -1.086
  577    HB3  HIS   8           HB3      HIS   8 -12.859  26.316  -1.467
  578    HD2  HIS   8           HD2      HIS   8 -14.538  25.347   0.742
  579    HE1  HIS   8           HE1      HIS   8 -15.373  29.309   1.948
  580    HE2  HIS   8           HE2      HIS   8 -16.157  26.910   2.018
  581    H    SER   9           H        SER   9 -10.226  23.851  -0.038
  582    HA   SER   9           HA       SER   9  -8.437  24.191  -2.323
  583    HB2  SER   9           HB2      SER   9  -8.884  21.807  -0.472
  584    HB3  SER   9           HB3      SER   9  -7.615  21.928  -1.691
  585    HG   SER   9           HG       SER   9  -7.735  24.030   0.117
  586    H    HIS  10           H        HIS  10  -9.568  24.179  -4.241
  587    HA   HIS  10           HA       HIS  10 -10.814  21.686  -5.098
  588    HB2  HIS  10           HB2      HIS  10 -12.931  22.716  -5.865
  589    HB3  HIS  10           HB3      HIS  10 -12.753  22.853  -4.124
  590    HD1  HIS  10           HD1      HIS  10 -13.554  24.809  -7.066
  591    HD2  HIS  10           HD2      HIS  10 -11.900  25.619  -3.346
  592    HE1  HIS  10           HE1      HIS  10 -13.765  27.280  -6.766
  593    HE2  HIS  10           HE2      HIS  10 -12.580  27.761  -4.612
  594    H    MET  11           H        MET  11  -8.813  21.759  -6.330
  595    HA   MET  11           HA       MET  11  -8.539  23.588  -8.575
  596    HB2  MET  11           HB2      MET  11  -6.572  22.506  -7.479
  597    HB3  MET  11           HB3      MET  11  -7.151  20.930  -7.989
  598    HG2  MET  11           HG2      MET  11  -6.403  23.104  -9.947
  599    HG3  MET  11           HG3      MET  11  -5.242  21.926  -9.331
  600    HE1  MET  11           HE1      MET  11  -4.611  21.080 -11.754
  601    HE2  MET  11           HE2      MET  11  -5.675  22.333 -12.397
  602    HE3  MET  11           HE3      MET  11  -5.809  20.675 -12.982
  603    H    GLY  12           H        GLY  12  -9.291  20.114  -8.239
  604    HA2  GLY  12           HA2      GLY  12 -11.501  19.798  -9.764
  605    HA3  GLY  12           HA3      GLY  12 -10.218  19.824 -10.970
  606    H    GLY  13           H        GLY  13 -12.082  17.757  -9.273
  607    HA2  GLY  13           HA2      GLY  13 -11.042  15.390 -10.046
  608    HA3  GLY  13           HA3      GLY  13 -10.103  15.712  -8.595
  609    H    GLY  14           H        GLY  14 -11.761  13.473  -8.923
  610    HA2  GLY  14           HA2      GLY  14 -12.924  12.852  -6.658
  611    HA3  GLY  14           HA3      GLY  14 -14.172  13.928  -7.278
  612    H    LYS  15           H        LYS  15 -15.531  12.007  -7.087
  613    HA   LYS  15           HA       LYS  15 -16.884  10.454  -7.994
  614    HB2  LYS  15           HB2      LYS  15 -16.741  11.804 -10.095
  615    HB3  LYS  15           HB3      LYS  15 -15.356  10.847 -10.607
  616    HG2  LYS  15           HG2      LYS  15 -16.851   8.804 -10.582
  617    HG3  LYS  15           HG3      LYS  15 -18.218   9.873 -10.258
  618    HD2  LYS  15           HD2      LYS  15 -16.430   9.925 -12.723
  619    HD3  LYS  15           HD3      LYS  15 -18.087   9.326 -12.652
  620    HE2  LYS  15           HE2      LYS  15 -18.869  11.619 -12.089
  621    HE3  LYS  15           HE3      LYS  15 -17.211  12.208 -12.230
  622    HZ1  LYS  15           HZ1      LYS  15 -17.207  11.560 -14.548
  623    HZ2  LYS  15           HZ2      LYS  15 -18.512  12.592 -14.241
  624    HZ3  LYS  15           HZ3      LYS  15 -18.769  10.932 -14.409
  625    H    GLY  16           H        GLY  16 -16.944   8.253  -7.767
  626    HA2  GLY  16           HA2      GLY  16 -15.237   6.314  -8.768
  627    HA3  GLY  16           HA3      GLY  16 -14.512   6.817  -7.246
  628    HA   PRO  17           HA       PRO  17 -17.371   3.491  -5.877
  629    HB2  PRO  17           HB2      PRO  17 -15.759   3.321  -3.411
  630    HB3  PRO  17           HB3      PRO  17 -15.941   2.133  -4.704
  631    HG2  PRO  17           HG2      PRO  17 -13.605   3.486  -4.281
  632    HG3  PRO  17           HG3      PRO  17 -14.118   2.938  -5.891
  633    HD2  PRO  17           HD2      PRO  17 -14.379   5.695  -4.660
  634    HD3  PRO  17           HD3      PRO  17 -13.809   5.236  -6.287
  635    H    ALA  18           H        ALA  18 -18.999   5.202  -5.692
  636    HA   ALA  18           HA       ALA  18 -19.976   5.467  -2.975
  637    HB1  ALA  18           HB1      ALA  18 -18.499   7.449  -3.112
  638    HB2  ALA  18           HB2      ALA  18 -20.191   7.930  -2.988
  639    HB3  ALA  18           HB3      ALA  18 -19.363   8.008  -4.547
  640    H    ALA  19           H        ALA  19 -22.051   4.756  -3.258
  641    HA   ALA  19           HA       ALA  19 -23.677   5.165  -5.588
  642    HB1  ALA  19           HB1      ALA  19 -24.084   3.339  -3.938
  643    HB2  ALA  19           HB2      ALA  19 -25.524   4.321  -4.206
  644    HB3  ALA  19           HB3      ALA  19 -24.566   4.545  -2.738
  645    H    GLU  20           H        GLU  20 -23.293   6.820  -2.520
  646    HA   GLU  20           HA       GLU  20 -24.503   9.292  -3.390
  647    HB2  GLU  20           HB2      GLU  20 -26.527   8.081  -2.788
  648    HB3  GLU  20           HB3      GLU  20 -25.812   7.513  -1.283
  649    HG2  GLU  20           HG2      GLU  20 -25.811   9.793  -0.401
  650    HG3  GLU  20           HG3      GLU  20 -26.472  10.389  -1.923
  651    H    GLU  21           H        GLU  21 -23.720  11.006  -2.086
  652    HA   GLU  21           HA       GLU  21 -21.633  10.252  -0.104
  653    HB2  GLU  21           HB2      GLU  21 -20.039  11.664  -1.155
  654    HB3  GLU  21           HB3      GLU  21 -20.788  10.793  -2.475
  655    HG2  GLU  21           HG2      GLU  21 -21.507  13.640  -1.689
  656    HG3  GLU  21           HG3      GLU  21 -20.329  13.229  -2.922
  657    HA   PRO  22           HA       PRO  22 -22.913  14.186   2.003
  658    HB2  PRO  22           HB2      PRO  22 -20.829  14.502   3.712
  659    HB3  PRO  22           HB3      PRO  22 -22.065  13.266   3.983
  660    HG2  PRO  22           HG2      PRO  22 -19.310  12.961   2.806
  661    HG3  PRO  22           HG3      PRO  22 -20.139  11.930   3.992
  662    HD2  PRO  22           HD2      PRO  22 -19.998  11.361   1.288
  663    HD3  PRO  22           HD3      PRO  22 -21.298  10.770   2.344
  664    H    LEU  23           H        LEU  23 -22.748  15.979   0.732
  665    HA   LEU  23           HA       LEU  23 -20.568  16.503  -1.044
  666    HB2  LEU  23           HB2      LEU  23 -23.038  18.122  -0.323
  667    HB3  LEU  23           HB3      LEU  23 -21.870  18.664  -1.514
  668    HG   LEU  23           HG       LEU  23 -23.474  16.083  -1.739
  669   HD11  LEU  23          HD11      LEU  23 -24.949  18.040  -1.936
  670   HD12  LEU  23          HD12      LEU  23 -24.782  17.217  -3.485
  671   HD13  LEU  23          HD13      LEU  23 -23.902  18.719  -3.188
  672   HD21  LEU  23          HD21      LEU  23 -21.654  17.441  -3.774
  673   HD22  LEU  23          HD22      LEU  23 -22.627  15.998  -4.065
  674   HD23  LEU  23          HD23      LEU  23 -21.301  15.943  -2.907
  675    H    SER  24           H        SER  24 -18.779  16.642   0.428
  676    HA   SER  24           HA       SER  24 -17.901  19.319   0.697
  677    HB2  SER  24           HB2      SER  24 -19.224  19.184   2.845
  678    HB3  SER  24           HB3      SER  24 -18.166  17.874   3.378
  679    HG   SER  24           HG       SER  24 -17.411  19.833   4.197
  680    H    LEU  25           H        LEU  25 -16.869  16.574   2.779
  681    HA   LEU  25           HA       LEU  25 -14.349  16.382   1.225
  682    HB2  LEU  25           HB2      LEU  25 -14.819  16.279   4.207
  683    HB3  LEU  25           HB3      LEU  25 -13.464  15.396   3.528
  684    HG   LEU  25           HG       LEU  25 -12.596  17.561   2.557
  685   HD11  LEU  25          HD11      LEU  25 -14.737  18.893   4.244
  686   HD12  LEU  25          HD12      LEU  25 -14.641  18.890   2.484
  687   HD13  LEU  25          HD13      LEU  25 -13.402  19.711   3.424
  688   HD21  LEU  25          HD21      LEU  25 -12.889  17.515   5.581
  689   HD22  LEU  25          HD22      LEU  25 -11.663  18.396   4.665
  690   HD23  LEU  25          HD23      LEU  25 -11.680  16.635   4.638
  691    H    LEU  26           H        LEU  26 -13.543  14.433   0.703
  692    HA   LEU  26           HA       LEU  26 -14.732  11.866   1.430
  693    HB2  LEU  26           HB2      LEU  26 -14.886  12.999  -1.396
  694    HB3  LEU  26           HB3      LEU  26 -14.994  11.281  -1.073
  695    HG   LEU  26           HG       LEU  26 -16.974  13.324  -0.001
  696   HD11  LEU  26          HD11      LEU  26 -18.511  12.569  -1.748
  697   HD12  LEU  26          HD12      LEU  26 -17.265  11.522  -2.428
  698   HD13  LEU  26          HD13      LEU  26 -17.064  13.276  -2.459
  699   HD21  LEU  26          HD21      LEU  26 -17.057  10.272  -0.058
  700   HD22  LEU  26          HD22      LEU  26 -18.383  11.322   0.454
  701   HD23  LEU  26          HD23      LEU  26 -16.884  11.302   1.374
  702    H    ASP  27           H        ASP  27 -12.933  13.180  -1.328
  703    HA   ASP  27           HA       ASP  27 -10.900  13.079  -2.169
  704    HB2  ASP  27           HB2      ASP  27 -10.060  12.467   0.690
  705    HB3  ASP  27           HB3      ASP  27  -8.945  12.890  -0.610
  706    H    ASP  28           H        ASP  28 -10.317  11.640  -3.574
  707    HA   ASP  28           HA       ASP  28 -10.878   8.899  -3.469
  708    HB2  ASP  28           HB2      ASP  28 -10.657  10.295  -5.546
  709    HB3  ASP  28           HB3      ASP  28  -8.912  10.328  -5.313
  710    H    MET  29           H        MET  29  -7.928  10.676  -2.633
  711    HA   MET  29           HA       MET  29  -6.155   8.507  -2.247
  712    HB2  MET  29           HB2      MET  29  -6.213  11.078  -0.605
  713    HB3  MET  29           HB3      MET  29  -4.850   9.983  -0.791
  714    HG2  MET  29           HG2      MET  29  -5.116  10.563  -3.347
  715    HG3  MET  29           HG3      MET  29  -5.949  11.985  -2.723
  716    HE1  MET  29           HE1      MET  29  -2.649   9.969  -2.962
  717    HE2  MET  29           HE2      MET  29  -2.793  10.010  -1.200
  718    HE3  MET  29           HE3      MET  29  -1.508  10.920  -2.002
  719    H    ASN  30           H        ASN  30  -8.456  10.084  -0.042
  720    HA   ASN  30           HA       ASN  30  -7.840   8.666   2.333
  721    HB2  ASN  30           HB2      ASN  30  -8.985  10.847   2.338
  722    HB3  ASN  30           HB3      ASN  30 -10.356  10.160   1.479
  723   HD21  ASN  30          HD21      ASN  30 -11.799  10.795   3.069
  724   HD22  ASN  30          HD22      ASN  30 -11.884  10.044   4.621
  725    H    HIS  31           H        HIS  31 -10.265   8.089  -0.219
  726    HA   HIS  31           HA       HIS  31 -11.538   5.848   1.021
  727    HB2  HIS  31           HB2      HIS  31 -12.463   7.321  -0.905
  728    HB3  HIS  31           HB3      HIS  31 -11.479   6.344  -1.990
  729    HD2  HIS  31           HD2      HIS  31 -14.970   6.356  -0.612
  730    HE1  HIS  31           HE1      HIS  31 -14.117   2.298  -1.478
  731    HE2  HIS  31           HE2      HIS  31 -15.948   4.009  -1.117
  732    H    CYS  32           H        CYS  32  -8.861   6.163  -1.307
  733    HA   CYS  32           HA       CYS  32  -8.342   3.400  -1.707
  734    HB2  CYS  32           HB2      CYS  32  -6.505   5.809  -1.974
  735    HB3  CYS  32           HB3      CYS  32  -6.053   4.176  -2.461
  736    HG   CYS  32           HG       CYS  32  -8.776   5.784  -3.764
  737    H    TYR  33           H        TYR  33  -7.102   5.699   0.708
  738    HA   TYR  33           HA       TYR  33  -5.304   3.994   2.083
  739    HB2  TYR  33           HB2      TYR  33  -6.700   6.582   2.758
  740    HB3  TYR  33           HB3      TYR  33  -5.978   5.689   4.088
  741    HD1  TYR  33           HD1      TYR  33  -3.470   4.774   3.415
  742    HD2  TYR  33           HD2      TYR  33  -5.304   8.333   1.928
  743    HE1  TYR  33           HE1      TYR  33  -1.260   5.748   3.035
  744    HE2  TYR  33           HE2      TYR  33  -3.086   9.312   1.534
  745    HH   TYR  33           HH       TYR  33  -0.271   7.581   1.493
  746    H    SER  34           H        SER  34  -8.774   4.575   2.455
  747    HA   SER  34           HA       SER  34  -9.292   3.026   4.750
  748    HB2  SER  34           HB2      SER  34 -10.991   4.547   3.780
  749    HB3  SER  34           HB3      SER  34 -11.117   3.535   2.347
  750    HG   SER  34           HG       SER  34 -11.946   1.872   3.665
  751    H    ARG  35           H        ARG  35  -9.434   2.119   1.291
  752    HA   ARG  35           HA       ARG  35  -9.997  -0.631   1.704
  753    HB2  ARG  35           HB2      ARG  35  -9.155   0.999  -0.688
  754    HB3  ARG  35           HB3      ARG  35  -9.068  -0.756  -0.805
  755    HG2  ARG  35           HG2      ARG  35 -11.575   0.723   0.031
  756    HG3  ARG  35           HG3      ARG  35 -11.225   0.264  -1.642
  757    HD2  ARG  35           HD2      ARG  35 -11.202  -2.107  -1.017
  758    HD3  ARG  35           HD3      ARG  35 -11.424  -1.688   0.688
  759    HE   ARG  35           HE       ARG  35 -13.556  -0.579  -0.704
  760   HH11  ARG  35          HH11      ARG  35 -12.412  -3.789  -0.074
  761   HH12  ARG  35          HH12      ARG  35 -14.003  -4.457  -0.076
  762   HH21  ARG  35          HH21      ARG  35 -15.548  -1.451  -0.692
  763   HH22  ARG  35          HH22      ARG  35 -15.755  -3.150  -0.438
  764    H    LEU  36           H        LEU  36  -6.869   1.051   1.527
  765    HA   LEU  36           HA       LEU  36  -5.217  -1.244   1.475
  766    HB2  LEU  36           HB2      LEU  36  -4.748   1.377   2.955
