*HEADER    STRUCTURAL GENOMICS, UNKNOWN FUNCTION   29-JUN-08   2K5L              
*TITLE     SOLUTION NMR STRUCTURE OF PROTEIN FEOA FROM CLOSTRIDIUM               
*TITLE    2 THERMOCELLUM, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM               
*TITLE    3 TARGET CMR17                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FEOA;                                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM THERMOCELLUM ATCC 27405;            
*SOURCE   3 GENE: CTHE_0619;                                                     
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PET 21-23C                                
*KEYWDS    NMR STRUCTURE, NESG, STRUCTURAL GENOMICS, PSI-2, PROTEIN              
*KEYWDS   2 STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS                  
*KEYWDS   3 CONSORTIUM, UNKNOWN FUNCTION                                         
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    A.ZERI, K.K.SINGARAPU, J.L.MILLS, Y.WU, E.GARCIA, H.WANG,             
*AUTHOR   2 M.JIANG, E.L.FOOTE, R.XIAO, R.NAIR, J.K.EVERETT,                     
*AUTHOR   3 G.V.T.SWAPNA, T.B.ACTON, B.ROST, G.T.MONTELIONE,                     
*AUTHOR   4 T.SZYPERSKI, NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)         
*REVDAT   1   02-SEP-08 2K5L    0                                                


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assign (resid   42 and name HB1  ) (resid   53 and name HA   )   6.00   6.00   0.00
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assign (resid   40 and name HD*  ) (resid   54 and name HB1  )   8.13   8.13   0.00
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assign (resid   50 and name HB2  ) (resid   61 and name HB1  )   7.76   7.76   0.00
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assign (resid   50 and name HG1  ) (resid   61 and name HB2  )   7.76   7.76   0.00
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assign (resid   51 and name HN   ) (resid   62 and name HB2  )   6.00   6.00   0.00
assign (resid   51 and name HN   ) (resid   62 and name HB1  )   6.00   6.00   0.00
assign (resid   50 and name HB2  ) (resid   63 and name HD2  )   7.76   7.76   0.00
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assign (resid   14 and name HG2  ) (resid   38 and name HA   )   6.00   6.00   0.00
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assign (resid   19 and name HB1  ) (resid   69 and name HG2  )   7.76   7.76   0.00
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assign (resid   40 and name HE*  ) (resid   42 and name HB1  )   8.13   8.13   0.00
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assign (resid   55 and name HB   ) (resid   58 and name HB2  )   6.00   6.00   0.00
assign (resid    5 and name HD1  ) (resid   68 and name HA   )   6.00   6.00   0.00
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assign (resid   18 and name HA   ) (resid   18 and name HD2* )   4.68   4.68   0.00
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assign (resid   24 and name HN   ) (resid   24 and name HD2* )   7.02   7.02   0.00
assign (resid   24 and name HA   ) (resid   24 and name HD2* )   6.51   6.51   0.00
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assign (resid   47 and name HA   ) (resid   47 and name HD1* )   7.02   7.02   0.00
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assign (resid    2 and name HZ   ) (resid   72 and name HG2* )   7.02   7.02   0.00
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assign (resid   11 and name HA   ) (resid   74 and name HD1* )   7.02   7.02   0.00
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assign (resid   47 and name N    ) (resid   47 and name CA   )
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assign (resid   47 and name CA   ) (resid   47 and name CB   )
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assign (resid   47 and name N    ) (resid   47 and name CA   )
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assign (resid   47 and name N    ) (resid   47 and name CA   )
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assign (resid   51 and name N    ) (resid   51 and name CA   )
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assign (resid   51 and name N    ) (resid   51 and name CA   )
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assign (resid   51 and name CA   ) (resid   51 and name CB   )
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assign (resid   51 and name CA   ) (resid   51 and name CB   )
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assign (resid   52 and name N    ) (resid   52 and name CA   )
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assign (resid   52 and name CA   ) (resid   52 and name CB   )
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assign (resid   53 and name N    ) (resid   53 and name CA   )
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assign (resid   53 and name CA   ) (resid   53 and name CB   )
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assign (resid   54 and name CA   ) (resid   54 and name CB   )
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assign (resid   55 and name N    ) (resid   55 and name CA   )
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assign (resid   55 and name N    ) (resid   55 and name CA   )
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assign (resid   55 and name C    ) (resid   56 and name N    )
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assign (resid   56 and name N    ) (resid   56 and name CA   )
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assign (resid   56 and name N    ) (resid   56 and name CA   )
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assign (resid   56 and name CA   ) (resid   56 and name CB   )
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assign (resid   56 and name N    ) (resid   56 and name CA   )
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assign (resid   56 and name C    ) (resid   57 and name N    )
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assign (resid   57 and name N    ) (resid   57 and name CA   )