  767    HB3  LEU  36           HB3      LEU  36  -3.525   0.142   2.712
  768    HG   LEU  36           HG       LEU  36  -4.838   1.832   0.552
  769   HD11  LEU  36          HD11      LEU  36  -3.164   3.059   1.833
  770   HD12  LEU  36          HD12      LEU  36  -2.601   2.759   0.191
  771   HD13  LEU  36          HD13      LEU  36  -1.970   1.792   1.526
  772   HD21  LEU  36          HD21      LEU  36  -4.470  -0.412  -0.355
  773   HD22  LEU  36          HD22      LEU  36  -2.791  -0.386   0.189
  774   HD23  LEU  36          HD23      LEU  36  -3.334   0.729  -1.067
  775    H    ARG  37           H        ARG  37  -6.526   0.560   4.272
  776    HA   ARG  37           HA       ARG  37  -5.707  -1.214   6.309
  777    HB2  ARG  37           HB2      ARG  37  -7.906   0.863   6.235
  778    HB3  ARG  37           HB3      ARG  37  -7.459  -0.019   7.697
  779    HG2  ARG  37           HG2      ARG  37  -5.178   0.886   7.591
  780    HG3  ARG  37           HG3      ARG  37  -5.554   1.709   6.072
  781    HD2  ARG  37           HD2      ARG  37  -5.620   3.247   7.952
  782    HD3  ARG  37           HD3      ARG  37  -7.210   3.091   7.213
  783    HE   ARG  37           HE       ARG  37  -6.663   1.440   9.562
  784   HH11  ARG  37          HH11      ARG  37  -8.195   4.307   8.368
  785   HH12  ARG  37          HH12      ARG  37  -9.191   4.465   9.768
  786   HH21  ARG  37          HH21      ARG  37  -7.959   1.698  11.324
  787   HH22  ARG  37          HH22      ARG  37  -9.047   3.040  11.405
  788    H    GLU  38           H        GLU  38  -8.388  -1.499   4.069
  789    HA   GLU  38           HA       GLU  38  -9.937  -3.327   5.768
  790    HB2  GLU  38           HB2      GLU  38 -10.338  -2.388   2.892
  791    HB3  GLU  38           HB3      GLU  38 -11.410  -3.536   3.690
  792    HG2  GLU  38           HG2      GLU  38 -12.047  -1.860   5.355
  793    HG3  GLU  38           HG3      GLU  38 -10.900  -0.709   4.676
  794    H    LEU  39           H        LEU  39  -7.732  -3.506   3.007
  795    HA   LEU  39           HA       LEU  39  -8.181  -6.377   2.601
  796    HB2  LEU  39           HB2      LEU  39  -6.357  -4.485   1.085
  797    HB3  LEU  39           HB3      LEU  39  -6.772  -6.124   0.613
  798    HG   LEU  39           HG       LEU  39  -8.673  -3.745   0.685
  799   HD11  LEU  39          HD11      LEU  39  -8.750  -3.962  -1.762
  800   HD12  LEU  39          HD12      LEU  39  -7.562  -5.267  -1.692
  801   HD13  LEU  39          HD13      LEU  39  -7.111  -3.634  -1.198
  802   HD21  LEU  39          HD21      LEU  39  -9.896  -5.784   1.309
  803   HD22  LEU  39          HD22      LEU  39  -9.292  -6.604  -0.136
  804   HD23  LEU  39          HD23      LEU  39 -10.377  -5.222  -0.290
  805    H    VAL  40           H        VAL  40  -6.020  -4.427   4.396
  806    HA   VAL  40           HA       VAL  40  -3.936  -6.523   4.535
  807    HB   VAL  40           HB       VAL  40  -3.927  -3.728   5.779
  808   HG11  VAL  40          HG11      VAL  40  -2.497  -5.272   7.057
  809   HG12  VAL  40          HG12      VAL  40  -1.508  -4.098   6.191
  810   HG13  VAL  40          HG13      VAL  40  -1.652  -5.749   5.583
  811   HG21  VAL  40          HG21      VAL  40  -2.523  -4.729   3.265
  812   HG22  VAL  40          HG22      VAL  40  -2.295  -3.137   4.003
  813   HG23  VAL  40          HG23      VAL  40  -3.870  -3.583   3.347
  814    HA   PRO  41           HA       PRO  41  -6.015  -7.658   8.522
  815    HB2  PRO  41           HB2      PRO  41  -5.263 -10.265   8.594
  816    HB3  PRO  41           HB3      PRO  41  -6.571  -9.707   7.540
  817    HG2  PRO  41           HG2      PRO  41  -3.699 -10.292   6.848
  818    HG3  PRO  41           HG3      PRO  41  -5.175 -10.728   5.960
  819    HD2  PRO  41           HD2      PRO  41  -3.579  -8.556   5.327
  820    HD3  PRO  41           HD3      PRO  41  -5.308  -8.653   4.930
  821    H    GLY  42           H        GLY  42  -2.768  -7.309   7.600
  822    HA2  GLY  42           HA2      GLY  42  -1.409  -8.105   9.998
  823    HA3  GLY  42           HA3      GLY  42  -0.780  -7.062   8.737
  824    H    VAL  43           H        VAL  43  -3.384  -5.384   9.297
  825    HA   VAL  43           HA       VAL  43  -2.309  -3.395  10.979
  826    HB   VAL  43           HB       VAL  43  -5.217  -3.914  10.193
  827   HG11  VAL  43          HG11      VAL  43  -5.209  -2.490  12.183
  828   HG12  VAL  43          HG12      VAL  43  -5.672  -1.538  10.774
  829   HG13  VAL  43          HG13      VAL  43  -4.042  -1.394  11.438
  830   HG21  VAL  43          HG21      VAL  43  -4.858  -2.166   8.480
  831   HG22  VAL  43          HG22      VAL  43  -3.743  -3.516   8.260
  832   HG23  VAL  43          HG23      VAL  43  -3.170  -2.008   8.978
  833    HA   PRO  44           HA       PRO  44  -3.088  -5.524  14.968
  834    HB2  PRO  44           HB2      PRO  44  -2.122  -3.004  16.233
  835    HB3  PRO  44           HB3      PRO  44  -1.463  -4.642  16.351
  836    HG2  PRO  44           HG2      PRO  44  -0.192  -2.718  14.952
  837    HG3  PRO  44           HG3      PRO  44  -0.191  -4.409  14.406
  838    HD2  PRO  44           HD2      PRO  44  -1.904  -2.106  13.430
  839    HD3  PRO  44           HD3      PRO  44  -1.023  -3.333  12.486
  840    H    ARG  45           H        ARG  45  -4.718  -5.470  16.509
  841    HA   ARG  45           HA       ARG  45  -7.008  -3.808  15.941
  842    HB2  ARG  45           HB2      ARG  45  -6.636  -5.955  18.079
  843    HB3  ARG  45           HB3      ARG  45  -8.163  -5.172  17.694
  844    HG2  ARG  45           HG2      ARG  45  -8.304  -7.238  16.583
  845    HG3  ARG  45           HG3      ARG  45  -7.850  -6.112  15.308
  846    HD2  ARG  45           HD2      ARG  45  -5.477  -6.835  15.550
  847    HD3  ARG  45           HD3      ARG  45  -5.981  -8.011  16.771
  848    HE   ARG  45           HE       ARG  45  -7.018  -8.081  14.004
  849   HH11  ARG  45          HH11      ARG  45  -5.529  -9.746  16.645
  850   HH12  ARG  45          HH12      ARG  45  -5.513 -11.255  15.808
  851   HH21  ARG  45          HH21      ARG  45  -6.996 -10.010  12.979
  852   HH22  ARG  45          HH22      ARG  45  -6.349 -11.408  13.763
  853    H    GLY  46           H        GLY  46  -7.757  -2.083  17.086
  854    HA2  GLY  46           HA2      GLY  46  -8.014  -0.530  18.783
  855    HA3  GLY  46           HA3      GLY  46  -6.893  -1.432  19.788
  856    H    THR  47           H        THR  47  -5.047  -1.173  17.168
  857    HA   THR  47           HA       THR  47  -3.600   1.153  18.159
  858    HB   THR  47           HB       THR  47  -2.927  -0.712  15.834
  859    HG1  THR  47           HG1      THR  47  -2.980  -1.360  18.308
  860   HG21  THR  47          HG21      THR  47  -0.601   0.129  16.107
  861   HG22  THR  47          HG22      THR  47  -1.165   1.281  17.315
  862   HG23  THR  47          HG23      THR  47  -1.703   1.428  15.642
  863    H    GLN  48           H        GLN  48  -4.188   3.148  17.477
  864    HA   GLN  48           HA       GLN  48  -5.508   3.700  14.976
  865    HB2  GLN  48           HB2      GLN  48  -5.943   5.054  17.000
  866    HB3  GLN  48           HB3      GLN  48  -4.270   5.605  17.006
  867    HG2  GLN  48           HG2      GLN  48  -4.661   6.743  14.818
  868    HG3  GLN  48           HG3      GLN  48  -6.340   6.201  14.854
  869   HE21  GLN  48          HE21      GLN  48  -7.766   7.161  16.366
  870   HE22  GLN  48          HE22      GLN  48  -7.404   8.670  17.123
  871    H    LEU  49           H        LEU  49  -4.526   3.915  13.076
  872    HA   LEU  49           HA       LEU  49  -1.615   4.435  12.894
  873    HB2  LEU  49           HB2      LEU  49  -3.497   3.213  10.839
  874    HB3  LEU  49           HB3      LEU  49  -1.762   3.417  10.645
  875    HG   LEU  49           HG       LEU  49  -3.111   1.605  12.682
  876   HD11  LEU  49          HD11      LEU  49  -3.317   0.734  10.409
  877   HD12  LEU  49          HD12      LEU  49  -2.216  -0.257  11.361
  878   HD13  LEU  49          HD13      LEU  49  -1.572   0.880  10.173
  879   HD21  LEU  49          HD21      LEU  49  -1.012   2.489  13.598
  880   HD22  LEU  49          HD22      LEU  49  -0.140   1.997  12.142
  881   HD23  LEU  49          HD23      LEU  49  -0.841   0.779  13.210
  882    H    SER  50           H        SER  50  -0.927   6.322  12.095
  883    HA   SER  50           HA       SER  50  -2.647   8.233  10.743
  884    HB2  SER  50           HB2      SER  50  -0.805   8.992  12.225
  885    HB3  SER  50           HB3      SER  50   0.382   8.262  11.146
  886    HG   SER  50           HG       SER  50   0.279  10.392  10.594
  887    H    GLN  51           H        GLN  51  -1.726   9.267   8.631
  888    HA   GLN  51           HA       GLN  51  -2.158   7.700   6.426
  889    HB2  GLN  51           HB2      GLN  51  -0.359  10.141   6.655
  890    HB3  GLN  51           HB3      GLN  51  -0.926   9.491   5.127
  891    HG2  GLN  51           HG2      GLN  51  -2.766  10.546   7.291
  892    HG3  GLN  51           HG3      GLN  51  -2.148  11.518   5.955
  893   HE21  GLN  51          HE21      GLN  51  -4.057  11.902   4.936
  894   HE22  GLN  51          HE22      GLN  51  -5.040  10.679   4.230
  895    H    VAL  52           H        VAL  52   1.021   8.500   7.782
  896    HA   VAL  52           HA       VAL  52   2.565   7.123   5.794
  897    HB   VAL  52           HB       VAL  52   3.553   7.996   8.550
  898   HG11  VAL  52          HG11      VAL  52   5.729   8.260   7.395
  899   HG12  VAL  52          HG12      VAL  52   4.994   7.708   5.887
  900   HG13  VAL  52          HG13      VAL  52   5.128   6.604   7.260
  901   HG21  VAL  52          HG21      VAL  52   4.092  10.193   7.573
  902   HG22  VAL  52          HG22      VAL  52   2.356   9.887   7.504
  903   HG23  VAL  52          HG23      VAL  52   3.340   9.716   6.045
  904    H    GLU  53           H        GLU  53   1.518   6.366   9.103
  905    HA   GLU  53           HA       GLU  53   2.923   3.975   9.579
  906    HB2  GLU  53           HB2      GLU  53   0.159   4.762  10.612
  907    HB3  GLU  53           HB3      GLU  53   1.189   3.519  11.309
  908    HG2  GLU  53           HG2      GLU  53   1.838   6.481  11.197
  909    HG3  GLU  53           HG3      GLU  53   1.217   5.616  12.600
  910    H    ILE  54           H        ILE  54  -0.146   4.546   7.912
  911    HA   ILE  54           HA       ILE  54  -0.985   1.917   7.378
  912    HB   ILE  54           HB       ILE  54  -1.236   4.420   5.638
  913   HG12  ILE  54          HG12      ILE  54  -3.288   3.193   7.556
  914   HG13  ILE  54          HG13      ILE  54  -2.283   4.590   7.925
  915   HG21  ILE  54          HG21      ILE  54  -2.825   1.830   5.379
  916   HG22  ILE  54          HG22      ILE  54  -1.589   2.398   4.258
  917   HG23  ILE  54          HG23      ILE  54  -3.087   3.308   4.443
  918   HD11  ILE  54          HD11      ILE  54  -4.382   4.436   5.767
  919   HD12  ILE  54          HD12      ILE  54  -3.369   5.841   6.114
  920   HD13  ILE  54          HD13      ILE  54  -4.522   5.262   7.317
  921    H    LEU  55           H        LEU  55   1.045   4.077   5.355
  922    HA   LEU  55           HA       LEU  55   1.586   2.274   3.261
  923    HB2  LEU  55           HB2      LEU  55   3.240   4.644   4.200
  924    HB3  LEU  55           HB3      LEU  55   3.392   3.857   2.636
  925    HG   LEU  55           HG       LEU  55   0.942   5.379   3.616
  926   HD11  LEU  55          HD11      LEU  55   1.525   7.052   1.920
  927   HD12  LEU  55          HD12      LEU  55   2.983   6.149   1.510
  928   HD13  LEU  55          HD13      LEU  55   2.814   6.874   3.110
  929   HD21  LEU  55          HD21      LEU  55   0.054   5.086   1.331
  930   HD22  LEU  55          HD22      LEU  55   0.268   3.537   2.138
  931   HD23  LEU  55          HD23      LEU  55   1.431   4.059   0.918
  932    H    GLN  56           H        GLN  56   3.413   2.950   6.215
  933    HA   GLN  56           HA       GLN  56   5.702   1.393   5.836
  934    HB2  GLN  56           HB2      GLN  56   4.138   2.006   8.377
  935    HB3  GLN  56           HB3      GLN  56   5.719   1.229   8.382
  936    HG2  GLN  56           HG2      GLN  56   6.790   3.205   7.523
  937    HG3  GLN  56           HG3      GLN  56   5.238   3.969   7.178
  938   HE21  GLN  56          HE21      GLN  56   5.953   5.760   8.450
  939   HE22  GLN  56          HE22      GLN  56   5.878   5.703  10.174
  940    H    ARG  57           H        ARG  57   2.574   0.459   7.314
  941    HA   ARG  57           HA       ARG  57   3.358  -2.288   7.743
  942    HB2  ARG  57           HB2      ARG  57   0.648  -0.949   8.019
  943    HB3  ARG  57           HB3      ARG  57   1.026  -2.592   8.546
  944    HG2  ARG  57           HG2      ARG  57   2.770  -1.651  10.077
  945    HG3  ARG  57           HG3      ARG  57   2.254  -0.031   9.609
  946    HD2  ARG  57           HD2      ARG  57   0.005  -0.495  10.499
  947    HD3  ARG  57           HD3      ARG  57   0.526  -2.113  10.986
  948    HE   ARG  57           HE       ARG  57   1.348   0.444  12.173
  949   HH11  ARG  57          HH11      ARG  57   1.623  -2.990  12.227
  950   HH12  ARG  57          HH12      ARG  57   2.245  -3.022  13.835
  951   HH21  ARG  57          HH21      ARG  57   2.151   0.384  14.233
  952   HH22  ARG  57          HH22      ARG  57   2.543  -1.136  14.952
  953    H    VAL  58           H        VAL  58   1.814  -0.610   5.105
  954    HA   VAL  58           HA       VAL  58   0.914  -2.925   3.696
  955    HB   VAL  58           HB       VAL  58   1.786  -0.189   2.640
  956   HG11  VAL  58          HG11      VAL  58   0.709  -0.818   0.493