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assign (resid   58 and name CA   ) (resid   58 and name CB   )
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assign (resid   59 and name N    ) (resid   59 and name CA   )
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assign (resid   60 and name CA   ) (resid   60 and name CB   )
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assign (resid   62 and name N    ) (resid   62 and name CA   )
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assign (resid   62 and name CA   ) (resid   62 and name CB   )
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assign (resid   62 and name CA   ) (resid   62 and name CB   )
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assign (resid   63 and name N    ) (resid   63 and name CA   )
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assign (resid   63 and name N    ) (resid   63 and name CA   )
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assign (resid   63 and name CA   ) (resid   63 and name CB   )
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assign (resid   63 and name N    ) (resid   63 and name CA   )
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assign (resid   64 and name N    ) (resid   64 and name CA   )
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assign (resid   68 and name N    ) (resid   68 and name CA   )
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assign (resid   68 and name CA   ) (resid   68 and name CB   )
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assign (resid   68 and name C    ) (resid   69 and name N    )
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assign (resid   69 and name N    ) (resid   69 and name CA   )
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assign (resid   69 and name N    ) (resid   69 and name CA   )
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assign (resid   69 and name CA   ) (resid   69 and name CB   )
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assign (resid   69 and name N    ) (resid   69 and name CA   )
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assign (resid   70 and name N    ) (resid   70 and name CA   )
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assign (resid   70 and name N    ) (resid   70 and name CA   )
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assign (resid   70 and name N    ) (resid   70 and name CA   )
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assign (resid   70 and name CA   ) (resid   70 and name CB   )
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assign (resid   70 and name CA   ) (resid   70 and name CB   )
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assign (resid   70 and name CA   ) (resid   70 and name CB   )
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assign (resid   71 and name N    ) (resid   71 and name CA   )
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assign (resid   71 and name CA   ) (resid   71 and name CB   )
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assign (resid   71 and name CA   ) (resid   71 and name CB   )
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assign (resid   72 and name N    ) (resid   72 and name CA   )
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assign (resid   72 and name N    ) (resid   72 and name CA   )
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assign (resid   73 and name N    ) (resid   73 and name CA   )
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assign (resid   73 and name N    ) (resid   73 and name CA   )
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assign (resid   73 and name CA   ) (resid   73 and name CB   )
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assign (resid   73 and name C    ) (resid   74 and name N    )
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assign (resid   73 and name C    ) (resid   74 and name N    )
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assign (resid   74 and name N    ) (resid   74 and name CA   )
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assign (resid   74 and name N    ) (resid   74 and name CA   )
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assign (resid   74 and name CA   ) (resid   74 and name CB   )
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assign (resid   74 and name CA   ) (resid   74 and name CB   )
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assign (resid   74 and name N    ) (resid   74 and name CA   )
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assign (resid   74 and name C    ) (resid   75 and name N    )
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assign (resid   74 and name C    ) (resid   75 and name N    )
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assign (resid   75 and name N    ) (resid   75 and name CA   )
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assign (resid   75 and name N    ) (resid   75 and name CA   )
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assign (resid   75 and name CA   ) (resid   75 and name CB   )
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assign (resid   75 and name N    ) (resid   75 and name CA   )
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assign (resid   75 and name C    ) (resid   76 and name N    )
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assign (resid   75 and name C    ) (resid   76 and name N    )
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assign (resid   76 and name N    ) (resid   76 and name CA   )
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assign (resid   76 and name N    ) (resid   76 and name CA   )
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assign (resid   76 and name N    ) (resid   76 and name CA   )
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assign (resid   76 and name C    ) (resid   77 and name N    )
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assign (resid   76 and name C    ) (resid   77 and name N    )
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assign (resid   77 and name N    ) (resid   77 and name CA   )