  957   HG12  VAL  58          HG12      VAL  58   0.446  -2.454   1.105
  958   HG13  VAL  58          HG13      VAL  58   2.087  -1.855   0.861
  959   HG21  VAL  58          HG21      VAL  58  -0.260  -0.130   4.025
  960   HG22  VAL  58          HG22      VAL  58  -1.003  -1.373   3.021
  961   HG23  VAL  58          HG23      VAL  58  -0.645   0.217   2.340
  962    H    ILE  59           H        ILE  59   4.031  -1.125   3.694
  963    HA   ILE  59           HA       ILE  59   5.520  -2.758   1.953
  964    HB   ILE  59           HB       ILE  59   6.450  -1.215   4.422
  965   HG12  ILE  59          HG12      ILE  59   6.612  -0.437   1.469
  966   HG13  ILE  59          HG13      ILE  59   5.400   0.161   2.594
  967   HG21  ILE  59          HG21      ILE  59   8.178  -2.370   2.201
  968   HG22  ILE  59          HG22      ILE  59   8.141  -2.916   3.877
  969   HG23  ILE  59          HG23      ILE  59   8.746  -1.307   3.490
  970   HD11  ILE  59          HD11      ILE  59   7.167   1.231   3.914
  971   HD12  ILE  59          HD12      ILE  59   7.136   1.791   2.243
  972   HD13  ILE  59          HD13      ILE  59   8.367   0.642   2.759
  973    H    ASP  60           H        ASP  60   5.168  -3.012   5.520
  974    HA   ASP  60           HA       ASP  60   6.608  -5.385   5.955
  975    HB2  ASP  60           HB2      ASP  60   4.258  -4.259   7.533
  976    HB3  ASP  60           HB3      ASP  60   5.313  -5.545   8.109
  977    H    TYR  61           H        TYR  61   3.209  -4.937   5.129
  978    HA   TYR  61           HA       TYR  61   2.219  -7.554   5.328
  979    HB2  TYR  61           HB2      TYR  61   0.712  -5.676   5.041
  980    HB3  TYR  61           HB3      TYR  61   1.475  -5.216   3.530
  981    HD1  TYR  61           HD1      TYR  61  -0.657  -7.892   5.080
  982    HD2  TYR  61           HD2      TYR  61   0.594  -6.008   1.444
  983    HE1  TYR  61           HE1      TYR  61  -2.384  -9.118   3.845
  984    HE2  TYR  61           HE2      TYR  61  -1.144  -7.243   0.218
  985    HH   TYR  61           HH       TYR  61  -3.671  -8.882   1.800
  986    H    ILE  62           H        ILE  62   3.720  -5.894   2.560
  987    HA   ILE  62           HA       ILE  62   3.535  -8.066   0.704
  988    HB   ILE  62           HB       ILE  62   5.362  -5.604   0.623
  989   HG12  ILE  62          HG12      ILE  62   2.590  -5.933  -0.643
  990   HG13  ILE  62          HG13      ILE  62   2.892  -5.052   0.843
  991   HG21  ILE  62          HG21      ILE  62   4.439  -7.431  -1.634
  992   HG22  ILE  62          HG22      ILE  62   6.078  -7.309  -0.993
  993   HG23  ILE  62          HG23      ILE  62   5.364  -5.942  -1.843
  994   HD11  ILE  62          HD11      ILE  62   4.282  -3.452  -0.390
  995   HD12  ILE  62          HD12      ILE  62   2.640  -3.547  -1.030
  996   HD13  ILE  62          HD13      ILE  62   3.964  -4.340  -1.883
  997    H    LEU  63           H        LEU  63   6.101  -6.899   2.870
  998    HA   LEU  63           HA       LEU  63   8.187  -8.658   2.048
  999    HB2  LEU  63           HB2      LEU  63   7.748  -7.086   4.611
 1000    HB3  LEU  63           HB3      LEU  63   9.209  -8.006   4.293
 1001    HG   LEU  63           HG       LEU  63   8.241  -5.640   2.635
 1002   HD11  LEU  63          HD11      LEU  63   9.009  -4.913   4.835
 1003   HD12  LEU  63          HD12      LEU  63  10.158  -4.420   3.594
 1004   HD13  LEU  63          HD13      LEU  63  10.523  -5.801   4.632
 1005   HD21  LEU  63          HD21      LEU  63  10.820  -7.247   2.388
 1006   HD22  LEU  63          HD22      LEU  63  10.429  -5.781   1.484
 1007   HD23  LEU  63          HD23      LEU  63   9.478  -7.244   1.236
 1008    H    ASP  64           H        ASP  64   5.635  -8.948   4.474
 1009    HA   ASP  64           HA       ASP  64   6.538 -11.226   5.884
 1010    HB2  ASP  64           HB2      ASP  64   4.781  -9.735   6.744
 1011    HB3  ASP  64           HB3      ASP  64   3.724 -10.154   5.403
 1012    H    LEU  65           H        LEU  65   4.651 -10.863   2.932
 1013    HA   LEU  65           HA       LEU  65   3.948 -13.625   2.568
 1014    HB2  LEU  65           HB2      LEU  65   4.049 -11.377   0.516
 1015    HB3  LEU  65           HB3      LEU  65   3.192 -12.902   0.337
 1016    HG   LEU  65           HG       LEU  65   2.523 -10.722   2.348
 1017   HD11  LEU  65          HD11      LEU  65   1.947 -10.063   0.068
 1018   HD12  LEU  65          HD12      LEU  65   0.498 -10.346   1.031
 1019   HD13  LEU  65          HD13      LEU  65   1.024 -11.553  -0.146
 1020   HD21  LEU  65          HD21      LEU  65   1.081 -13.343   1.836
 1021   HD22  LEU  65          HD22      LEU  65   0.528 -12.047   2.898
 1022   HD23  LEU  65          HD23      LEU  65   2.007 -12.923   3.282
 1023    H    GLN  66           H        GLN  66   6.511 -11.543   1.341
 1024    HA   GLN  66           HA       GLN  66   7.680 -13.664  -0.324
 1025    HB2  GLN  66           HB2      GLN  66   8.370 -10.710  -0.054
 1026    HB3  GLN  66           HB3      GLN  66   9.156 -11.822  -1.173
 1027    HG2  GLN  66           HG2      GLN  66   6.983 -12.190  -2.318
 1028    HG3  GLN  66           HG3      GLN  66   6.219 -11.041  -1.214
 1029   HE21  GLN  66          HE21      GLN  66   6.799  -8.839  -1.379
 1030   HE22  GLN  66          HE22      GLN  66   7.470  -8.180  -2.828
 1031    H    VAL  67           H        VAL  67  10.270 -13.310  -0.403
 1032    HA   VAL  67           HA       VAL  67  11.328 -14.400   1.998
 1033    HB   VAL  67           HB       VAL  67  13.556 -14.269   0.839
 1034   HG11  VAL  67          HG11      VAL  67  13.022 -15.906  -0.938
 1035   HG12  VAL  67          HG12      VAL  67  11.312 -15.482  -0.822
 1036   HG13  VAL  67          HG13      VAL  67  12.128 -16.243   0.546
 1037   HG21  VAL  67          HG21      VAL  67  13.228 -12.202  -0.477
 1038   HG22  VAL  67          HG22      VAL  67  11.996 -12.998  -1.458
 1039   HG23  VAL  67          HG23      VAL  67  13.673 -13.545  -1.528
 1040    H    VAL  68           H        VAL  68  12.309 -13.497   3.690
 1041    HA   VAL  68           HA       VAL  68  13.543 -10.827   3.564
 1042    HB   VAL  68           HB       VAL  68  12.604 -10.358   5.969
 1043   HG11  VAL  68          HG11      VAL  68  10.608  -9.217   5.064
 1044   HG12  VAL  68          HG12      VAL  68  10.740 -10.152   3.573
 1045   HG13  VAL  68          HG13      VAL  68  12.007  -9.006   4.009
 1046   HG21  VAL  68          HG21      VAL  68  11.595 -12.572   6.388
 1047   HG22  VAL  68          HG22      VAL  68  10.484 -12.342   5.036
 1048   HG23  VAL  68          HG23      VAL  68  10.369 -11.305   6.461
  Start of MODEL   20
    1    H1   MET   1           H1       MET   1  49.419  34.312  22.634
    2    H2   MET   1           H2       MET   1  48.011  34.739  21.808
    3    H3   MET   1           H3       MET   1  49.033  33.553  21.175
    4    HA   MET   1           HA       MET   1  47.525  33.359  23.710
    5    HB2  MET   1           HB2      MET   1  47.010  32.088  20.985
    6    HB3  MET   1           HB3      MET   1  46.207  31.563  22.462
    7    HG2  MET   1           HG2      MET   1  45.233  33.827  22.718
    8    HG3  MET   1           HG3      MET   1  45.994  34.309  21.198
    9    HE1  MET   1           HE1      MET   1  43.488  35.090  20.405
   10    HE2  MET   1           HE2      MET   1  42.820  34.493  21.926
   11    HE3  MET   1           HE3      MET   1  42.114  33.986  20.394
   12    H    GLY   2           H        GLY   2  48.218  31.803  25.073
   13    HA2  GLY   2           HA2      GLY   2  49.041  29.649  25.647
   14    HA3  GLY   2           HA3      GLY   2  49.933  29.583  24.135
   15    H    HIS   3           H        HIS   3  50.691  29.324  27.100
   16    HA   HIS   3           HA       HIS   3  52.975  31.238  27.122
   17    HB2  HIS   3           HB2      HIS   3  51.508  29.947  29.460
   18    HB3  HIS   3           HB3      HIS   3  53.004  30.864  29.628
   19    HD2  HIS   3           HD2      HIS   3  49.204  31.467  28.979
   20    HE1  HIS   3           HE1      HIS   3  51.122  35.189  29.564
   21    HE2  HIS   3           HE2      HIS   3  48.928  34.035  29.084
   22    H    HIS   4           H        HIS   4  55.033  30.455  27.635
   23    HA   HIS   4           HA       HIS   4  55.611  27.798  26.733
   24    HB2  HIS   4           HB2      HIS   4  57.432  29.939  27.904
   25    HB3  HIS   4           HB3      HIS   4  58.003  28.427  27.204
   26    HD2  HIS   4           HD2      HIS   4  56.448  31.839  26.047
   27    HE1  HIS   4           HE1      HIS   4  57.953  29.762  22.685
   28    HE2  HIS   4           HE2      HIS   4  57.210  32.001  23.577
   29    H    HIS   5           H        HIS   5  54.552  26.435  28.239
   30    HA   HIS   5           HA       HIS   5  55.922  26.071  30.849
   31    HB2  HIS   5           HB2      HIS   5  53.226  25.029  29.880
   32    HB3  HIS   5           HB3      HIS   5  53.952  24.613  31.430
   33    HD2  HIS   5           HD2      HIS   5  54.490  27.091  33.027
   34    HE1  HIS   5           HE1      HIS   5  51.010  28.861  31.421
   35    HE2  HIS   5           HE2      HIS   5  52.634  28.865  33.348
   36    H    HIS   6           H        HIS   6  57.044  24.219  31.240
   37    HA   HIS   6           HA       HIS   6  57.898  22.635  28.988
   38    HB2  HIS   6           HB2      HIS   6  59.478  21.606  30.617
   39    HB3  HIS   6           HB3      HIS   6  59.549  23.364  30.638
   40    HD2  HIS   6           HD2      HIS   6  59.542  20.618  33.114
   41    HE1  HIS   6           HE1      HIS   6  57.625  23.831  35.073
   42    HE2  HIS   6           HE2      HIS   6  58.521  21.484  35.331
   43    H    HIS   7           H        HIS   7  56.932  20.819  28.314
   44    HA   HIS   7           HA       HIS   7  55.505  19.029  30.200
   45    HB2  HIS   7           HB2      HIS   7  54.677  19.733  27.344
   46    HB3  HIS   7           HB3      HIS   7  53.880  18.529  28.357
   47    HD2  HIS   7           HD2      HIS   7  52.866  19.824  30.884
   48    HE1  HIS   7           HE1      HIS   7  52.005  23.349  28.711
   49    HE2  HIS   7           HE2      HIS   7  51.691  22.131  30.904
   50    H    HIS   8           H        HIS   8  56.305  17.026  30.215
   51    HA   HIS   8           HA       HIS   8  58.015  16.070  27.970
   52    HB2  HIS   8           HB2      HIS   8  59.320  16.658  30.004
   53    HB3  HIS   8           HB3      HIS   8  58.337  15.558  30.957
   54    HD2  HIS   8           HD2      HIS   8  60.716  15.145  27.814
   55    HE1  HIS   8           HE1      HIS   8  61.199  11.876  30.447
   56    HE2  HIS   8           HE2      HIS   8  61.792  12.827  28.186
   57    H    SER   9           H        SER   9  56.240  15.021  26.978
   58    HA   SER   9           HA       SER   9  55.679  12.346  27.808
   59    HB2  SER   9           HB2      SER   9  53.208  12.544  28.100
   60    HB3  SER   9           HB3      SER   9  54.064  13.480  29.324
   61    HG   SER   9           HG       SER   9  52.941  15.113  28.641
   62    H    HIS  10           H        HIS  10  54.644  11.104  26.172
   63    HA   HIS  10           HA       HIS  10  54.645  12.219  23.466
   64    HB2  HIS  10           HB2      HIS  10  54.131   9.381  24.458
   65    HB3  HIS  10           HB3      HIS  10  54.268   9.847  22.762
   66    HD1  HIS  10           HD1      HIS  10  56.364   9.560  25.900
   67    HD2  HIS  10           HD2      HIS  10  56.885  10.036  21.811
   68    HE1  HIS  10           HE1      HIS  10  58.810   9.284  25.510
   69    HE2  HIS  10           HE2      HIS  10  59.124   9.706  23.052
   70    H    MET  11           H        MET  11  52.856  12.966  22.482
   71    HA   MET  11           HA       MET  11  50.280  12.902  23.827
   72    HB2  MET  11           HB2      MET  11  51.109  14.303  21.249
   73    HB3  MET  11           HB3      MET  11  49.617  14.595  22.135
   74    HG2  MET  11           HG2      MET  11  50.853  15.529  24.004
   75    HG3  MET  11           HG3      MET  11  52.389  15.101  23.243
   76    HE1  MET  11           HE1      MET  11  53.337  17.546  23.497
   77    HE2  MET  11           HE2      MET  11  51.852  18.046  24.311
   78    HE3  MET  11           HE3      MET  11  52.479  18.992  22.964
   79    H    GLY  12           H        GLY  12  48.533  11.694  23.265
   80    HA2  GLY  12           HA2      GLY  12  48.806   9.627  21.221
   81    HA3  GLY  12           HA3      GLY  12  47.545   9.755  22.431
   82    H    GLY  13           H        GLY  13  48.251  10.129  19.151
   83    HA2  GLY  13           HA2      GLY  13  46.172  12.029  18.452
   84    HA3  GLY  13           HA3      GLY  13  47.143  11.070  17.347
   85    H    GLY  14           H        GLY  14  44.370  10.915  19.573
   86    HA2  GLY  14           HA2      GLY  14  43.428   8.331  18.676
   87    HA3  GLY  14           HA3      GLY  14  42.608   9.435  19.764
   88    H    LYS  15           H        LYS  15  40.993   8.163  18.150
   89    HA   LYS  15           HA       LYS  15  40.467   9.468  15.618
   90    HB2  LYS  15           HB2      LYS  15  38.779   7.513  17.234
   91    HB3  LYS  15           HB3      LYS  15  38.448   7.998  15.574
   92    HG2  LYS  15           HG2      LYS  15  40.548   6.942  14.832
   93    HG3  LYS  15           HG3      LYS  15  40.923   6.498  16.498
   94    HD2  LYS  15           HD2      LYS  15  38.916   5.044  16.573
   95    HD3  LYS  15           HD3      LYS  15  38.514   5.503  14.916
   96    HE2  LYS  15           HE2      LYS  15  41.024   4.018  15.766
   97    HE3  LYS  15           HE3      LYS  15  39.591   3.282  15.044
   98    HZ1  LYS  15           HZ1      LYS  15  39.959   4.650  13.068
   99    HZ2  LYS  15           HZ2      LYS  15  41.269   3.632  13.385
  100    HZ3  LYS  15           HZ3      LYS  15  41.370   5.277  13.751
  101    H    GLY  16           H        GLY  16  38.081  10.210  15.217
  102    HA2  GLY  16           HA2      GLY  16  36.936  11.742  17.479
  103    HA3  GLY  16           HA3      GLY  16  37.356  12.592  16.001
  104    HA   PRO  17           HA       PRO  17  33.054  11.604  15.007
  105    HB2  PRO  17           HB2      PRO  17  32.817  12.948  12.658
  106    HB3  PRO  17           HB3      PRO  17  32.989  13.789  14.205
  107    HG2  PRO  17           HG2      PRO  17  35.090  13.211  12.121
  108    HG3  PRO  17           HG3      PRO  17  34.783  14.721  13.007
  109    HD2  PRO  17           HD2      PRO  17  36.740  12.911  13.710
  110    HD3  PRO  17           HD3      PRO  17  35.958  14.001  14.875
  111    H    ALA  18           H        ALA  18  31.769  10.389  13.493
  112    HA   ALA  18           HA       ALA  18  33.260   8.575  11.672
  113    HB1  ALA  18           HB1      ALA  18  31.045   7.748  13.587
  114    HB2  ALA  18           HB2      ALA  18  32.764   7.410  13.796
  115    HB3  ALA  18           HB3      ALA  18  31.884   6.689  12.448
  116    H    ALA  19           H        ALA  19  29.805   9.031  12.538
  117    HA   ALA  19           HA       ALA  19  29.071  10.107   9.951
  118    HB1  ALA  19           HB1      ALA  19  28.071   7.323  10.697
  119    HB2  ALA  19           HB2      ALA  19  29.222   7.686   9.413
  120    HB3  ALA  19           HB3      ALA  19  27.561   8.267   9.293
  121    H    GLU  20           H        GLU  20  27.545  11.603  10.430
  122    HA   GLU  20           HA       GLU  20  25.486  11.079  12.494
  123    HB2  GLU  20           HB2      GLU  20  27.190  13.591  12.260
  124    HB3  GLU  20           HB3      GLU  20  25.708  13.518  13.211
  125    HG2  GLU  20           HG2      GLU  20  26.681  11.824  14.679
  126    HG3  GLU  20           HG3      GLU  20  28.132  11.752  13.683
  127    H    GLU  21           H        GLU  21  23.594  11.201  11.574
  128    HA   GLU  21           HA       GLU  21  23.049  12.737   9.164
  129    HB2  GLU  21           HB2      GLU  21  21.246  10.986  10.887
  130    HB3  GLU  21           HB3      GLU  21  20.821  11.637   9.304
  131    HG2  GLU  21           HG2      GLU  21  22.623  10.299   8.262
  132    HG3  GLU  21           HG3      GLU  21  23.077   9.671   9.844
  133    HA   PRO  22           HA       PRO  22  21.431  16.494  11.094
  134    HB2  PRO  22           HB2      PRO  22  19.145  16.265   9.128
  135    HB3  PRO  22           HB3      PRO  22  20.207  17.645   9.460
  136    HG2  PRO  22           HG2      PRO  22  20.572  16.192   7.254
  137    HG3  PRO  22           HG3      PRO  22  21.982  16.737   8.195
  138    HD2  PRO  22           HD2      PRO  22  20.679  14.010   8.131
  139    HD3  PRO  22           HD3      PRO  22  22.408  14.424   8.151
  140    H    LEU  23           H        LEU  23  20.297  16.710  12.967
  141    HA   LEU  23           HA       LEU  23  18.408  14.770  13.898
  142    HB2  LEU  23           HB2      LEU  23  19.136  17.465  15.116
  143    HB3  LEU  23           HB3      LEU  23  18.334  16.143  15.946
  144    HG   LEU  23           HG       LEU  23  21.203  16.101  14.926
  145   HD11  LEU  23          HD11      LEU  23  21.878  16.150  17.287
  146   HD12  LEU  23          HD12      LEU  23  20.190  16.301  17.780
  147   HD13  LEU  23          HD13      LEU  23  20.960  17.592  16.853
  148   HD21  LEU  23          HD21      LEU  23  21.438  13.956  16.116
  149   HD22  LEU  23          HD22      LEU  23  20.220  13.850  14.848
  150   HD23  LEU  23          HD23      LEU  23  19.722  13.990  16.534
  151    H    SER  24           H        SER  24  16.881  15.012  12.132
  152    HA   SER  24           HA       SER  24  14.658  16.792  12.593
  153    HB2  SER  24           HB2      SER  24  16.293  17.062  10.016
  154    HB3  SER  24           HB3      SER  24  14.683  17.751  10.246
  155    HG   SER  24           HG       SER  24  15.991  18.654  12.261
  156    H    LEU  25           H        LEU  25  12.819  16.244  11.178
  157    HA   LEU  25           HA       LEU  25  12.542  13.456  10.661
  158    HB2  LEU  25           HB2      LEU  25  10.311  13.869  10.009
  159    HB3  LEU  25           HB3      LEU  25  10.648  15.027  11.279
  160    HG   LEU  25           HG       LEU  25  10.611  15.716   8.307
  161   HD11  LEU  25          HD11      LEU  25   8.445  16.179  10.377
  162   HD12  LEU  25          HD12      LEU  25   8.377  15.044   9.028
  163   HD13  LEU  25          HD13      LEU  25   8.430  16.778   8.715
  164   HD21  LEU  25          HD21      LEU  25  10.678  17.563  10.721
  165   HD22  LEU  25          HD22      LEU  25  10.547  18.070   9.037
  166   HD23  LEU  25          HD23      LEU  25  12.012  17.271   9.599
  167    H    LEU  26           H        LEU  26  12.393  12.319   8.720
  168    HA   LEU  26           HA       LEU  26  13.590  13.558   6.319
  169    HB2  LEU  26           HB2      LEU  26  13.206  10.626   7.043
  170    HB3  LEU  26           HB3      LEU  26  13.857  11.197   5.516
  171    HG   LEU  26           HG       LEU  26  15.668  12.401   7.005
  172   HD11  LEU  26          HD11      LEU  26  14.782  10.272   8.970
  173   HD12  LEU  26          HD12      LEU  26  14.652  12.018   9.181
  174   HD13  LEU  26          HD13      LEU  26  16.240  11.264   9.101
  175   HD21  LEU  26          HD21      LEU  26  17.141  10.443   6.901
  176   HD22  LEU  26          HD22      LEU  26  16.197  10.628   5.427
  177   HD23  LEU  26          HD23      LEU  26  15.748   9.397   6.608
  178    H    ASP  27           H        ASP  27  12.687  12.283   4.241
  179    HA   ASP  27           HA       ASP  27   9.852  12.890   3.999
  180    HB2  ASP  27           HB2      ASP  27  11.890  11.809   1.989
  181    HB3  ASP  27           HB3      ASP  27  10.223  12.223   1.590
  182    H    ASP  28           H        ASP  28   9.590  11.085   5.802
  183    HA   ASP  28           HA       ASP  28   9.988   8.363   5.455
  184    HB2  ASP  28           HB2      ASP  28   7.574   9.595   6.862
  185    HB3  ASP  28           HB3      ASP  28   8.265   8.001   7.168
  186    H    MET  29           H        MET  29   7.204  10.276   4.492
  187    HA   MET  29           HA       MET  29   5.550   8.219   3.490
  188    HB2  MET  29           HB2      MET  29   4.541  10.284   4.105
  189    HB3  MET  29           HB3      MET  29   5.619  11.228   3.089
  190    HG2  MET  29           HG2      MET  29   4.445  10.676   1.125
  191    HG3  MET  29           HG3      MET  29   3.689   9.264   1.857
  192    HE1  MET  29           HE1      MET  29   2.404   9.989   4.430
  193    HE2  MET  29           HE2      MET  29   1.458   9.274   3.119
  194    HE3  MET  29           HE3      MET  29   0.846  10.689   3.980
  195    H    ASN  30           H        ASN  30   7.912  10.340   1.811
  196    HA   ASN  30           HA       ASN  30   7.352   9.366  -0.829
  197    HB2  ASN  30           HB2      ASN  30   9.785  10.844   0.247
  198    HB3  ASN  30           HB3      ASN  30   9.495  10.523  -1.463
  199   HD21  ASN  30          HD21      ASN  30   9.754  13.098  -0.155
  200   HD22  ASN  30          HD22      ASN  30   8.278  13.945  -0.443
  201    H    HIS  31           H        HIS  31   9.840   8.520   1.589
  202    HA   HIS  31           HA       HIS  31  11.231   6.513   0.221
  203    HB2  HIS  31           HB2      HIS  31  10.525   6.736   3.180
  204    HB3  HIS  31           HB3      HIS  31  11.651   5.541   2.538
  205    HD2  HIS  31           HD2      HIS  31  13.939   6.524   3.655
  206    HE1  HIS  31           HE1      HIS  31  13.664  10.404   2.019
  207    HE2  HIS  31           HE2      HIS  31  15.191   8.727   3.116
  208    H    CYS  32           H        CYS  32   8.249   6.307   2.150
  209    HA   CYS  32           HA       CYS  32   7.765   3.541   1.895
  210    HB2  CYS  32           HB2      CYS  32   5.845   5.829   2.439
  211    HB3  CYS  32           HB3      CYS  32   5.396   4.123   2.535
  212    HG   CYS  32           HG       CYS  32   7.988   5.284   4.393
  213    H    TYR  33           H        TYR  33   6.570   6.283  -0.075
  214    HA   TYR  33           HA       TYR  33   4.905   4.768  -1.808
  215    HB2  TYR  33           HB2      TYR  33   5.993   7.573  -1.854
  216    HB3  TYR  33           HB3      TYR  33   5.303   6.942  -3.347
  217    HD1  TYR  33           HD1      TYR  33   2.969   5.577  -2.841
  218    HD2  TYR  33           HD2      TYR  33   4.437   8.895  -0.588
  219    HE1  TYR  33           HE1      TYR  33   0.691   6.107  -2.145
  220    HE2  TYR  33           HE2      TYR  33   2.149   9.416   0.113
  221    HH   TYR  33           HH       TYR  33  -0.094   9.050  -0.521
  222    H    SER  34           H        SER  34   8.312   5.724  -2.080
  223    HA   SER  34           HA       SER  34   8.798   4.718  -4.695
  224    HB2  SER  34           HB2      SER  34  10.737   5.039  -2.354
  225    HB3  SER  34           HB3      SER  34  11.218   4.702  -4.021
  226    HG   SER  34           HG       SER  34  10.233   7.046  -2.878
  227    H    ARG  35           H        ARG  35   9.057   3.255  -1.457
  228    HA   ARG  35           HA       ARG  35  10.052   0.728  -2.321
  229    HB2  ARG  35           HB2      ARG  35   9.900   1.989   0.122
  230    HB3  ARG  35           HB3      ARG  35   8.583   0.841   0.299
  231    HG2  ARG  35           HG2      ARG  35  11.436   0.120  -0.411
  232    HG3  ARG  35           HG3      ARG  35  10.744   0.025   1.208
  233    HD2  ARG  35           HD2      ARG  35   9.122  -1.658   0.396
  234    HD3  ARG  35           HD3      ARG  35   9.847  -1.579  -1.212
  235    HE   ARG  35           HE       ARG  35  10.925  -2.860   1.168
  236   HH11  ARG  35          HH11      ARG  35  11.692  -1.775  -2.029
  237   HH12  ARG  35          HH12      ARG  35  12.962  -2.928  -2.219
  238   HH21  ARG  35          HH21      ARG  35  12.553  -4.309   0.902
  239   HH22  ARG  35          HH22      ARG  35  13.449  -4.346  -0.575
  240    H    LEU  36           H        LEU  36   6.766   1.974  -1.824
  241    HA   LEU  36           HA       LEU  36   5.285  -0.386  -2.146
  242    HB2  LEU  36           HB2      LEU  36   4.658   2.466  -3.007
  243    HB3  LEU  36           HB3      LEU  36   3.506   1.154  -3.168
  244    HG   LEU  36           HG       LEU  36   4.619   2.221  -0.546
  245   HD11  LEU  36          HD11      LEU  36   1.840   2.470  -1.724
  246   HD12  LEU  36          HD12      LEU  36   3.023   3.768  -1.548
  247   HD13  LEU  36          HD13      LEU  36   2.334   3.010  -0.116
  248   HD21  LEU  36          HD21      LEU  36   3.029   0.707   0.574
  249   HD22  LEU  36          HD22      LEU  36   4.217  -0.193  -0.361
  250   HD23  LEU  36          HD23      LEU  36   2.579   0.011  -0.988
  251    H    ARG  37           H        ARG  37   6.313   1.988  -4.616
  252    HA   ARG  37           HA       ARG  37   5.514   0.664  -6.930
  253    HB2  ARG  37           HB2      ARG  37   6.204   3.041  -6.757
  254    HB3  ARG  37           HB3      ARG  37   7.878   2.541  -6.567
  255    HG2  ARG  37           HG2      ARG  37   7.966   1.687  -8.814
  256    HG3  ARG  37           HG3      ARG  37   6.226   1.879  -9.028
  257    HD2  ARG  37           HD2      ARG  37   6.445   4.304  -8.965
  258    HD3  ARG  37           HD3      ARG  37   8.162   4.174  -8.587
  259    HE   ARG  37           HE       ARG  37   8.364   3.059 -10.843
  260   HH11  ARG  37          HH11      ARG  37   5.895   5.404 -10.265
  261   HH12  ARG  37          HH12      ARG  37   5.760   5.824 -11.933
  262   HH21  ARG  37          HH21      ARG  37   8.184   3.650 -12.976
  263   HH22  ARG  37          HH22      ARG  37   7.040   4.864 -13.433
  264    H    GLU  38           H        GLU  38   8.313   0.046  -4.911
  265    HA   GLU  38           HA       GLU  38   9.781  -1.541  -6.848
  266    HB2  GLU  38           HB2      GLU  38  10.080  -1.351  -3.819
  267    HB3  GLU  38           HB3      GLU  38  11.160  -2.265  -4.869
  268    HG2  GLU  38           HG2      GLU  38  11.761  -0.141  -6.042
  269    HG3  GLU  38           HG3      GLU  38  10.767   0.742  -4.882
  270    H    LEU  39           H        LEU  39   7.651  -2.247  -4.074
  271    HA   LEU  39           HA       LEU  39   7.832  -5.114  -4.320
  272    HB2  LEU  39           HB2      LEU  39   5.896  -3.392  -2.736
  273    HB3  LEU  39           HB3      LEU  39   6.042  -5.137  -2.583
  274    HG   LEU  39           HG       LEU  39   8.191  -3.100  -1.865
  275   HD11  LEU  39          HD11      LEU  39   7.820  -3.776   0.457
  276   HD12  LEU  39          HD12      LEU  39   6.532  -4.869  -0.051
  277   HD13  LEU  39          HD13      LEU  39   6.341  -3.127  -0.254
  278   HD21  LEU  39          HD21      LEU  39   9.245  -5.149  -2.714
  279   HD22  LEU  39          HD22      LEU  39   8.291  -6.128  -1.596
  280   HD23  LEU  39          HD23      LEU  39   9.494  -4.994  -0.977
  281    H    VAL  40           H        VAL  40   5.938  -2.708  -5.877
  282    HA   VAL  40           HA       VAL  40   3.863  -4.616  -6.762
  283    HB   VAL  40           HB       VAL  40   3.995  -1.589  -7.190
  284   HG11  VAL  40          HG11      VAL  40   1.699  -3.518  -7.722
  285   HG12  VAL  40          HG12      VAL  40   2.646  -2.655  -8.935
  286   HG13  VAL  40          HG13      VAL  40   1.602  -1.758  -7.835
  287   HG21  VAL  40          HG21      VAL  40   3.752  -2.096  -4.819
  288   HG22  VAL  40          HG22      VAL  40   2.389  -3.177  -5.146