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assign (resid   77 and name N    ) (resid   77 and name CA   )
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assign (resid   77 and name N    ) (resid   77 and name CA   )
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assign (resid   77 and name C    ) (resid   78 and name N    )
       (resid   78 and name CA   ) (resid   78 and name C    )    1.0  180.0  135.0 2
assign (resid   77 and name C    ) (resid   78 and name N    )
       (resid   78 and name CA   ) (resid   78 and name C    )    1.0  -55.0  130.0 2
assign (resid   78 and name N    ) (resid   78 and name CA   )
       (resid   78 and name CB   ) (resid   78 and name CG   )    1.0  180.0  155.0 2
assign (resid   78 and name N    ) (resid   78 and name CA   )
       (resid   78 and name CB   ) (resid   78 and name CG   )    1.0  -55.0  150.0 2
assign (resid   78 and name N    ) (resid   78 and name CA   )
       (resid   78 and name C    ) (resid   79 and name N    )    1.0   55.0  140.0 2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HN       MET   1  -1.739   5.310  14.060
    2    HA   MET   1           HA       MET   1  -0.343   6.469  11.875
    3    HB2  MET   1           2HB      MET   1   1.698   6.099  13.124
    4    HB3  MET   1           3HB      MET   1   1.242   4.409  13.447
    5    HG2  MET   1           2HG      MET   1   2.921   4.458  11.725
    6    HG3  MET   1           3HG      MET   1   1.380   3.943  11.019
    7    HE1  MET   1           3HE      MET   1   2.157   4.381   8.571
    8    HE2  MET   1           1HE      MET   1   2.953   5.874   8.025
    9    HE3  MET   1           2HE      MET   1   3.768   4.810   9.194
   10    H    PHE   2           HN       PHE   2  -1.545   5.677  10.295
   11    HA   PHE   2           HA       PHE   2  -2.214   2.774  10.364
   12    HB2  PHE   2           2HB      PHE   2  -4.130   4.382  10.276
   13    HB3  PHE   2           3HB      PHE   2  -3.499   4.995   8.737
   14    HD1  PHE   2           2HD      PHE   2  -4.974   2.046  10.418
   15    HD2  PHE   2           1HD      PHE   2  -3.855   3.800   6.699
   16    HE1  PHE   2           2HE      PHE   2  -6.220   0.300   9.218
   17    HE2  PHE   2           1HE      PHE   2  -5.093   2.052   5.499
   18    HZ   PHE   2           HZ       PHE   2  -6.269   0.293   6.756
   19    H    SER   3           HN       SER   3  -0.879   1.592   9.184
   20    HA   SER   3           HA       SER   3   0.539   2.917   6.933
   21    HB2  SER   3           2HB      SER   3   1.287   0.280   8.213
   22    HB3  SER   3           3HB      SER   3   2.318   1.424   7.320
   23    HG   SER   3           HG       SER   3   2.639   1.527   9.597
   24    H    LEU   4           HN       LEU   4   1.247   1.169   5.233
   25    HA   LEU   4           HA       LEU   4  -1.150   0.198   4.000
   26    HB2  LEU   4           2HB      LEU   4   0.891   0.923   2.787
   27    HB3  LEU   4           3HB      LEU   4   1.739  -0.512   3.413
   28    HG   LEU   4           HG       LEU   4   0.144  -1.956   2.206
   29   HD11  LEU   4          1HD1      LEU   4  -1.358  -0.976   0.522
   30   HD12  LEU   4          2HD1      LEU   4  -1.770  -0.424   2.162
   31   HD13  LEU   4          3HD1      LEU   4  -0.888   0.655   1.054
   32   HD21  LEU   4          3HD2      LEU   4   2.283  -1.326   1.182
   33   HD22  LEU   4          1HD2      LEU   4   1.014  -1.505  -0.051
   34   HD23  LEU   4          2HD2      LEU   4   1.524   0.118   0.470
   35    H    ARG   5           HN       ARG   5   1.184  -1.165   6.222
   36    HA   ARG   5           HA       ARG   5   0.383  -3.914   5.703
   37    HB2  ARG   5           2HB      ARG   5   1.804  -4.437   7.663
   38    HB3  ARG   5           3HB      ARG   5   2.642  -3.506   6.398
   39    HG2  ARG   5           2HG      ARG   5   3.389  -2.511   8.347
   40    HG3  ARG   5           3HG      ARG   5   2.052  -1.444   7.852
   41    HD2  ARG   5           2HD      ARG   5   0.561  -2.522   9.442
   42    HD3  ARG   5           3HD      ARG   5   1.833  -3.680   9.889
   43    HE   ARG   5           HE       ARG   5   2.750  -1.000  10.273
   44   HH11  ARG   5          2HH1      ARG   5   0.603  -3.431  11.649
   45   HH12  ARG   5          1HH1      ARG   5   0.725  -2.799  13.274
   46   HH21  ARG   5          2HH2      ARG   5   2.898  -0.185  12.394
   47   HH22  ARG   5          1HH2      ARG   5   2.024  -0.962  13.696
   48    H    ASP   6           HN       ASP   6  -1.079  -1.348   7.276
   49    HA   ASP   6           HA       ASP   6  -2.323  -2.992   9.374
   50    HB2  ASP   6           2HB      ASP   6  -2.603  -0.090   8.551
   51    HB3  ASP   6           3HB      ASP   6  -3.653  -0.848   9.767
   52    HD2  ASP   6           2HD      ASP   6  -0.086   0.324  10.848
   53    H    ALA   7           HN       ALA   7  -2.728  -2.503   6.093
   54    HA   ALA   7           HA       ALA   7  -5.659  -2.672   6.130
   55    HB1  ALA   7           1HB      ALA   7  -5.451  -2.648   3.677
   56    HB2  ALA   7           2HB      ALA   7  -4.544  -1.309   4.418
   57    HB3  ALA   7           3HB      ALA   7  -3.681  -2.749   3.828
   58    H    LYS   8           HN       LYS   8  -6.843  -4.420   5.247
   59    HA   LYS   8           HA       LYS   8  -5.454  -7.012   5.645
   60    HB2  LYS   8           2HB      LYS   8  -8.423  -6.441   5.364
   61    HB3  LYS   8           3HB      LYS   8  -7.663  -7.959   5.899
   62    HG2  LYS   8           2HG      LYS   8  -7.546  -5.319   7.379
   63    HG3  LYS   8           3HG      LYS   8  -8.640  -6.671   7.758
   64    HD2  LYS   8           2HD      LYS   8  -6.700  -8.118   8.196
   65    HD3  LYS   8           3HD      LYS   8  -5.606  -6.767   7.816
   66    HE2  LYS   8           2HE      LYS   8  -6.530  -5.473   9.674
   67    HE3  LYS   8           3HE      LYS   8  -7.674  -6.784  10.037
   68    HZ1  LYS   8           3HZ      LYS   8  -4.740  -6.980  10.188
   69    HZ2  LYS   8           1HZ      LYS   8  -5.760  -6.850  11.475
   70    HZ3  LYS   8           2HZ      LYS   8  -5.801  -8.196  10.525
   71    H    CYS   9           HN       CYS   9  -5.610  -8.695   4.094