  289   HG23  VAL  40          HG23      VAL  40   2.237  -1.443  -5.446
  290    HA   PRO  41           HA       PRO  41   6.285  -4.770 -10.739
  291    HB2  PRO  41           HB2      PRO  41   4.813  -7.331 -11.113
  292    HB3  PRO  41           HB3      PRO  41   6.555  -7.032 -11.110
  293    HG2  PRO  41           HG2      PRO  41   5.345  -8.353  -9.079
  294    HG3  PRO  41           HG3      PRO  41   6.736  -7.282  -8.798
  295    HD2  PRO  41           HD2      PRO  41   3.791  -6.695  -8.420
  296    HD3  PRO  41           HD3      PRO  41   5.151  -6.364  -7.323
  297    H    GLY  42           H        GLY  42   2.965  -4.694  -9.865
  298    HA2  GLY  42           HA2      GLY  42   1.629  -4.695 -12.349
  299    HA3  GLY  42           HA3      GLY  42   1.065  -3.924 -10.875
  300    H    VAL  43           H        VAL  43   3.730  -2.293 -11.006
  301    HA   VAL  43           HA       VAL  43   2.839  -0.116 -12.710
  302    HB   VAL  43           HB       VAL  43   5.533  -0.357 -11.270
  303   HG11  VAL  43          HG11      VAL  43   4.042   2.108 -12.261
  304   HG12  VAL  43          HG12      VAL  43   5.485   1.398 -12.988
  305   HG13  VAL  43          HG13      VAL  43   5.572   2.114 -11.379
  306   HG21  VAL  43          HG21      VAL  43   2.966   0.865 -10.174
  307   HG22  VAL  43          HG22      VAL  43   4.550   0.921  -9.397
  308   HG23  VAL  43          HG23      VAL  43   3.733  -0.625  -9.615
  309    HA   PRO  44           HA       PRO  44   5.227  -1.903 -16.257
  310    HB2  PRO  44           HB2      PRO  44   4.100   0.437 -17.726
  311    HB3  PRO  44           HB3      PRO  44   3.990  -1.286 -18.111
  312    HG2  PRO  44           HG2      PRO  44   1.858   0.075 -17.196
  313    HG3  PRO  44           HG3      PRO  44   2.140  -1.612 -16.708
  314    HD2  PRO  44           HD2      PRO  44   2.732   0.935 -15.175
  315    HD3  PRO  44           HD3      PRO  44   1.985  -0.574 -14.598
  316    H    ARG  45           H        ARG  45   6.582  -0.605 -18.079
  317    HA   ARG  45           HA       ARG  45   8.830   0.391 -16.628
  318    HB2  ARG  45           HB2      ARG  45   8.401   0.291 -19.641
  319    HB3  ARG  45           HB3      ARG  45   9.948   0.544 -18.840
  320    HG2  ARG  45           HG2      ARG  45   8.259  -1.976 -18.752
  321    HG3  ARG  45           HG3      ARG  45   9.767  -1.754 -19.639
  322    HD2  ARG  45           HD2      ARG  45   9.453  -1.725 -16.617
  323    HD3  ARG  45           HD3      ARG  45  10.127  -3.043 -17.577
  324    HE   ARG  45           HE       ARG  45  11.645  -0.807 -18.177
  325   HH11  ARG  45          HH11      ARG  45  10.987  -2.639 -15.310
  326   HH12  ARG  45          HH12      ARG  45  12.521  -2.267 -14.604
  327   HH21  ARG  45          HH21      ARG  45  13.589  -0.352 -17.249
  328   HH22  ARG  45          HH22      ARG  45  13.977  -0.990 -15.688
  329    H    GLY  46           H        GLY  46   8.911   2.386 -15.799
  330    HA2  GLY  46           HA2      GLY  46   9.118   4.663 -15.664
  331    HA3  GLY  46           HA3      GLY  46   9.052   4.719 -17.415
  332    H    THR  47           H        THR  47   6.362   3.323 -15.680
  333    HA   THR  47           HA       THR  47   4.507   5.207 -16.786
  334    HB   THR  47           HB       THR  47   4.054   2.983 -14.749
  335    HG1  THR  47           HG1      THR  47   3.040   2.395 -17.111
  336   HG21  THR  47          HG21      THR  47   2.186   4.611 -14.671
  337   HG22  THR  47          HG22      THR  47   1.667   3.102 -15.423
  338   HG23  THR  47          HG23      THR  47   2.017   4.511 -16.426
  339    H    GLN  48           H        GLN  48   4.250   7.190 -16.002
  340    HA   GLN  48           HA       GLN  48   4.931   7.954 -13.294
  341    HB2  GLN  48           HB2      GLN  48   5.534   9.348 -15.248
  342    HB3  GLN  48           HB3      GLN  48   3.830   9.589 -15.617
  343    HG2  GLN  48           HG2      GLN  48   3.528  10.839 -13.528
  344    HG3  GLN  48           HG3      GLN  48   5.203  10.534 -13.076
  345   HE21  GLN  48          HE21      GLN  48   3.103  12.326 -15.216
  346   HE22  GLN  48          HE22      GLN  48   4.286  13.460 -15.755
  347    H    LEU  49           H        LEU  49   3.520   7.550 -11.722
  348    HA   LEU  49           HA       LEU  49   0.615   8.090 -12.076
  349    HB2  LEU  49           HB2      LEU  49   2.006   6.188 -10.144
  350    HB3  LEU  49           HB3      LEU  49   0.276   6.478 -10.191
  351    HG   LEU  49           HG       LEU  49   1.881   5.220 -12.454
  352   HD11  LEU  49          HD11      LEU  49   0.054   3.870 -10.443
  353   HD12  LEU  49          HD12      LEU  49   1.809   3.712 -10.529
  354   HD13  LEU  49          HD13      LEU  49   0.808   3.095 -11.840
  355   HD21  LEU  49          HD21      LEU  49  -0.095   6.411 -13.297
  356   HD22  LEU  49          HD22      LEU  49  -1.130   5.544 -12.158
  357   HD23  LEU  49          HD23      LEU  49  -0.305   4.666 -13.450
  358    H    SER  50           H        SER  50  -0.429   9.396 -10.535
  359    HA   SER  50           HA       SER  50   1.086  11.094  -8.764
  360    HB2  SER  50           HB2      SER  50  -1.069  11.997  -8.049
  361    HB3  SER  50           HB3      SER  50  -1.117  11.764  -9.795
  362    HG   SER  50           HG       SER  50  -2.701  10.426  -9.542
  363    H    GLN  51           H        GLN  51   0.629  11.184  -6.333
  364    HA   GLN  51           HA       GLN  51   1.291   8.818  -5.001
  365    HB2  GLN  51           HB2      GLN  51  -0.090  11.279  -3.862
  366    HB3  GLN  51           HB3      GLN  51   0.675  10.024  -2.893
  367    HG2  GLN  51           HG2      GLN  51   2.861  10.580  -3.914
  368    HG3  GLN  51           HG3      GLN  51   2.092  11.844  -4.866
  369   HE21  GLN  51          HE21      GLN  51   3.128  10.910  -1.671
  370   HE22  GLN  51          HE22      GLN  51   2.970  12.463  -0.945
  371    H    VAL  52           H        VAL  52  -1.881  10.123  -5.780
  372    HA   VAL  52           HA       VAL  52  -3.475   8.377  -4.160
  373    HB   VAL  52           HB       VAL  52  -4.478   9.561  -6.792
  374   HG11  VAL  52          HG11      VAL  52  -6.608   9.784  -5.570
  375   HG12  VAL  52          HG12      VAL  52  -5.849   9.140  -4.111
  376   HG13  VAL  52          HG13      VAL  52  -6.021   8.117  -5.541
  377   HG21  VAL  52          HG21      VAL  52  -4.985  11.706  -5.663
  378   HG22  VAL  52          HG22      VAL  52  -3.250  11.402  -5.760
  379   HG23  VAL  52          HG23      VAL  52  -4.103  11.157  -4.237
  380    H    GLU  53           H        GLU  53  -2.490   8.340  -7.589
  381    HA   GLU  53           HA       GLU  53  -3.751   5.891  -8.321
  382    HB2  GLU  53           HB2      GLU  53  -1.470   7.416  -9.629
  383    HB3  GLU  53           HB3      GLU  53  -2.299   6.045 -10.363
  384    HG2  GLU  53           HG2      GLU  53  -4.415   7.304 -10.397
  385    HG3  GLU  53           HG3      GLU  53  -3.628   8.671  -9.606
  386    H    ILE  54           H        ILE  54  -0.594   6.585  -6.892
  387    HA   ILE  54           HA       ILE  54   0.604   4.037  -7.293
  388    HB   ILE  54           HB       ILE  54   1.071   6.055  -5.039
  389   HG12  ILE  54          HG12      ILE  54   2.688   5.500  -7.586
  390   HG13  ILE  54          HG13      ILE  54   1.693   6.919  -7.282
  391   HG21  ILE  54          HG21      ILE  54   1.770   3.845  -4.249
  392   HG22  ILE  54          HG22      ILE  54   3.196   4.828  -4.563
  393   HG23  ILE  54          HG23      ILE  54   2.720   3.575  -5.716
  394   HD11  ILE  54          HD11      ILE  54   3.215   7.548  -5.432
  395   HD12  ILE  54          HD12      ILE  54   4.008   7.471  -7.006
  396   HD13  ILE  54          HD13      ILE  54   4.236   6.164  -5.845
  397    H    LEU  55           H        LEU  55  -1.301   5.384  -4.559
  398    HA   LEU  55           HA       LEU  55  -1.533   3.143  -2.922
  399    HB2  LEU  55           HB2      LEU  55  -3.622   5.271  -3.515
  400    HB3  LEU  55           HB3      LEU  55  -3.736   4.128  -2.187
  401    HG   LEU  55           HG       LEU  55  -1.562   6.230  -2.484
  402   HD11  LEU  55          HD11      LEU  55  -2.668   7.391  -0.615
  403   HD12  LEU  55          HD12      LEU  55  -3.977   6.205  -0.644
  404   HD13  LEU  55          HD13      LEU  55  -3.725   7.279  -2.022
  405   HD21  LEU  55          HD21      LEU  55  -0.753   4.250  -1.291
  406   HD22  LEU  55          HD22      LEU  55  -2.137   4.316  -0.197
  407   HD23  LEU  55          HD23      LEU  55  -0.936   5.609  -0.184
  408    H    GLN  56           H        GLN  56  -3.579   4.062  -5.676
  409    HA   GLN  56           HA       GLN  56  -5.399   1.891  -5.636
  410    HB2  GLN  56           HB2      GLN  56  -4.496   3.693  -7.918
  411    HB3  GLN  56           HB3      GLN  56  -5.882   2.606  -8.007
  412    HG2  GLN  56           HG2      GLN  56  -7.088   3.863  -6.356
  413    HG3  GLN  56           HG3      GLN  56  -5.656   4.801  -5.934
  414   HE21  GLN  56          HE21      GLN  56  -6.732   6.737  -6.312
  415   HE22  GLN  56          HE22      GLN  56  -7.101   7.301  -7.901
  416    H    ARG  57           H        ARG  57  -2.247   2.289  -7.246
  417    HA   ARG  57           HA       ARG  57  -2.352  -0.113  -8.806
  418    HB2  ARG  57           HB2      ARG  57  -0.836   1.941  -9.182
  419    HB3  ARG  57           HB3      ARG  57   0.175   1.324  -7.883
  420    HG2  ARG  57           HG2      ARG  57   1.277   0.501  -9.758
  421    HG3  ARG  57           HG3      ARG  57   0.264  -0.871  -9.327
  422    HD2  ARG  57           HD2      ARG  57  -0.244   1.148 -11.538
  423    HD3  ARG  57           HD3      ARG  57   0.227  -0.537 -11.741
  424    HE   ARG  57           HE       ARG  57  -2.400   0.381 -10.727
  425   HH11  ARG  57          HH11      ARG  57  -0.554  -2.011 -12.426
  426   HH12  ARG  57          HH12      ARG  57  -1.955  -2.937 -12.818
  427   HH21  ARG  57          HH21      ARG  57  -4.147  -0.791 -11.286
  428   HH22  ARG  57          HH22      ARG  57  -3.960  -2.257 -12.187
  429    H    VAL  58           H        VAL  58  -1.157   0.686  -5.584
  430    HA   VAL  58           HA       VAL  58  -0.026  -1.843  -4.917
  431    HB   VAL  58           HB       VAL  58  -1.095   0.360  -3.086
  432   HG11  VAL  58          HG11      VAL  58   0.675  -2.015  -2.377
  433   HG12  VAL  58          HG12      VAL  58  -0.993  -1.765  -1.865
  434   HG13  VAL  58          HG13      VAL  58   0.269  -0.678  -1.293
  435   HG21  VAL  58          HG21      VAL  58   1.257   1.050  -2.843
  436   HG22  VAL  58          HG22      VAL  58   0.768   1.103  -4.533
  437   HG23  VAL  58          HG23      VAL  58   1.767  -0.228  -3.953
  438    H    ILE  59           H        ILE  59  -3.284  -0.411  -4.451
  439    HA   ILE  59           HA       ILE  59  -4.584  -2.479  -3.091
  440    HB   ILE  59           HB       ILE  59  -5.603  -0.516  -5.191
  441   HG12  ILE  59          HG12      ILE  59  -6.094  -0.625  -2.173
  442   HG13  ILE  59          HG13      ILE  59  -4.905   0.401  -2.961
  443   HG21  ILE  59          HG21      ILE  59  -7.082  -2.459  -5.357
  444   HG22  ILE  59          HG22      ILE  59  -7.939  -1.125  -4.589
  445   HG23  ILE  59          HG23      ILE  59  -7.329  -2.459  -3.610
  446   HD11  ILE  59          HD11      ILE  59  -6.685   1.615  -4.095
  447   HD12  ILE  59          HD12      ILE  59  -6.891   1.636  -2.344
  448   HD13  ILE  59          HD13      ILE  59  -7.890   0.572  -3.332
  449    H    ASP  60           H        ASP  60  -4.198  -2.028  -6.614
  450    HA   ASP  60           HA       ASP  60  -5.441  -4.366  -7.544
  451    HB2  ASP  60           HB2      ASP  60  -4.839  -2.421  -8.958
  452    HB3  ASP  60           HB3      ASP  60  -3.132  -2.784  -8.756
  453    H    TYR  61           H        TYR  61  -2.065  -3.787  -6.585
  454    HA   TYR  61           HA       TYR  61  -0.979  -6.323  -7.219
  455    HB2  TYR  61           HB2      TYR  61   0.533  -4.490  -6.857
  456    HB3  TYR  61           HB3      TYR  61  -0.113  -4.173  -5.250
  457    HD1  TYR  61           HD1      TYR  61   1.707  -6.817  -7.213
  458    HD2  TYR  61           HD2      TYR  61   0.981  -5.128  -3.348
  459    HE1  TYR  61           HE1      TYR  61   3.385  -8.307  -6.239
  460    HE2  TYR  61           HE2      TYR  61   2.676  -6.615  -2.396
  461    HH   TYR  61           HH       TYR  61   4.865  -8.355  -4.280
  462    H    ILE  62           H        ILE  62  -2.343  -5.102  -4.118
  463    HA   ILE  62           HA       ILE  62  -1.796  -7.504  -2.665
  464    HB   ILE  62           HB       ILE  62  -3.894  -5.400  -1.926
  465   HG12  ILE  62          HG12      ILE  62  -0.956  -5.515  -1.046
  466   HG13  ILE  62          HG13      ILE  62  -1.608  -4.372  -2.212
  467   HG21  ILE  62          HG21      ILE  62  -4.120  -7.531  -0.683
  468   HG22  ILE  62          HG22      ILE  62  -3.582  -6.242   0.389
  469   HG23  ILE  62          HG23      ILE  62  -2.425  -7.442  -0.196
  470   HD11  ILE  62          HD11      ILE  62  -1.328  -3.333  -0.054
  471   HD12  ILE  62          HD12      ILE  62  -2.353  -4.547   0.707
  472   HD13  ILE  62          HD13      ILE  62  -3.041  -3.415  -0.462
  473    H    LEU  63           H        LEU  63  -4.587  -6.332  -4.542
  474    HA   LEU  63           HA       LEU  63  -6.389  -8.440  -4.082
  475    HB2  LEU  63           HB2      LEU  63  -5.957  -6.669  -6.511
  476    HB3  LEU  63           HB3      LEU  63  -7.250  -7.857  -6.442
  477    HG   LEU  63           HG       LEU  63  -6.944  -5.525  -4.507
  478   HD11  LEU  63          HD11      LEU  63  -7.524  -4.716  -6.735