   72    HA   CYS   9           HA       CYS   9  -5.629  -7.787   1.367
   73    HB2  CYS   9           2HB      CYS   9  -5.616 -10.355   0.961
   74    HB3  CYS   9           3HB      CYS   9  -4.201  -9.552   1.687
   75    HG   CYS   9           HG       CYS   9  -4.531 -11.912   2.755
   76    H    GLY  10           HN       GLY  10  -7.355  -7.248   0.267
   77    HA2  GLY  10           1HA      GLY  10  -9.478  -8.244  -0.682
   78    HA3  GLY  10           2HA      GLY  10  -9.922  -8.567   1.009
   79    H    GLN  11           HN       GLN  11  -8.285  -5.870   1.401
   80    HA   GLN  11           HA       GLN  11 -10.686  -4.162   1.069
   81    HB2  GLN  11           2HB      GLN  11  -8.178  -3.812   2.741
   82    HB3  GLN  11           3HB      GLN  11  -9.523  -2.649   2.657
   83    HG2  GLN  11           2HG      GLN  11 -11.038  -4.302   3.607
   84    HG3  GLN  11           3HG      GLN  11  -9.731  -5.507   3.638
   85   HE21  GLN  11          1HE2      GLN  11 -11.363  -4.411   5.850
   86   HE22  GLN  11          2HE2      GLN  11 -10.222  -3.722   6.986
   87    H    THR  12           HN       THR  12 -10.253  -1.839   0.553
   88    HA   THR  12           HA       THR  12  -8.091  -1.639  -1.488
   89    HB   THR  12           HB       THR  12 -10.761  -0.176  -1.484
   90    HG1  THR  12           1HG      THR  12 -11.256  -1.655  -3.189
   91   HG21  THR  12          3HG2      THR  12  -8.613  -0.469  -3.615
   92   HG22  THR  12          1HG2      THR  12 -10.161   0.386  -3.812
   93   HG23  THR  12          2HG2      THR  12  -8.948   0.999  -2.665
   94    H    VAL  13           HN       VAL  13  -6.544  -0.236  -0.979
   95    HA   VAL  13           HA       VAL  13  -7.285   2.035   0.796
   96    HB   VAL  13           HB       VAL  13  -4.903   2.090   1.500
   97   HG11  VAL  13          1HG1      VAL  13  -4.965   0.114   2.957
   98   HG12  VAL  13          2HG1      VAL  13  -6.553   0.911   2.869
   99   HG13  VAL  13          3HG1      VAL  13  -6.255  -0.585   1.951
  100   HG21  VAL  13          3HG2      VAL  13  -3.921   1.042  -0.482
  101   HG22  VAL  13          1HG2      VAL  13  -3.430   0.189   1.000
  102   HG23  VAL  13          2HG2      VAL  13  -4.686  -0.506  -0.050
  103    H    LYS  14           HN       LYS  14  -5.945   3.983   0.502
  104    HA   LYS  14           HA       LYS  14  -4.765   4.211  -2.211
  105    HB2  LYS  14           2HB      LYS  14  -6.942   5.841  -0.981
  106    HB3  LYS  14           3HB      LYS  14  -5.716   6.684  -1.959
  107    HG2  LYS  14           2HG      LYS  14  -6.291   5.518  -3.903
  108    HG3  LYS  14           3HG      LYS  14  -7.136   4.239  -2.998
  109    HD2  LYS  14           2HD      LYS  14  -8.659   5.803  -4.199
  110    HD3  LYS  14           3HD      LYS  14  -8.934   5.733  -2.442
  111    HE2  LYS  14           2HE      LYS  14  -7.710   7.813  -2.135
  112    HE3  LYS  14           3HE      LYS  14  -7.317   7.867  -3.867
  113    HZ1  LYS  14           3HZ      LYS  14 -10.023   8.001  -2.721
  114    HZ2  LYS  14           1HZ      LYS  14  -9.175   9.274  -3.334
  115    HZ3  LYS  14           2HZ      LYS  14  -9.657   8.051  -4.328
  116    H    VAL  15           HN       VAL  15  -2.912   5.364  -2.328
  117    HA   VAL  15           HA       VAL  15  -1.564   5.774   0.205
  118    HB   VAL  15           HB       VAL  15  -0.611   6.440  -2.606
  119   HG11  VAL  15          1HG1      VAL  15   1.641   6.287  -1.630
  120   HG12  VAL  15          2HG1      VAL  15   0.671   7.549  -0.836
  121   HG13  VAL  15          3HG1      VAL  15   0.926   5.982  -0.030
  122   HG21  VAL  15          3HG2      VAL  15  -1.243   4.082  -2.422
  123   HG22  VAL  15          1HG2      VAL  15   0.522   4.260  -2.557
  124   HG23  VAL  15          2HG2      VAL  15  -0.218   3.913  -0.977
  125    H    VAL  16           HN       VAL  16  -1.280   7.613   1.309
  126    HA   VAL  16           HA       VAL  16  -1.981  10.122  -0.118
  127    HB   VAL  16           HB       VAL  16  -2.405  11.057   2.229
  128   HG11  VAL  16          1HG1      VAL  16  -4.717  10.214   2.244
  129   HG12  VAL  16          2HG1      VAL  16  -4.173  10.590   0.593
  130   HG13  VAL  16          3HG1      VAL  16  -4.243   8.899   1.144
  131   HG21  VAL  16          3HG2      VAL  16  -1.382   9.235   3.516
  132   HG22  VAL  16          1HG2      VAL  16  -3.096   9.432   3.946
  133   HG23  VAL  16          2HG2      VAL  16  -2.595   8.099   2.881
  134    H    LYS  17           HN       LYS  17  -0.011   8.959   2.665
  135    HA   LYS  17           HA       LYS  17   2.045  10.925   1.779
  136    HB2  LYS  17           2HB      LYS  17   1.381   9.926   4.562
  137    HB3  LYS  17           3HB      LYS  17   2.833  10.873   4.159
  138    HG2  LYS  17           2HG      LYS  17   1.380  12.723   3.395
  139    HG3  LYS  17           3HG      LYS  17  -0.045  11.779   3.892
  140    HD2  LYS  17           2HD      LYS  17   0.785  11.732   6.202
  141    HD3  LYS  17           3HD      LYS  17   2.219  12.664   5.708
  142    HE2  LYS  17           2HE      LYS  17   0.783  14.537   5.044
  143    HE3  LYS  17           3HE      LYS  17  -0.657  13.606   5.511
  144    HZ1  LYS  17           3HZ      LYS  17   1.507  14.439   7.326
  145    HZ2  LYS  17           1HZ      LYS  17   0.013  15.130   7.232
  146    HZ3  LYS  17           2HZ      LYS  17   0.170  13.576   7.759
  147    H    LEU  18           HN       LEU  18   4.264  10.322   2.204
  148    HA   LEU  18           HA       LEU  18   4.671   7.391   2.491
  149    HB2  LEU  18           2HB      LEU  18   5.975   9.267   0.499
  150    HB3  LEU  18           3HB      LEU  18   6.557   7.624   0.860
  151    HG   LEU  18           HG       LEU  18   3.824   8.292  -0.268
  152   HD11  LEU  18          1HD1      LEU  18   4.704   7.393  -2.382
  153   HD12  LEU  18          2HD1      LEU  18   5.619   8.824  -1.854
  154   HD13  LEU  18          3HD1      LEU  18   6.305   7.197  -1.631
  155   HD21  LEU  18          3HD2      LEU  18   3.896   6.213   1.041
  156   HD22  LEU  18          1HD2      LEU  18   3.697   5.869  -0.693
  157   HD23  LEU  18          2HD2      LEU  18   5.285   5.651   0.080
  158    H    HIS  19           HN       HIS  19   5.664   7.175   4.397
  159    HA   HIS  19           HA       HIS  19   7.383   9.343   5.380
  160    HB2  HIS  19           2HB      HIS  19   6.602   6.678   6.615
  161    HB3  HIS  19           3HB      HIS  19   7.562   7.936   7.418
  162    HD1  HIS  19           1HD      HIS  19   6.309   9.737   8.634
  163    HD2  HIS  19           2HD      HIS  19   3.855   7.500   6.099
  164    HE1  HIS  19           1HE      HIS  19   3.932  10.460   9.131
  165    HE2  HIS  19           2HE      HIS  19   2.443   9.098   7.589
  166    H    GLY  20           HN       GLY  20   9.559   8.812   6.285
  167    HA2  GLY  20           1HA      GLY  20  11.172   6.798   6.231
  168    HA3  GLY  20           2HA      GLY  20  10.909   6.884   4.474
  169    H    THR  21           HN       THR  21  13.405   7.022   5.054
  170    HA   THR  21           HA       THR  21  14.319   9.703   5.731
  171    HB   THR  21           HB       THR  21  16.579   8.634   5.067
  172    HG1  THR  21           1HG      THR  21  16.465   6.326   4.972
  173   HG21  THR  21          3HG2      THR  21  14.918   7.334   7.255
  174   HG22  THR  21          1HG2      THR  21  16.693   7.322   7.154
  175   HG23  THR  21          2HG2      THR  21  15.829   8.856   7.401
  176    H    GLY  22           HN       GLY  22  12.614   9.471   3.314
  177    HA2  GLY  22           1HA      GLY  22  12.614  10.698   1.348
  178    HA3  GLY  22           2HA      GLY  22  14.343  11.044   1.580
  179    H    ALA  23           HN       ALA  23  15.708   8.875   1.439
  180    HA   ALA  23           HA       ALA  23  15.664   8.101  -1.267
  181    HB1  ALA  23           1HB      ALA  23  17.322   6.407  -0.607
  182    HB2  ALA  23           2HB      ALA  23  17.653   7.974   0.167
  183    HB3  ALA  23           3HB      ALA  23  16.900   6.660   1.102
  184    H    LEU  24           HN       LEU  24  14.259   6.564   1.605
  185    HA   LEU  24           HA       LEU  24  13.452   4.138   0.358
  186    HB2  LEU  24           2HB      LEU  24  13.497   4.510   2.794
  187    HB3  LEU  24           3HB      LEU  24  12.156   5.670   2.636
  188    HG   LEU  24           HG       LEU  24  10.713   3.839   1.807
  189   HD11  LEU  24          1HD1      LEU  24  11.450   1.503   2.059
  190   HD12  LEU  24          2HD1      LEU  24  12.462   2.383   0.891
  191   HD13  LEU  24          3HD1      LEU  24  13.069   2.067   2.534
  192   HD21  LEU  24          3HD2      LEU  24  10.714   4.469   4.176
  193   HD22  LEU  24          1HD2      LEU  24  10.427   2.724   3.980
  194   HD23  LEU  24          2HD2      LEU  24  12.027   3.309   4.489
  195    H    LYS  25           HN       LYS  25  11.853   7.311   0.726
  196    HA   LYS  25           HA       LYS  25   9.353   6.610  -0.405
  197    HB2  LYS  25           2HB      LYS  25  10.752   9.288  -0.673
  198    HB3  LYS  25           3HB      LYS  25   9.002   8.967  -0.711
  199    HG2  LYS  25           2HG      LYS  25   9.042   8.343   1.643
  200    HG3  LYS  25           3HG      LYS  25  10.804   8.589   1.695
  201    HD2  LYS  25           2HD      LYS  25  10.428  10.971   1.028
  202    HD3  LYS  25           3HD      LYS  25   8.677  10.687   1.166
  203    HE2  LYS  25           2HE      LYS  25   8.994  10.049   3.536
  204    HE3  LYS  25           3HE      LYS  25  10.727  10.411   3.385
  205    HZ1  LYS  25           3HZ      LYS  25   8.534  12.340   3.013
  206    HZ2  LYS  25           1HZ      LYS  25   9.515  12.244   4.334
  207    HZ3  LYS  25           2HZ      LYS  25  10.143  12.676   2.873
  208    H    ARG  26           HN       ARG  26  12.385   7.772  -1.852
  209    HA   ARG  26           HA       ARG  26  11.446   8.111  -4.505
  210    HB2  ARG  26           2HB      ARG  26  13.577   8.987  -3.630
  211    HB3  ARG  26           3HB      ARG  26  14.201   7.324  -3.501
  212    HG2  ARG  26           2HG      ARG  26  15.118   8.359  -5.464
  213    HG3  ARG  26           3HG      ARG  26  13.968   7.094  -5.961
  214    HD2  ARG  26           2HD      ARG  26  12.303   8.702  -6.523
  215    HD3  ARG  26           3HD      ARG  26  13.209  10.015  -5.740
  216    HE   ARG  26           HE       ARG  26  14.692   8.740  -7.879
  217   HH11  ARG  26          2HH1      ARG  26  12.145  11.069  -7.196
  218   HH12  ARG  26          1HH1      ARG  26  12.477  12.037  -8.615
  219   HH21  ARG  26          2HH2      ARG  26  15.154  10.032  -9.694
  220   HH22  ARG  26          1HH2      ARG  26  14.184  11.449 -10.031
  221    H    ARG  27           HN       ARG  27  12.856   5.284  -2.832
  222    HA   ARG  27           HA       ARG  27  12.882   3.573  -5.114
  223    HB2  ARG  27           2HB      ARG  27  14.164   3.050  -3.131
  224    HB3  ARG  27           3HB      ARG  27  12.683   2.976  -2.146
  225    HG2  ARG  27           2HG      ARG  27  11.940   1.005  -3.366
  226    HG3  ARG  27           3HG      ARG  27  13.369   1.097  -4.423
  227    HD2  ARG  27           2HD      ARG  27  14.843   0.677  -2.551
  228    HD3  ARG  27           3HD      ARG  27  13.482   0.753  -1.411
  229    HE   ARG  27           HE       ARG  27  12.608  -1.263  -2.773
  230   HH11  ARG  27          2HH1      ARG  27  16.017  -0.558  -2.210
  231   HH12  ARG  27          1HH1      ARG  27  16.501  -2.237  -2.277
  232   HH21  ARG  27          2HH2      ARG  27  13.248  -3.439  -2.840
  233   HH22  ARG  27          1HH2      ARG  27  14.932  -3.868  -2.634
  234    H    ILE  28           HN       ILE  28  10.482   4.097  -2.521
  235    HA   ILE  28           HA       ILE  28   8.567   2.223  -3.392
  236    HB   ILE  28           HB       ILE  28   8.209   4.889  -1.966
  237   HG12  ILE  28          2HG1      ILE  28   8.331   2.048  -0.907
  238   HG13  ILE  28          3HG1      ILE  28   9.665   3.226  -0.848
  239   HG21  ILE  28          1HG2      ILE  28   6.035   4.020  -1.215
  240   HG22  ILE  28          2HG2      ILE  28   6.100   4.166  -2.986