  479   HD12  LEU  63          HD12      LEU  63  -8.886  -4.532  -5.634
  480   HD13  LEU  63          HD13      LEU  63  -8.880  -5.844  -6.817
  481   HD21  LEU  63          HD21      LEU  63  -9.200  -7.537  -4.794
  482   HD22  LEU  63          HD22      LEU  63  -9.196  -6.133  -3.721
  483   HD23  LEU  63          HD23      LEU  63  -8.048  -7.441  -3.459
  484    H    ASP  64           H        ASP  64  -3.637  -8.254  -6.348
  485    HA   ASP  64           HA       ASP  64  -3.921 -10.758  -7.613
  486    HB2  ASP  64           HB2      ASP  64  -2.341  -9.089  -8.434
  487    HB3  ASP  64           HB3      ASP  64  -1.420  -9.155  -6.942
  488    H    LEU  65           H        LEU  65  -2.646  -9.931  -4.435
  489    HA   LEU  65           HA       LEU  65  -1.610 -12.594  -3.852
  490    HB2  LEU  65           HB2      LEU  65  -1.940 -10.201  -2.007
  491    HB3  LEU  65           HB3      LEU  65  -0.989 -11.641  -1.680
  492    HG   LEU  65           HG       LEU  65  -0.392  -9.547  -3.808
  493   HD11  LEU  65          HD11      LEU  65   1.608  -9.037  -2.467
  494   HD12  LEU  65          HD12      LEU  65   1.086 -10.193  -1.242
  495   HD13  LEU  65          HD13      LEU  65   0.124  -8.747  -1.557
  496   HD21  LEU  65          HD21      LEU  65   1.693 -10.802  -4.252
  497   HD22  LEU  65          HD22      LEU  65   0.261 -11.753  -4.642
  498   HD23  LEU  65          HD23      LEU  65   1.156 -12.080  -3.156
  499    H    GLN  66           H        GLN  66  -4.543 -10.779  -3.193
  500    HA   GLN  66           HA       GLN  66  -5.493 -12.636  -1.128
  501    HB2  GLN  66           HB2      GLN  66  -6.888 -10.183  -2.290
  502    HB3  GLN  66           HB3      GLN  66  -7.430 -11.106  -0.896
  503    HG2  GLN  66           HG2      GLN  66  -4.856  -9.506  -1.027
  504    HG3  GLN  66           HG3      GLN  66  -6.363  -8.939  -0.316
  505   HE21  GLN  66          HE21      GLN  66  -5.453  -8.637   1.699
  506   HE22  GLN  66          HE22      GLN  66  -4.941  -9.931   2.720
  507    H    VAL  67           H        VAL  67  -6.917 -11.307  -4.132
  508    HA   VAL  67           HA       VAL  67  -8.543 -13.774  -4.476
  509    HB   VAL  67           HB       VAL  67  -9.344 -10.906  -5.188
  510   HG11  VAL  67          HG11      VAL  67 -10.973 -13.471  -5.331
  511   HG12  VAL  67          HG12      VAL  67 -10.379 -12.528  -6.699
  512   HG13  VAL  67          HG13      VAL  67 -11.597 -11.843  -5.625
  513   HG21  VAL  67          HG21      VAL  67  -9.310 -11.216  -2.745
  514   HG22  VAL  67          HG22      VAL  67 -10.339 -12.644  -2.889
  515   HG23  VAL  67          HG23      VAL  67 -10.968 -11.052  -3.327
  516    H    VAL  68           H        VAL  68  -7.682 -14.881  -6.181
  517    HA   VAL  68           HA       VAL  68  -5.989 -13.772  -8.159
  518    HB   VAL  68           HB       VAL  68  -7.464 -16.442  -8.353
  519   HG11  VAL  68          HG11      VAL  68  -6.394 -15.763 -10.459
  520   HG12  VAL  68          HG12      VAL  68  -5.569 -17.157  -9.765
  521   HG13  VAL  68          HG13      VAL  68  -4.849 -15.550  -9.630
  522   HG21  VAL  68          HG21      VAL  68  -5.512 -17.476  -7.240
  523   HG22  VAL  68          HG22      VAL  68  -6.298 -16.302  -6.185
  524   HG23  VAL  68          HG23      VAL  68  -4.790 -15.881  -6.999
  525    H1   MET   1           H1       MET   1  32.118  11.758  28.198
  526    H2   MET   1           H2       MET   1  31.333  10.995  29.486
  527    H3   MET   1           H3       MET   1  32.957  10.671  29.182
  528    HA   MET   1           HA       MET   1  32.695  12.114  31.088
  529    HB2  MET   1           HB2      MET   1  34.321  13.846  30.380
  530    HB3  MET   1           HB3      MET   1  34.747  12.261  29.755
  531    HG2  MET   1           HG2      MET   1  33.766  12.920  27.553
  532    HG3  MET   1           HG3      MET   1  33.490  14.536  28.204
  533    HE1  MET   1           HE1      MET   1  35.139  14.019  25.532
  534    HE2  MET   1           HE2      MET   1  36.554  15.046  25.758
  535    HE3  MET   1           HE3      MET   1  34.958  15.647  26.197
  536    H    GLY   2           H        GLY   2  30.334  12.649  28.911
  537    HA2  GLY   2           HA2      GLY   2  29.840  15.506  29.400
  538    HA3  GLY   2           HA3      GLY   2  28.983  14.465  28.278
  539    H    HIS   3           H        HIS   3  29.596  14.438  31.800
  540    HA   HIS   3           HA       HIS   3  26.894  13.481  32.376
  541    HB2  HIS   3           HB2      HIS   3  29.274  14.069  34.194
  542    HB3  HIS   3           HB3      HIS   3  27.744  13.390  34.750
  543    HD2  HIS   3           HD2      HIS   3  30.634  12.306  32.260
  544    HE1  HIS   3           HE1      HIS   3  28.828   8.896  33.973
  545    HE2  HIS   3           HE2      HIS   3  30.621   9.722  32.404
  546    H    HIS   4           H        HIS   4  26.404  15.777  31.271
  547    HA   HIS   4           HA       HIS   4  26.256  17.942  33.289
  548    HB2  HIS   4           HB2      HIS   4  26.159  18.077  30.241
  549    HB3  HIS   4           HB3      HIS   4  26.035  19.465  31.322
  550    HD2  HIS   4           HD2      HIS   4  28.431  20.132  32.694
  551    HE1  HIS   4           HE1      HIS   4  30.873  17.720  30.225
  552    HE2  HIS   4           HE2      HIS   4  30.830  19.628  31.882
  553    H    HIS   5           H        HIS   5  24.331  17.978  34.269
  554    HA   HIS   5           HA       HIS   5  21.885  17.028  32.992
  555    HB2  HIS   5           HB2      HIS   5  22.481  17.926  35.839
  556    HB3  HIS   5           HB3      HIS   5  20.892  17.386  35.298
  557    HD2  HIS   5           HD2      HIS   5  24.498  15.869  35.814
  558    HE1  HIS   5           HE1      HIS   5  21.631  12.763  35.708
  559    HE2  HIS   5           HE2      HIS   5  24.003  13.381  36.310
  560    H    HIS   6           H        HIS   6  22.583  19.090  31.586
  561    HA   HIS   6           HA       HIS   6  20.757  21.318  32.315
  562    HB2  HIS   6           HB2      HIS   6  23.054  21.278  30.291
  563    HB3  HIS   6           HB3      HIS   6  22.047  22.670  30.678
  564    HD2  HIS   6           HD2      HIS   6  25.071  20.687  32.131
  565    HE1  HIS   6           HE1      HIS   6  24.366  24.065  34.573
  566    HE2  HIS   6           HE2      HIS   6  25.779  21.997  34.248
  567    H    HIS   7           H        HIS   7  19.734  18.877  31.494
  568    HA   HIS   7           HA       HIS   7  19.028  19.082  28.618
  569    HB2  HIS   7           HB2      HIS   7  18.449  16.626  28.866
  570    HB3  HIS   7           HB3      HIS   7  20.144  16.998  29.134
  571    HD2  HIS   7           HD2      HIS   7  21.130  15.842  31.369
  572    HE1  HIS   7           HE1      HIS   7  17.453  15.262  33.375
  573    HE2  HIS   7           HE2      HIS   7  19.958  14.904  33.483
  574    H    HIS   8           H        HIS   8  17.723  20.439  31.079
  575    HA   HIS   8           HA       HIS   8  15.073  19.226  31.278
  576    HB2  HIS   8           HB2      HIS   8  16.269  21.702  32.595
  577    HB3  HIS   8           HB3      HIS   8  14.682  21.032  32.972
  578    HD2  HIS   8           HD2      HIS   8  14.750  19.398  35.104
  579    HE1  HIS   8           HE1      HIS   8  18.816  18.275  34.840
  580    HE2  HIS   8           HE2      HIS   8  16.742  18.246  36.283
  581    H    SER   9           H        SER   9  15.159  19.794  28.730
  582    HA   SER   9           HA       SER   9  13.130  21.818  28.298
  583    HB2  SER   9           HB2      SER   9  15.212  23.192  28.096
  584    HB3  SER   9           HB3      SER   9  15.824  22.088  26.862
  585    HG   SER   9           HG       SER   9  14.712  23.187  25.456
  586    H    HIS  10           H        HIS  10  12.049  21.557  26.287
  587    HA   HIS  10           HA       HIS  10  12.870  19.310  24.537
  588    HB2  HIS  10           HB2      HIS  10  10.048  19.817  25.586
  589    HB3  HIS  10           HB3      HIS  10  10.423  18.687  24.288
  590    HD1  HIS  10           HD1      HIS  10   9.961  18.792  27.862
  591    HD2  HIS  10           HD2      HIS  10  12.295  16.557  25.261
  592    HE1  HIS  10           HE1      HIS  10  10.622  16.749  29.143
  593    HE2  HIS  10           HE2      HIS  10  12.180  15.505  27.609
  594    H    MET  11           H        MET  11  10.122  21.603  24.550
  595    HA   MET  11           HA       MET  11   9.129  22.843  22.956
  596    HB2  MET  11           HB2      MET  11  11.082  24.297  23.517
  597    HB3  MET  11           HB3      MET  11  11.988  23.572  22.196
  598    HG2  MET  11           HG2      MET  11  10.355  24.474  20.581
  599    HG3  MET  11           HG3      MET  11   9.445  25.198  21.911
  600    HE1  MET  11           HE1      MET  11   9.529  27.603  20.825
  601    HE2  MET  11           HE2      MET  11  10.388  26.945  19.430
  602    HE3  MET  11           HE3      MET  11  11.012  28.372  20.258
  603    H    GLY  12           H        GLY  12   8.103  21.329  21.683
  604    HA2  GLY  12           HA2      GLY  12   9.465  19.812  19.607
  605    HA3  GLY  12           HA3      GLY  12   7.772  19.720  20.049
  606    H    GLY  13           H        GLY  13   6.883  19.845  18.013
  607    HA2  GLY  13           HA2      GLY  13   6.739  22.440  16.739
  608    HA3  GLY  13           HA3      GLY  13   7.627  21.250  15.790
  609    H    GLY  14           H        GLY  14   4.588  22.524  16.457
  610    HA2  GLY  14           HA2      GLY  14   2.885  20.292  15.888
  611    HA3  GLY  14           HA3      GLY  14   2.435  21.986  15.875
  612    H    LYS  15           H        LYS  15   2.010  19.574  13.986
  613    HA   LYS  15           HA       LYS  15   3.368  20.214  11.524
  614    HB2  LYS  15           HB2      LYS  15   1.057  18.298  12.089
  615    HB3  LYS  15           HB3      LYS  15   1.815  18.476  10.514
  616    HG2  LYS  15           HG2      LYS  15   2.735  16.510  11.496
  617    HG3  LYS  15           HG3      LYS  15   3.998  17.738  11.556
  618    HD2  LYS  15           HD2      LYS  15   3.511  18.126  13.951
  619    HD3  LYS  15           HD3      LYS  15   2.218  16.926  13.892
  620    HE2  LYS  15           HE2      LYS  15   4.242  15.978  14.898
  621    HE3  LYS  15           HE3      LYS  15   3.879  15.170  13.372
  622    HZ1  LYS  15           HZ1      LYS  15   5.583  16.408  12.298
  623    HZ2  LYS  15           HZ2      LYS  15   6.240  15.723  13.695
  624    HZ3  LYS  15           HZ3      LYS  15   5.847  17.363  13.665
  625    H    GLY  16           H        GLY  16   2.876  22.221  10.765
  626    HA2  GLY  16           HA2      GLY  16   0.235  23.374  10.727
  627    HA3  GLY  16           HA3      GLY  16   1.685  24.035   9.993
  628    HA   PRO  17           HA       PRO  17  -1.235  22.127   6.713
  629    HB2  PRO  17           HB2      PRO  17  -2.577  24.289   5.767
  630    HB3  PRO  17           HB3      PRO  17  -3.097  23.441   7.230
  631    HG2  PRO  17           HG2      PRO  17  -1.496  25.982   6.989
  632    HG3  PRO  17           HG3      PRO  17  -2.873  25.619   8.052
  633    HD2  PRO  17           HD2      PRO  17  -0.252  25.480   8.891
  634    HD3  PRO  17           HD3      PRO  17  -1.550  24.501   9.600
  635    H    ALA  18           H        ALA  18  -1.200  22.463   4.360
  636    HA   ALA  18           HA       ALA  18   0.772  24.245   3.158
  637    HB1  ALA  18           HB1      ALA  18   2.183  22.364   3.930
  638    HB2  ALA  18           HB2      ALA  18   2.142  22.439   2.169
  639    HB3  ALA  18           HB3      ALA  18   1.183  21.228   3.026
  640    H    ALA  19           H        ALA  19   0.728  24.212   0.839
  641    HA   ALA  19           HA       ALA  19  -0.130  24.142  -1.240
  642    HB1  ALA  19           HB1      ALA  19  -1.176  22.075  -2.050
  643    HB2  ALA  19           HB2      ALA  19  -1.428  21.529  -0.390
  644    HB3  ALA  19           HB3      ALA  19   0.210  21.704  -1.022
  645    H    GLU  20           H        GLU  20  -2.347  23.770  -2.530
  646    HA   GLU  20           HA       GLU  20  -4.670  24.767  -0.966
  647    HB2  GLU  20           HB2      GLU  20  -3.974  25.409  -3.866
  648    HB3  GLU  20           HB3      GLU  20  -5.488  25.856  -3.085
  649    HG2  GLU  20           HG2      GLU  20  -4.174  27.220  -1.437
  650    HG3  GLU  20           HG3      GLU  20  -2.716  26.846  -2.354
  651    H    GLU  21           H        GLU  21  -6.785  24.102  -1.850
  652    HA   GLU  21           HA       GLU  21  -6.756  21.558  -3.356
  653    HB2  GLU  21           HB2      GLU  21  -8.176  20.444  -1.714
  654    HB3  GLU  21           HB3      GLU  21  -6.743  21.049  -0.893
  655    HG2  GLU  21           HG2      GLU  21  -8.084  23.021  -0.117
  656    HG3  GLU  21           HG3      GLU  21  -9.517  22.284  -0.826
  657    HA   PRO  22           HA       PRO  22 -10.633  23.206  -5.225
  658    HB2  PRO  22           HB2      PRO  22 -11.473  20.315  -5.308
  659    HB3  PRO  22           HB3      PRO  22 -11.410  21.504  -6.620
  660    HG2  PRO  22           HG2      PRO  22  -9.572  19.556  -6.455
  661    HG3  PRO  22           HG3      PRO  22  -9.103  21.198  -6.960
  662    HD2  PRO  22           HD2      PRO  22  -8.771  19.867  -4.263
  663    HD3  PRO  22           HD3      PRO  22  -7.623  20.884  -5.162
  664    H    LEU  23           H        LEU  23 -12.621  23.779  -4.354
  665    HA   LEU  23           HA       LEU  23 -13.222  23.204  -1.622
  666    HB2  LEU  23           HB2      LEU  23 -14.863  24.625  -3.749
  667    HB3  LEU  23           HB3      LEU  23 -15.286  24.584  -2.046
  668    HG   LEU  23           HG       LEU  23 -12.789  25.893  -3.208