  241   HG23  ILE  28          3HG2      ILE  28   6.269   2.570  -2.218
  242   HD11  ILE  28          3HD1      ILE  28   6.976   3.512   0.519
  243   HD12  ILE  28          1HD1      ILE  28   8.504   3.085   1.318
  244   HD13  ILE  28          2HD1      ILE  28   8.311   4.688   0.579
  245    H    MET  29           HN       MET  29   8.898   5.706  -4.190
  246    HA   MET  29           HA       MET  29   6.571   5.767  -5.858
  247    HB2  MET  29           2HB      MET  29   8.976   7.600  -5.671
  248    HB3  MET  29           3HB      MET  29   7.549   7.931  -6.682
  249    HG2  MET  29           2HG      MET  29   6.136   7.880  -4.654
  250    HG3  MET  29           3HG      MET  29   7.585   7.625  -3.668
  251    HE1  MET  29           3HE      MET  29   9.697   9.483  -5.225
  252    HE2  MET  29           1HE      MET  29   9.563  10.984  -4.281
  253    HE3  MET  29           2HE      MET  29   9.558   9.411  -3.452
  254    H    ASP  30           HN       ASP  30   9.934   4.946  -6.434
  255    HA   ASP  30           HA       ASP  30   9.899   5.308  -9.278
  256    HB2  ASP  30           2HB      ASP  30  11.918   5.094  -7.709
  257    HB3  ASP  30           3HB      ASP  30  11.630   3.341  -7.757
  258    HD2  ASP  30           2HD      ASP  30  13.356   5.076 -10.836
  259    H    MET  31           HN       MET  31   9.043   2.641  -7.120
  260    HA   MET  31           HA       MET  31   8.886   0.665  -9.224
  261    HB2  MET  31           2HB      MET  31   7.761   0.714  -6.406
  262    HB3  MET  31           3HB      MET  31   7.734  -0.699  -7.488
  263    HG2  MET  31           2HG      MET  31  10.172  -0.737  -7.525
  264    HG3  MET  31           3HG      MET  31  10.227   0.703  -6.495
  265    HE1  MET  31           3HE      MET  31   7.809   0.138  -4.476
  266    HE2  MET  31           1HE      MET  31   8.673  -0.642  -3.132
  267    HE3  MET  31           2HE      MET  31   9.400   0.751  -3.964
  268    H    GLY  32           HN       GLY  32   6.813   3.211  -8.155
  269    HA2  GLY  32           1HA      GLY  32   4.975   3.601  -9.822
  270    HA3  GLY  32           2HA      GLY  32   4.541   1.894  -9.575
  271    H    ILE  33           HN       ILE  33   5.320   2.304  -6.623
  272    HA   ILE  33           HA       ILE  33   2.652   2.875  -5.711
  273    HB   ILE  33           HB       ILE  33   5.160   2.840  -3.998
  274   HG12  ILE  33          2HG1      ILE  33   5.148   0.840  -5.411
  275   HG13  ILE  33          3HG1      ILE  33   4.829   0.441  -3.706
  276   HG21  ILE  33          1HG2      ILE  33   3.605   2.060  -2.255
  277   HG22  ILE  33          2HG2      ILE  33   3.100   3.632  -2.917
  278   HG23  ILE  33          3HG2      ILE  33   2.260   2.144  -3.417
  279   HD11  ILE  33          3HD1      ILE  33   2.757   0.634  -5.907
  280   HD12  ILE  33          1HD1      ILE  33   3.393  -0.872  -5.213
  281   HD13  ILE  33          2HD1      ILE  33   2.439   0.233  -4.202
  282    H    THR  34           HN       THR  34   1.854   4.892  -5.898
  283    HA   THR  34           HA       THR  34   3.684   7.128  -5.204
  284    HB   THR  34           HB       THR  34   2.235   8.319  -7.092
  285    HG1  THR  34           1HG      THR  34   1.801   6.785  -8.772
  286   HG21  THR  34          3HG2      THR  34   4.509   6.398  -7.708
  287   HG22  THR  34          1HG2      THR  34   3.999   7.763  -8.727
  288   HG23  THR  34          2HG2      THR  34   4.684   8.067  -7.114
  289    H    ARG  35           HN       ARG  35   2.674   9.112  -4.564
  290    HA   ARG  35           HA       ARG  35   0.503   8.682  -2.747
  291    HB2  ARG  35           2HB      ARG  35   1.725  11.254  -3.800
  292    HB3  ARG  35           3HB      ARG  35   0.617  11.128  -2.412
  293    HG2  ARG  35           2HG      ARG  35   2.245   9.789  -1.197
  294    HG3  ARG  35           3HG      ARG  35   3.344   9.816  -2.597
  295    HD2  ARG  35           2HD      ARG  35   4.070  11.449  -0.958
  296    HD3  ARG  35           3HD      ARG  35   3.477  12.282  -2.411
  297    HE   ARG  35           HE       ARG  35   1.453  11.945  -0.356
  298   HH11  ARG  35          2HH1      ARG  35   4.115  13.952  -1.492
  299   HH12  ARG  35          1HH1      ARG  35   3.524  15.399  -0.708
  300   HH21  ARG  35          2HH2      ARG  35   0.690  13.838   0.664
  301   HH22  ARG  35          1HH2      ARG  35   1.583  15.334   0.514
  302    H    GLY  36           HN       GLY  36  -1.479   8.204  -3.457
  303    HA2  GLY  36           1HA      GLY  36  -3.494   9.458  -4.263
  304    HA3  GLY  36           2HA      GLY  36  -2.532   9.853  -5.706
  305    H    CYS  37           HN       CYS  37  -1.298   7.074  -5.638
  306    HA   CYS  37           HA       CYS  37  -3.274   5.903  -7.383
  307    HB2  CYS  37           2HB      CYS  37  -1.722   4.109  -7.693
  308    HB3  CYS  37           3HB      CYS  37  -0.815   5.642  -7.675
  309    HG   CYS  37           HG       CYS  37   0.626   3.744  -6.603
  310    H    GLU  38           HN       GLU  38  -4.556   4.116  -7.103
  311    HA   GLU  38           HA       GLU  38  -5.216   3.496  -4.308
  312    HB2  GLU  38           2HB      GLU  38  -7.131   2.308  -5.271
  313    HB3  GLU  38           3HB      GLU  38  -7.025   3.978  -5.877
  314    HG2  GLU  38           2HG      GLU  38  -5.896   3.056  -7.927
  315    HG3  GLU  38           3HG      GLU  38  -6.294   1.431  -7.330
  316    HE2  GLU  38           2HE      GLU  38  -9.175   3.666  -8.874
  317    H    ILE  39           HN       ILE  39  -5.015   1.516  -3.354
  318    HA   ILE  39           HA       ILE  39  -3.491  -0.503  -4.913
  319    HB   ILE  39           HB       ILE  39  -3.119   0.242  -1.983
  320   HG12  ILE  39          2HG1      ILE  39  -1.313   0.590  -4.396
  321   HG13  ILE  39          3HG1      ILE  39  -2.121   1.882  -3.476
  322   HG21  ILE  39          1HG2      ILE  39  -1.304  -1.420  -2.003
  323   HG22  ILE  39          2HG2      ILE  39  -2.874  -2.169  -2.376
  324   HG23  ILE  39          3HG2      ILE  39  -1.710  -1.843  -3.682
  325   HD11  ILE  39          3HD1      ILE  39   0.014   0.012  -2.416
  326   HD12  ILE  39          1HD1      ILE  39   0.259   1.711  -2.870
  327   HD13  ILE  39          2HD1      ILE  39  -0.793   1.306  -1.498
  328    H    TYR  40           HN       TYR  40  -4.721  -2.235  -5.197
  329    HA   TYR  40           HA       TYR  40  -6.730  -2.941  -3.159
  330    HB2  TYR  40           2HB      TYR  40  -7.108  -3.039  -5.700
  331    HB3  TYR  40           3HB      TYR  40  -6.062  -4.469  -5.685
  332    HD1  TYR  40           1HD      TYR  40  -9.292  -3.091  -4.539
  333    HD2  TYR  40           2HD      TYR  40  -6.873  -6.588  -4.818
  334    HE1  TYR  40           1HE      TYR  40 -11.227  -4.474  -3.944
  335    HE2  TYR  40           2HE      TYR  40  -8.812  -7.974  -4.223
  336    HH   TYR  40           HH       TYR  40 -11.024  -8.015  -3.677
  337    H    ILE  41           HN       ILE  41  -5.957  -3.972  -1.419
  338    HA   ILE  41           HA       ILE  41  -3.448  -5.366  -1.450
  339    HB   ILE  41           HB       ILE  41  -5.601  -5.731   0.657
  340   HG12  ILE  41          2HG1      ILE  41  -5.380  -3.323   0.198
  341   HG13  ILE  41          3HG1      ILE  41  -4.750  -3.759   1.805
  342   HG21  ILE  41          1HG2      ILE  41  -3.652  -5.978   2.151
  343   HG22  ILE  41          2HG2      ILE  41  -3.593  -7.149   0.814
  344   HG23  ILE  41          3HG2      ILE  41  -2.562  -5.699   0.773
  345   HD11  ILE  41          3HD1      ILE  41  -3.092  -3.235  -0.674
  346   HD12  ILE  41          1HD1      ILE  41  -3.293  -2.118   0.691
  347   HD13  ILE  41          2HD1      ILE  41  -2.463  -3.669   0.933
  348    H    ARG  42           HN       ARG  42  -3.074  -7.298  -2.317
  349    HA   ARG  42           HA       ARG  42  -5.398  -8.926  -3.084
  350    HB2  ARG  42           2HB      ARG  42  -2.452  -9.240  -3.756
  351    HB3  ARG  42           3HB      ARG  42  -3.806 -10.124  -4.501
  352    HG2  ARG  42           2HG      ARG  42  -3.470  -7.116  -4.624
  353    HG3  ARG  42           3HG      ARG  42  -2.893  -8.239  -5.879
  354    HD2  ARG  42           2HD      ARG  42  -5.770  -8.205  -4.955
  355    HD3  ARG  42           3HD      ARG  42  -5.178  -7.123  -6.235
  356    HE   ARG  42           HE       ARG  42  -4.334  -9.472  -7.180
  357   HH11  ARG  42          2HH1      ARG  42  -7.423  -8.633  -5.710
  358   HH12  ARG  42          1HH1      ARG  42  -8.326  -9.801  -6.647
  359   HH21  ARG  42          2HH2      ARG  42  -5.522 -10.979  -8.404
  360   HH22  ARG  42          1HH2      ARG  42  -7.249 -11.130  -8.173
  361    H    LYS  43           HN       LYS  43  -2.216  -9.477  -1.480
  362    HA   LYS  43           HA       LYS  43  -3.489 -11.562   0.166
  363    HB2  LYS  43           2HB      LYS  43  -2.839 -12.821  -1.786
  364    HB3  LYS  43           3HB      LYS  43  -1.218 -12.085  -1.778
  365    HG2  LYS  43           2HG      LYS  43  -1.134 -14.369  -0.955
  366    HG3  LYS  43           3HG      LYS  43  -0.718 -13.219   0.339
  367    HD2  LYS  43           2HD      LYS  43  -2.981 -13.411   1.255
  368    HD3  LYS  43           3HD      LYS  43  -3.427 -14.528  -0.057
  369    HE2  LYS  43           2HE      LYS  43  -1.771 -16.140   0.712
  370    HE3  LYS  43           3HE      LYS  43  -1.226 -15.013   1.973
  371    HZ1  LYS  43           3HZ      LYS  43  -3.908 -16.209   1.787
  372    HZ2  LYS  43           1HZ      LYS  43  -2.725 -16.661   2.842
  373    HZ3  LYS  43           2HZ      LYS  43  -3.402 -15.163   2.958
  374    H    VAL  44           HN       VAL  44  -2.826 -11.288   2.190
  375    HA   VAL  44           HA       VAL  44  -0.116 -10.132   2.606
  376    HB   VAL  44           HB       VAL  44  -2.470 -10.260   4.531
  377   HG11  VAL  44          1HG1      VAL  44  -1.117  -8.785   5.962
  378   HG12  VAL  44          2HG1      VAL  44  -0.303 -10.339   5.673
  379   HG13  VAL  44          3HG1      VAL  44   0.220  -8.882   4.795
  380   HG21  VAL  44          3HG2      VAL  44  -2.872  -8.694   2.691
  381   HG22  VAL  44          1HG2      VAL  44  -2.616  -7.825   4.222
  382   HG23  VAL  44          2HG2      VAL  44  -1.312  -7.902   3.016
  383    H    ALA  45           HN       ALA  45   1.411 -11.505   3.246
  384    HA   ALA  45           HA       ALA  45   0.819 -14.228   3.896
  385    HB1  ALA  45           1HB      ALA  45   3.231 -14.401   4.359
  386    HB2  ALA  45           2HB      ALA  45   2.924 -13.529   2.839
  387    HB3  ALA  45           3HB      ALA  45   3.367 -12.628   4.309
  388    HA   PRO  46           HA       PRO  46  -0.123 -14.047   8.186
  389    HB2  PRO  46           2HB      PRO  46   1.005 -16.466   9.019
  390    HB3  PRO  46           3HB      PRO  46  -0.548 -16.303   8.136
  391    HG2  PRO  46           2HG      PRO  46   2.158 -16.922   7.048
  392    HG3  PRO  46           3HG      PRO  46   0.597 -17.735   6.700
  393    HD2  PRO  46           2HD      PRO  46   1.660 -15.936   5.005
  394    HD3  PRO  46           3HD      PRO  46  -0.101 -15.952   5.327
  395    H    LEU  47           HN       LEU  47   3.165 -14.381   7.070
  396    HA   LEU  47           HA       LEU  47   4.379 -13.991   9.689
  397    HB2  LEU  47           2HB      LEU  47   5.585 -13.574   6.939
  398    HB3  LEU  47           3HB      LEU  47   6.450 -13.840   8.472
  399    HG   LEU  47           HG       LEU  47   4.663 -15.875   7.119
  400   HD11  LEU  47          1HD1      LEU  47   6.756 -17.008   6.495
  401   HD12  LEU  47          2HD1      LEU  47   6.652 -15.388   5.767
  402   HD13  LEU  47          3HD1      LEU  47   7.690 -15.660   7.187
  403   HD21  LEU  47          3HD2      LEU  47   4.842 -16.138   9.552
  404   HD22  LEU  47          1HD2      LEU  47   5.698 -17.447   8.705
  405   HD23  LEU  47          2HD2      LEU  47   6.618 -16.108   9.430
  406    H    GLY  48           HN       GLY  48   2.708 -12.044   7.511
  407    HA2  GLY  48           1HA      GLY  48   2.307  -9.737   7.830
  408    HA3  GLY  48           2HA      GLY  48   3.833  -9.603   8.734
  409    H    ASP  49           HN       ASP  49   5.015 -11.352   6.498
  410    HA   ASP  49           HA       ASP  49   5.179  -9.360   4.324