  669   HD11  LEU  23          HD11      LEU  23 -15.291  27.190  -2.073
  670   HD12  LEU  23          HD12      LEU  23 -14.821  27.156  -3.773
  671   HD13  LEU  23          HD13      LEU  23 -13.835  28.036  -2.609
  672   HD21  LEU  23          HD21      LEU  23 -12.408  26.779  -0.937
  673   HD22  LEU  23          HD22      LEU  23 -12.371  25.017  -0.941
  674   HD23  LEU  23          HD23      LEU  23 -13.795  25.865  -0.334
  675    H    SER  24           H        SER  24 -13.369  20.933  -1.608
  676    HA   SER  24           HA       SER  24 -15.969  19.772  -1.988
  677    HB2  SER  24           HB2      SER  24 -15.203  17.976  -3.602
  678    HB3  SER  24           HB3      SER  24 -15.252  19.584  -4.314
  679    HG   SER  24           HG       SER  24 -12.812  18.846  -3.197
  680    H    LEU  25           H        LEU  25 -16.028  18.841   0.020
  681    HA   LEU  25           HA       LEU  25 -13.773  17.386   1.143
  682    HB2  LEU  25           HB2      LEU  25 -15.516  18.720   2.478
  683    HB3  LEU  25           HB3      LEU  25 -16.650  17.425   2.162
  684    HG   LEU  25           HG       LEU  25 -15.564  17.407   4.472
  685   HD11  LEU  25          HD11      LEU  25 -15.243  14.998   4.645
  686   HD12  LEU  25          HD12      LEU  25 -15.087  14.863   2.892
  687   HD13  LEU  25          HD13      LEU  25 -16.621  15.360   3.605
  688   HD21  LEU  25          HD21      LEU  25 -13.301  18.105   3.828
  689   HD22  LEU  25          HD22      LEU  25 -13.051  16.580   2.974
  690   HD23  LEU  25          HD23      LEU  25 -13.262  16.591   4.727
  691    H    LEU  26           H        LEU  26 -13.272  15.430   0.381
  692    HA   LEU  26           HA       LEU  26 -15.214  13.303   0.036
  693    HB2  LEU  26           HB2      LEU  26 -15.178  14.634  -2.176
  694    HB3  LEU  26           HB3      LEU  26 -13.531  14.085  -2.395
  695    HG   LEU  26           HG       LEU  26 -15.872  12.148  -2.134
  696   HD11  LEU  26          HD11      LEU  26 -15.948  11.980  -4.582
  697   HD12  LEU  26          HD12      LEU  26 -14.749  13.270  -4.717
  698   HD13  LEU  26          HD13      LEU  26 -16.338  13.609  -4.032
  699   HD21  LEU  26          HD21      LEU  26 -13.104  11.724  -3.327
  700   HD22  LEU  26          HD22      LEU  26 -14.402  10.527  -3.276
  701   HD23  LEU  26          HD23      LEU  26 -13.680  11.102  -1.778
  702    H    ASP  27           H        ASP  27 -11.897  14.299  -0.822
  703    HA   ASP  27           HA       ASP  27  -9.839  13.486  -0.492
  704    HB2  ASP  27           HB2      ASP  27 -11.106  12.064   1.888
  705    HB3  ASP  27           HB3      ASP  27  -9.371  12.182   1.605
  706    H    ASP  28           H        ASP  28  -9.801  12.402  -2.463
  707    HA   ASP  28           HA       ASP  28 -10.696   9.728  -2.915
  708    HB2  ASP  28           HB2      ASP  28  -8.644  11.384  -4.451
  709    HB3  ASP  28           HB3      ASP  28  -9.444   9.926  -5.044
  710    H    MET  29           H        MET  29  -7.659  11.113  -1.778
  711    HA   MET  29           HA       MET  29  -6.030   8.790  -1.918
  712    HB2  MET  29           HB2      MET  29  -5.822  11.051   0.123
  713    HB3  MET  29           HB3      MET  29  -4.564   9.881  -0.266
  714    HG2  MET  29           HG2      MET  29  -4.836  10.851  -2.706
  715    HG3  MET  29           HG3      MET  29  -5.521  12.232  -1.857
  716    HE1  MET  29           HE1      MET  29  -1.235  10.643  -1.343
  717    HE2  MET  29           HE2      MET  29  -2.431   9.974  -2.455
  718    HE3  MET  29           HE3      MET  29  -2.641   9.788  -0.711
  719    H    ASN  30           H        ASN  30  -8.070  10.113   0.690
  720    HA   ASN  30           HA       ASN  30  -7.604   8.079   2.615
  721    HB2  ASN  30           HB2      ASN  30  -8.531  10.354   3.133
  722    HB3  ASN  30           HB3      ASN  30 -10.042   9.890   2.359
  723   HD21  ASN  30          HD21      ASN  30 -11.298  10.101   4.207
  724   HD22  ASN  30          HD22      ASN  30 -11.149   9.066   5.578
  725    H    HIS  31           H        HIS  31  -9.871   8.331  -0.064
  726    HA   HIS  31           HA       HIS  31 -11.569   6.134   0.449
  727    HB2  HIS  31           HB2      HIS  31 -11.941   7.877  -1.320
  728    HB3  HIS  31           HB3      HIS  31 -10.618   7.193  -2.255
  729    HD2  HIS  31           HD2      HIS  31 -14.299   6.293  -1.210
  730    HE1  HIS  31           HE1      HIS  31 -13.110   3.845  -4.449
  731    HE2  HIS  31           HE2      HIS  31 -15.067   4.706  -3.103
  732    H    CYS  32           H        CYS  32  -8.519   6.348  -1.380
  733    HA   CYS  32           HA       CYS  32  -8.231   3.593  -2.022
  734    HB2  CYS  32           HB2      CYS  32  -6.076   5.731  -1.791
  735    HB3  CYS  32           HB3      CYS  32  -5.931   4.198  -2.652
  736    HG   CYS  32           HG       CYS  32  -8.438   6.251  -3.596
  737    H    TYR  33           H        TYR  33  -6.986   5.565   0.663
  738    HA   TYR  33           HA       TYR  33  -5.434   3.638   2.011
  739    HB2  TYR  33           HB2      TYR  33  -6.794   6.194   2.892
  740    HB3  TYR  33           HB3      TYR  33  -6.015   5.169   4.091
  741    HD1  TYR  33           HD1      TYR  33  -3.546   4.305   2.966
  742    HD2  TYR  33           HD2      TYR  33  -5.430   8.104   2.474
  743    HE1  TYR  33           HE1      TYR  33  -1.358   5.339   2.632
  744    HE2  TYR  33           HE2      TYR  33  -3.236   9.149   2.114
  745    HH   TYR  33           HH       TYR  33  -0.449   7.456   1.467
  746    H    SER  34           H        SER  34  -8.896   4.368   2.185
  747    HA   SER  34           HA       SER  34  -9.557   2.789   4.444
  748    HB2  SER  34           HB2      SER  34 -11.076   4.541   3.531
  749    HB3  SER  34           HB3      SER  34 -11.354   3.550   2.102
  750    HG   SER  34           HG       SER  34 -12.689   2.321   3.209
  751    H    ARG  35           H        ARG  35  -9.496   2.052   0.938
  752    HA   ARG  35           HA       ARG  35 -10.403  -0.638   1.179
  753    HB2  ARG  35           HB2      ARG  35 -10.292   0.971  -0.919
  754    HB3  ARG  35           HB3      ARG  35  -8.730   0.187  -1.162
  755    HG2  ARG  35           HG2      ARG  35  -9.972  -2.044  -0.949
  756    HG3  ARG  35           HG3      ARG  35 -11.467  -1.111  -1.043
  757    HD2  ARG  35           HD2      ARG  35 -10.695  -0.204  -3.214
  758    HD3  ARG  35           HD3      ARG  35  -9.290  -1.255  -3.114
  759    HE   ARG  35           HE       ARG  35 -11.833  -1.964  -4.059
  760   HH11  ARG  35          HH11      ARG  35  -9.340  -3.405  -2.096
  761   HH12  ARG  35          HH12      ARG  35  -9.869  -5.010  -2.452
  762   HH21  ARG  35          HH21      ARG  35 -12.426  -4.014  -4.508
  763   HH22  ARG  35          HH22      ARG  35 -11.584  -5.348  -3.802
  764    H    LEU  36           H        LEU  36  -7.162   0.843   1.237
  765    HA   LEU  36           HA       LEU  36  -5.583  -1.499   1.253
  766    HB2  LEU  36           HB2      LEU  36  -5.138   1.183   2.622
  767    HB3  LEU  36           HB3      LEU  36  -3.934  -0.096   2.627
  768    HG   LEU  36           HG       LEU  36  -4.973   1.323   0.142
  769   HD11  LEU  36          HD11      LEU  36  -2.731   2.327   0.001
  770   HD12  LEU  36          HD12      LEU  36  -2.294   1.578   1.539
  771   HD13  LEU  36          HD13      LEU  36  -3.565   2.800   1.481
  772   HD21  LEU  36          HD21      LEU  36  -4.361  -1.001  -0.370
  773   HD22  LEU  36          HD22      LEU  36  -2.784  -0.776   0.390
  774   HD23  LEU  36          HD23      LEU  36  -3.197   0.117  -1.076
  775    H    ARG  37           H        ARG  37  -7.067   0.289   3.972
  776    HA   ARG  37           HA       ARG  37  -6.335  -1.262   6.153
  777    HB2  ARG  37           HB2      ARG  37  -8.866   0.293   5.607
  778    HB3  ARG  37           HB3      ARG  37  -8.544  -0.468   7.165
  779    HG2  ARG  37           HG2      ARG  37  -6.584   0.899   7.521
  780    HG3  ARG  37           HG3      ARG  37  -6.687   1.561   5.882
  781    HD2  ARG  37           HD2      ARG  37  -7.532   3.088   7.647
  782    HD3  ARG  37           HD3      ARG  37  -8.723   2.722   6.406
  783    HE   ARG  37           HE       ARG  37  -8.705   1.493   9.103
  784   HH11  ARG  37          HH11      ARG  37 -10.532   2.746   6.433
  785   HH12  ARG  37          HH12      ARG  37 -12.045   2.435   7.203
  786   HH21  ARG  37          HH21      ARG  37 -10.651   1.121  10.045
  787   HH22  ARG  37          HH22      ARG  37 -12.114   1.528   9.214
  788    H    GLU  38           H        GLU  38  -8.653  -2.019   3.677
  789    HA   GLU  38           HA       GLU  38  -9.999  -4.182   5.103
  790    HB2  GLU  38           HB2      GLU  38 -10.219  -3.353   2.175
  791    HB3  GLU  38           HB3      GLU  38 -11.301  -4.454   3.018
  792    HG2  GLU  38           HG2      GLU  38 -10.983  -1.486   3.535
  793    HG3  GLU  38           HG3      GLU  38 -12.334  -2.262   2.721
  794    H    LEU  39           H        LEU  39  -7.562  -3.742   2.609
  795    HA   LEU  39           HA       LEU  39  -7.283  -6.564   1.969
  796    HB2  LEU  39           HB2      LEU  39  -5.852  -4.072   1.003
  797    HB3  LEU  39           HB3      LEU  39  -5.419  -5.685   0.464
  798    HG   LEU  39           HG       LEU  39  -8.119  -4.356   0.015
  799   HD11  LEU  39          HD11      LEU  39  -6.363  -3.338  -1.354
  800   HD12  LEU  39          HD12      LEU  39  -7.467  -4.277  -2.357
  801   HD13  LEU  39          HD13      LEU  39  -5.878  -4.929  -1.948
  802   HD21  LEU  39          HD21      LEU  39  -8.353  -6.803   0.261
  803   HD22  LEU  39          HD22      LEU  39  -7.111  -7.057  -0.968
  804   HD23  LEU  39          HD23      LEU  39  -8.644  -6.300  -1.402
  805    H    VAL  40           H        VAL  40  -6.029  -4.625   4.417
  806    HA   VAL  40           HA       VAL  40  -3.626  -6.341   4.749
  807    HB   VAL  40           HB       VAL  40  -4.128  -3.597   6.011
  808   HG11  VAL  40          HG11      VAL  40  -1.738  -3.666   6.660
  809   HG12  VAL  40          HG12      VAL  40  -1.604  -5.300   6.003
  810   HG13  VAL  40          HG13      VAL  40  -2.647  -4.989   7.392
  811   HG21  VAL  40          HG21      VAL  40  -2.335  -4.308   3.652
  812   HG22  VAL  40          HG22      VAL  40  -2.430  -2.724   4.434
  813   HG23  VAL  40          HG23      VAL  40  -3.837  -3.372   3.587
  814    HA   PRO  41           HA       PRO  41  -6.193  -7.928   8.328
  815    HB2  PRO  41           HB2      PRO  41  -4.889 -10.375   8.406
  816    HB3  PRO  41           HB3      PRO  41  -6.309 -10.051   7.405
  817    HG2  PRO  41           HG2      PRO  41  -3.396  -9.977   6.626
  818    HG3  PRO  41           HG3      PRO  41  -4.763 -10.732   5.772
  819    HD2  PRO  41           HD2      PRO  41  -3.812  -8.342   4.995
  820    HD3  PRO  41           HD3      PRO  41  -5.556  -8.671   4.959
  821    H    GLY  42           H        GLY  42  -2.877  -7.173   7.783
  822    HA2  GLY  42           HA2      GLY  42  -1.812  -7.764  10.394
  823    HA3  GLY  42           HA3      GLY  42  -1.087  -6.747   9.166
  824    H    VAL  43           H        VAL  43  -4.176  -5.553   9.685
  825    HA   VAL  43           HA       VAL  43  -3.360  -3.403  11.440
  826    HB   VAL  43           HB       VAL  43  -6.132  -4.100  10.350
  827   HG11  VAL  43          HG11      VAL  43  -5.207  -1.534  11.705
  828   HG12  VAL  43          HG12      VAL  43  -6.345  -2.714  12.355
  829   HG13  VAL  43          HG13      VAL  43  -6.775  -1.775  10.928
  830   HG21  VAL  43          HG21      VAL  43  -5.745  -2.299   8.692
  831   HG22  VAL  43          HG22      VAL  43  -4.538  -3.575   8.547
  832   HG23  VAL  43          HG23      VAL  43  -4.114  -2.051   9.327
  833    HA   PRO  44           HA       PRO  44  -4.291  -5.910  15.185
  834    HB2  PRO  44           HB2      PRO  44  -3.768  -3.327  16.619
  835    HB3  PRO  44           HB3      PRO  44  -2.996  -4.905  16.830
  836    HG2  PRO  44           HG2      PRO  44  -1.685  -2.905  15.626
  837    HG3  PRO  44           HG3      PRO  44  -1.529  -4.573  15.025
  838    HD2  PRO  44           HD2      PRO  44  -3.260  -2.330  13.958
  839    HD3  PRO  44           HD3      PRO  44  -2.207  -3.454  13.065
  840    H    ARG  45           H        ARG  45  -5.687  -5.663  17.193
  841    HA   ARG  45           HA       ARG  45  -8.346  -4.812  16.519
  842    HB2  ARG  45           HB2      ARG  45  -7.806  -6.815  17.991
  843    HB3  ARG  45           HB3      ARG  45  -7.303  -5.702  19.255
  844    HG2  ARG  45           HG2      ARG  45  -9.530  -6.451  19.774
  845    HG3  ARG  45           HG3      ARG  45  -9.637  -4.760  19.275
  846    HD2  ARG  45           HD2      ARG  45 -11.455  -6.067  18.280
  847    HD3  ARG  45           HD3      ARG  45 -10.368  -5.476  17.018
  848    HE   ARG  45           HE       ARG  45  -9.751  -8.131  17.979
  849   HH11  ARG  45          HH11      ARG  45 -11.579  -6.381  15.608
  850   HH12  ARG  45          HH12      ARG  45 -11.724  -7.755  14.576
  851   HH21  ARG  45          HH21      ARG  45  -9.964  -9.846  16.636
  852   HH22  ARG  45          HH22      ARG  45 -10.829  -9.684  15.146
  853    H    GLY  46           H        GLY  46  -8.186  -2.559  16.149
  854    HA2  GLY  46           HA2      GLY  46  -8.483  -0.337  16.778
  855    HA3  GLY  46           HA3      GLY  46  -8.223  -0.778  18.459
  856    H    THR  47           H        THR  47  -6.982   1.090  16.123
  857    HA   THR  47           HA       THR  47  -4.349   1.336  17.304
  858    HB   THR  47           HB       THR  47  -3.859  -0.563  15.826
  859    HG1  THR  47           HG1      THR  47  -2.027   0.349  15.329
  860   HG21  THR  47          HG21      THR  47  -4.876   1.139  13.523
  861   HG22  THR  47          HG22      THR  47  -5.680  -0.289  14.179
  862   HG23  THR  47          HG23      THR  47  -4.115  -0.448  13.378
  863    H    GLN  48           H        GLN  48  -3.007   2.999  15.895
  864    HA   GLN  48           HA       GLN  48  -4.818   5.172  14.992
  865    HB2  GLN  48           HB2      GLN  48  -2.947   6.734  15.694
  866    HB3  GLN  48           HB3      GLN  48  -3.746   5.882  17.008
  867    HG2  GLN  48           HG2      GLN  48  -1.870   4.314  17.185
  868    HG3  GLN  48           HG3      GLN  48  -1.067   5.076  15.814
  869   HE21  GLN  48          HE21      GLN  48  -0.069   4.727  18.509
  870   HE22  GLN  48          HE22      GLN  48   0.302   6.307  19.100
  871    H    LEU  49           H        LEU  49  -4.877   4.570  12.840
  872    HA   LEU  49           HA       LEU  49  -2.379   4.662  11.249
  873    HB2  LEU  49           HB2      LEU  49  -5.140   3.630  10.469
  874    HB3  LEU  49           HB3      LEU  49  -3.725   3.628   9.433
  875    HG   LEU  49           HG       LEU  49  -4.090   1.985  11.961
  876   HD11  LEU  49          HD11      LEU  49  -4.060   0.039  10.463
  877   HD12  LEU  49          HD12      LEU  49  -3.949   1.105   9.063
  878   HD13  LEU  49          HD13      LEU  49  -5.393   1.127  10.078
  879   HD21  LEU  49          HD21      LEU  49  -1.682   2.089  10.113
  880   HD22  LEU  49          HD22      LEU  49  -1.922   0.923  11.414
  881   HD23  LEU  49          HD23      LEU  49  -1.744   2.633  11.793
  882    H    SER  50           H        SER  50  -2.030   6.845  10.903
  883    HA   SER  50           HA       SER  50  -4.154   8.623  10.035
  884    HB2  SER  50           HB2      SER  50  -1.157   9.130  10.228
  885    HB3  SER  50           HB3      SER  50  -2.394  10.360   9.951
  886    HG   SER  50           HG       SER  50  -3.258   9.848  11.991
  887    H    GLN  51           H        GLN  51  -0.954   8.344   8.430
  888    HA   GLN  51           HA       GLN  51  -2.182   7.450   5.912
  889    HB2  GLN  51           HB2      GLN  51  -0.628  10.054   6.208
  890    HB3  GLN  51           HB3      GLN  51  -0.765   9.226   4.662
  891    HG2  GLN  51           HG2      GLN  51  -3.220   9.457   4.755
  892    HG3  GLN  51           HG3      GLN  51  -3.077  10.326   6.284
  893   HE21  GLN  51          HE21      GLN  51  -2.397  10.481   2.834
  894   HE22  GLN  51          HE22      GLN  51  -2.203  12.193   2.760
  895    H    VAL  52           H        VAL  52   0.918   8.573   7.333
  896    HA   VAL  52           HA       VAL  52   2.596   6.947   5.712
  897    HB   VAL  52           HB       VAL  52   3.364   7.995   8.481
  898   HG11  VAL  52          HG11      VAL  52   4.989   6.439   7.459
  899   HG12  VAL  52          HG12      VAL  52   5.657   8.067   7.569
  900   HG13  VAL  52          HG13      VAL  52   5.073   7.458   6.016
  901   HG21  VAL  52          HG21      VAL  52   3.487   9.539   5.858
  902   HG22  VAL  52          HG22      VAL  52   4.136  10.081   7.407
  903   HG23  VAL  52          HG23      VAL  52   2.397   9.868   7.209
  904    H    GLU  53           H        GLU  53   1.134   6.469   8.914
  905    HA   GLU  53           HA       GLU  53   2.318   4.073   9.741
  906    HB2  GLU  53           HB2      GLU  53  -0.619   4.785  10.176
  907    HB3  GLU  53           HB3      GLU  53   0.373   3.731  11.171
  908    HG2  GLU  53           HG2      GLU  53   0.497   6.736  10.949
  909    HG3  GLU  53           HG3      GLU  53   0.088   5.767  12.361
  910    H    ILE  54           H        ILE  54  -0.453   4.605   7.608
  911    HA   ILE  54           HA       ILE  54  -1.203   1.903   7.173
  912    HB   ILE  54           HB       ILE  54  -1.623   4.342   5.379
  913   HG12  ILE  54          HG12      ILE  54  -3.489   3.100   7.464
  914   HG13  ILE  54          HG13      ILE  54  -2.595   4.599   7.667
  915   HG21  ILE  54          HG21      ILE  54  -3.044   1.642   5.287
  916   HG22  ILE  54          HG22      ILE  54  -1.935   2.287   4.074
  917   HG23  ILE  54          HG23      ILE  54  -3.489   3.068   4.340
  918   HD11  ILE  54          HD11      ILE  54  -4.796   4.111   5.667
  919   HD12  ILE  54          HD12      ILE  54  -3.900   5.620   5.870
  920   HD13  ILE  54          HD13      ILE  54  -4.920   5.017   7.176
  921    H    LEU  55           H        LEU  55   0.873   4.144   5.287
  922    HA   LEU  55           HA       LEU  55   1.531   2.487   3.132
  923    HB2  LEU  55           HB2      LEU  55   3.252   4.616   4.453
  924    HB3  LEU  55           HB3      LEU  55   3.525   3.951   2.852
  925    HG   LEU  55           HG       LEU  55   1.108   5.606   3.675
  926   HD11  LEU  55          HD11      LEU  55   3.151   6.965   3.581
  927   HD12  LEU  55          HD12      LEU  55   2.057   7.380   2.265
  928   HD13  LEU  55          HD13      LEU  55   3.478   6.385   1.944
  929   HD21  LEU  55          HD21      LEU  55   0.526   5.620   1.284
  930   HD22  LEU  55          HD22      LEU  55   0.520   3.982   1.930
  931   HD23  LEU  55          HD23      LEU  55   1.873   4.532   0.939
  932    H    GLN  56           H        GLN  56   3.325   2.960   6.167
  933    HA   GLN  56           HA       GLN  56   5.465   1.180   5.729
  934    HB2  GLN  56           HB2      GLN  56   4.220   2.168   8.333
  935    HB3  GLN  56           HB3      GLN  56   5.772   1.343   8.227
  936    HG2  GLN  56           HG2      GLN  56   6.774   3.169   7.043
  937    HG3  GLN  56           HG3      GLN  56   5.212   3.943   6.778
  938   HE21  GLN  56          HE21      GLN  56   7.641   5.007   8.063
  939   HE22  GLN  56          HE22      GLN  56   7.152   5.521   9.636
  940    H    ARG  57           H        ARG  57   2.266   0.699   7.201
  941    HA   ARG  57           HA       ARG  57   2.704  -1.976   8.137
  942    HB2  ARG  57           HB2      ARG  57   1.002  -0.418   9.091
  943    HB3  ARG  57           HB3      ARG  57   0.063  -0.551   7.608
  944    HG2  ARG  57           HG2      ARG  57  -0.430  -2.880   8.042
  945    HG3  ARG  57           HG3      ARG  57   0.724  -2.930   9.374
  946    HD2  ARG  57           HD2      ARG  57  -1.855  -1.321   9.325
  947    HD3  ARG  57           HD3      ARG  57  -1.592  -2.822  10.214
  948    HE   ARG  57           HE       ARG  57  -0.618  -0.170  10.905
  949   HH11  ARG  57          HH11      ARG  57  -0.272  -3.555  11.582
  950   HH12  ARG  57          HH12      ARG  57   0.363  -3.263  13.163
  951   HH21  ARG  57          HH21      ARG  57   0.194   0.149  12.936
  952   HH22  ARG  57          HH22      ARG  57   0.604  -1.215  13.918
  953    H    VAL  58           H        VAL  58   1.410  -0.625   5.131
  954    HA   VAL  58           HA       VAL  58   0.566  -3.070   3.932
  955    HB   VAL  58           HB       VAL  58   1.397  -0.417   2.649
  956   HG11  VAL  58          HG11      VAL  58   0.358  -1.237   0.549
  957   HG12  VAL  58          HG12      VAL  58   0.139  -2.830   1.280
  958   HG13  VAL  58          HG13      VAL  58   1.762  -2.197   1.006
  959   HG21  VAL  58          HG21      VAL  58  -1.371  -1.631   3.080
  960   HG22  VAL  58          HG22      VAL  58  -1.033  -0.090   2.289
  961   HG23  VAL  58          HG23      VAL  58  -0.669  -0.298   3.999
  962    H    ILE  59           H        ILE  59   3.652  -1.227   3.732
  963    HA   ILE  59           HA       ILE  59   5.059  -2.939   1.991
  964    HB   ILE  59           HB       ILE  59   6.167  -1.184   4.232
  965   HG12  ILE  59          HG12      ILE  59   5.921  -0.582   1.239
  966   HG13  ILE  59          HG13      ILE  59   4.841   0.042   2.480
  967   HG21  ILE  59          HG21      ILE  59   7.657  -2.405   1.871
  968   HG22  ILE  59          HG22      ILE  59   7.850  -2.856   3.564
  969   HG23  ILE  59          HG23      ILE  59   8.336  -1.252   3.022
  970   HD11  ILE  59          HD11      ILE  59   6.691   1.266   3.490
  971   HD12  ILE  59          HD12      ILE  59   6.460   1.698   1.797
  972   HD13  ILE  59          HD13      ILE  59   7.787   0.633   2.257
  973    H    ASP  60           H        ASP  60   4.959  -2.905   5.578
  974    HA   ASP  60           HA       ASP  60   6.649  -5.099   6.070
  975    HB2  ASP  60           HB2      ASP  60   5.945  -3.458   7.808
  976    HB3  ASP  60           HB3      ASP  60   4.311  -4.110   7.759
  977    H    TYR  61           H        TYR  61   3.145  -4.957   5.505
  978    HA   TYR  61           HA       TYR  61   2.380  -7.610   5.942
  979    HB2  TYR  61           HB2      TYR  61   0.733  -5.838   5.530
  980    HB3  TYR  61           HB3      TYR  61   1.353  -5.579   3.907
  981    HD1  TYR  61           HD1      TYR  61  -0.195  -8.256   6.028
  982    HD2  TYR  61           HD2      TYR  61   0.240  -6.659   2.077
  983    HE1  TYR  61           HE1      TYR  61  -1.806  -9.892   5.187
  984    HE2  TYR  61           HE2      TYR  61  -1.399  -8.300   1.246
  985    HH   TYR  61           HH       TYR  61  -2.274 -10.525   1.895
  986    H    ILE  62           H        ILE  62   3.504  -6.076   2.937
  987    HA   ILE  62           HA       ILE  62   3.351  -8.356   1.256
  988    HB   ILE  62           HB       ILE  62   5.025  -5.820   0.930
  989   HG12  ILE  62          HG12      ILE  62   2.266  -6.408  -0.268
  990   HG13  ILE  62          HG13      ILE  62   2.511  -5.459   1.193
  991   HG21  ILE  62          HG21      ILE  62   5.825  -7.600  -0.566
  992   HG22  ILE  62          HG22      ILE  62   5.022  -6.338  -1.498
  993   HG23  ILE  62          HG23      ILE  62   4.186  -7.857  -1.171
  994   HD11  ILE  62          HD11      ILE  62   3.533  -4.752  -1.557
  995   HD12  ILE  62          HD12      ILE  62   3.773  -3.799  -0.087
  996   HD13  ILE  62          HD13      ILE  62   2.149  -4.036  -0.732
  997    H    LEU  63           H        LEU  63   6.136  -6.861   2.962
  998    HA   LEU  63           HA       LEU  63   8.179  -8.619   2.128
  999    HB2  LEU  63           HB2      LEU  63   7.941  -7.086   4.746
 1000    HB3  LEU  63           HB3      LEU  63   9.416  -7.825   4.148
 1001    HG   LEU  63           HG       LEU  63   7.952  -5.497   2.848
 1002   HD11  LEU  63          HD11      LEU  63   9.049  -4.852   4.940
 1003   HD12  LEU  63          HD12      LEU  63   9.873  -4.137   3.559
 1004   HD13  LEU  63          HD13      LEU  63  10.575  -5.536   4.373
 1005   HD21  LEU  63          HD21      LEU  63   9.049  -6.879   1.142
 1006   HD22  LEU  63          HD22      LEU  63  10.573  -6.800   2.032
 1007   HD23  LEU  63          HD23      LEU  63   9.882  -5.337   1.326
 1008    H    ASP  64           H        ASP  64   5.811  -8.890   4.720
 1009    HA   ASP  64           HA       ASP  64   6.934 -11.152   6.069
 1010    HB2  ASP  64           HB2      ASP  64   5.321  -9.502   7.078
 1011    HB3  ASP  64           HB3      ASP  64   4.047 -10.164   6.066
 1012    H    LEU  65           H        LEU  65   4.704 -10.763   3.360
 1013    HA   LEU  65           HA       LEU  65   3.973 -13.553   3.146
 1014    HB2  LEU  65           HB2      LEU  65   3.724 -11.298   1.114
 1015    HB3  LEU  65           HB3      LEU  65   3.002 -12.890   0.948
 1016    HG   LEU  65           HG       LEU  65   2.262 -10.768   2.995
 1017   HD11  LEU  65          HD11      LEU  65   1.357 -10.327   0.773
 1018   HD12  LEU  65          HD12      LEU  65   0.070 -10.784   1.885
 1019   HD13  LEU  65          HD13      LEU  65   0.668 -11.952   0.706
 1020   HD21  LEU  65          HD21      LEU  65   0.522 -12.316   3.806
 1021   HD22  LEU  65          HD22      LEU  65   2.140 -12.956   4.084
 1022   HD23  LEU  65          HD23      LEU  65   1.161 -13.589   2.758
 1023    H    GLN  66           H        GLN  66   6.279 -11.423   1.508
 1024    HA   GLN  66           HA       GLN  66   7.189 -13.277  -0.451
 1025    HB2  GLN  66           HB2      GLN  66   8.463 -10.724   0.612
 1026    HB3  GLN  66           HB3      GLN  66   9.072 -11.624  -0.775
 1027    HG2  GLN  66           HG2      GLN  66   6.996 -11.211  -2.003
 1028    HG3  GLN  66           HG3      GLN  66   6.309 -10.377  -0.609
 1029   HE21  GLN  66          HE21      GLN  66   6.750  -9.383  -3.328
 1030   HE22  GLN  66          HE22      GLN  66   7.750  -7.985  -3.163
 1031    H    VAL  67           H        VAL  67   8.342 -12.410   2.771
 1032    HA   VAL  67           HA       VAL  67   9.828 -13.228   4.237
 1033    HB   VAL  67           HB       VAL  67   9.598 -15.853   2.688
 1034   HG11  VAL  67          HG11      VAL  67  10.239 -16.956   4.805
 1035   HG12  VAL  67          HG12      VAL  67  10.454 -15.379   5.571
 1036   HG13  VAL  67          HG13      VAL  67  11.505 -15.864   4.239
 1037   HG21  VAL  67          HG21      VAL  67   7.812 -16.480   4.293
 1038   HG22  VAL  67          HG22      VAL  67   7.363 -15.048   3.367
 1039   HG23  VAL  67          HG23      VAL  67   7.908 -14.883   5.038
 1040    H    VAL  68           H        VAL  68  11.640 -12.044   3.884
 1041    HA   VAL  68           HA       VAL  68  13.789 -11.499   3.488
 1042    HB   VAL  68           HB       VAL  68  14.164 -14.422   2.679
 1043   HG11  VAL  68          HG11      VAL  68  16.269 -12.380   3.499
 1044   HG12  VAL  68          HG12      VAL  68  16.049 -13.059   1.886
 1045   HG13  VAL  68          HG13      VAL  68  16.562 -14.098   3.216
 1046   HG21  VAL  68          HG21      VAL  68  13.255 -14.222   4.957
 1047   HG22  VAL  68          HG22      VAL  68  14.542 -13.101   5.400
 1048   HG23  VAL  68          HG23      VAL  68  14.928 -14.778   5.014