  411    HB2  ASP  49           2HB      ASP  49   6.916  -8.690   5.922
  412    HB3  ASP  49           3HB      ASP  49   7.558 -10.347   5.940
  413    HD2  ASP  49           2HD      ASP  49   9.432  -9.741   3.134
  414    HA   PRO  50           HA       PRO  50   5.968  -9.118   2.633
  415    HB2  PRO  50           2HB      PRO  50   5.927  -9.493  -0.063
  416    HB3  PRO  50           3HB      PRO  50   7.393  -9.825   0.916
  417    HG2  PRO  50           2HG      PRO  50   5.435 -11.730  -0.230
  418    HG3  PRO  50           3HG      PRO  50   7.212 -11.899  -0.056
  419    HD2  PRO  50           2HD      PRO  50   5.190 -12.960   1.646
  420    HD3  PRO  50           3HD      PRO  50   6.940 -12.857   2.006
  421    H    ILE  51           HN       ILE  51   4.486  -7.795   1.205
  422    HA   ILE  51           HA       ILE  51   1.750  -8.940   1.405
  423    HB   ILE  51           HB       ILE  51   2.664  -6.036   1.376
  424   HG12  ILE  51          2HG1      ILE  51   1.470  -7.763   3.567
  425   HG13  ILE  51          3HG1      ILE  51   3.161  -7.217   3.463
  426   HG21  ILE  51          1HG2      ILE  51   0.306  -5.481   1.822
  427   HG22  ILE  51          2HG2      ILE  51   0.493  -6.311   0.260
  428   HG23  ILE  51          3HG2      ILE  51  -0.126  -7.200   1.672
  429   HD11  ILE  51          3HD1      ILE  51   0.733  -5.436   3.783
  430   HD12  ILE  51          1HD1      ILE  51   1.884  -5.859   5.068
  431   HD13  ILE  51          2HD1      ILE  51   2.424  -4.891   3.681
  432    H    GLN  52           HN       GLN  52   0.876  -9.571  -0.443
  433    HA   GLN  52           HA       GLN  52   1.927  -8.589  -2.991
  434    HB2  GLN  52           2HB      GLN  52  -0.198 -10.618  -2.252
  435    HB3  GLN  52           3HB      GLN  52   0.135 -10.133  -3.932
  436    HG2  GLN  52           2HG      GLN  52   1.285 -12.166  -3.569
  437    HG3  GLN  52           3HG      GLN  52   2.511 -10.880  -3.571
  438   HE21  GLN  52          1HE2      GLN  52   3.653 -10.405  -1.692
  439   HE22  GLN  52          2HE2      GLN  52   3.611 -11.449  -0.287
  440    H    ILE  53           HN       ILE  53   1.160  -6.894  -4.034
  441    HA   ILE  53           HA       ILE  53  -1.668  -6.117  -3.607
  442    HB   ILE  53           HB       ILE  53  -0.931  -3.705  -3.590
  443   HG12  ILE  53          2HG1      ILE  53   1.800  -4.927  -3.085
  444   HG13  ILE  53          3HG1      ILE  53   1.304  -4.044  -4.549
  445   HG21  ILE  53          1HG2      ILE  53  -0.312  -3.684  -1.209
  446   HG22  ILE  53          2HG2      ILE  53  -1.605  -4.861  -1.534
  447   HG23  ILE  53          3HG2      ILE  53   0.067  -5.420  -1.293
  448   HD11  ILE  53          3HD1      ILE  53   1.470  -2.897  -1.750
  449   HD12  ILE  53          1HD1      ILE  53   2.640  -2.614  -3.056
  450   HD13  ILE  53          2HD1      ILE  53   0.975  -2.015  -3.214
  451    H    ASN  54           HN       ASN  54  -2.615  -4.958  -5.334
  452    HA   ASN  54           HA       ASN  54  -1.030  -5.111  -7.855
  453    HB2  ASN  54           2HB      ASN  54  -3.110  -6.526  -7.697
  454    HB3  ASN  54           3HB      ASN  54  -4.050  -5.023  -7.564
  455   HD21  ASN  54          1HD2      ASN  54  -3.996  -7.211  -9.624
  456   HD22  ASN  54          2HD2      ASN  54  -3.719  -6.393 -11.147
  457    H    VAL  55           HN       VAL  55  -0.240  -3.232  -8.426
  458    HA   VAL  55           HA       VAL  55  -1.902  -0.804  -8.003
  459    HB   VAL  55           HB       VAL  55   1.113  -0.967  -7.622
  460   HG11  VAL  55          1HG1      VAL  55   0.903   1.331  -6.772
  461   HG12  VAL  55          2HG1      VAL  55   0.331   1.202  -8.451
  462   HG13  VAL  55          3HG1      VAL  55  -0.842   1.297  -7.116
  463   HG21  VAL  55          3HG2      VAL  55  -0.054  -2.126  -5.811
  464   HG22  VAL  55          1HG2      VAL  55   0.678  -0.612  -5.231
  465   HG23  VAL  55          2HG2      VAL  55  -1.072  -0.692  -5.540
  466    H    ARG  56           HN       ARG  56  -2.121   0.437  -9.754
  467    HA   ARG  56           HA       ARG  56  -1.862   1.282 -11.857
  468    HB2  ARG  56           2HB      ARG  56   1.016   0.360 -11.570
  469    HB3  ARG  56           3HB      ARG  56   0.395   1.490 -12.797
  470    HG2  ARG  56           2HG      ARG  56   0.416   1.963  -9.804
  471    HG3  ARG  56           3HG      ARG  56   1.564   2.650 -10.978
  472    HD2  ARG  56           2HD      ARG  56  -0.399   3.701 -12.150
  473    HD3  ARG  56           3HD      ARG  56  -1.418   3.160 -10.800
  474    HE   ARG  56           HE       ARG  56   0.587   4.524  -9.541
  475   HH11  ARG  56          2HH1      ARG  56  -1.634   5.292 -12.158
  476   HH12  ARG  56          1HH1      ARG  56  -1.640   7.009 -11.825
  477   HH21  ARG  56          2HH2      ARG  56   0.597   6.784  -9.128
  478   HH22  ARG  56          1HH2      ARG  56  -0.377   7.855 -10.110
  479    H    GLY  57           HN       GLY  57  -2.234  -1.773 -11.284
  480    HA2  GLY  57           1HA      GLY  57  -3.079  -3.269 -12.931
  481    HA3  GLY  57           2HA      GLY  57  -2.032  -2.503 -14.148
  482    H    TYR  58           HN       TYR  58  -0.016  -2.720 -11.639
  483    HA   TYR  58           HA       TYR  58   0.988  -5.367 -12.535
  484    HB2  TYR  58           2HB      TYR  58   2.411  -3.270 -10.862
  485    HB3  TYR  58           3HB      TYR  58   3.128  -4.679 -11.662
  486    HD1  TYR  58           2HD      TYR  58   3.354  -4.699 -14.152
  487    HD2  TYR  58           1HD      TYR  58   2.032  -1.230 -12.063
  488    HE1  TYR  58           2HE      TYR  58   3.842  -3.322 -16.126
  489    HE2  TYR  58           1HE      TYR  58   2.519   0.149 -14.035
  490    HH   TYR  58           HH       TYR  58   3.830  -1.236 -17.038
  491    H    GLU  59           HN       GLU  59   0.863  -7.086 -11.208
  492    HA   GLU  59           HA       GLU  59   0.152  -6.552  -8.373
  493    HB2  GLU  59           2HB      GLU  59  -1.363  -7.975  -9.737
  494    HB3  GLU  59           3HB      GLU  59  -0.028  -9.135  -9.936
  495    HG2  GLU  59           2HG      GLU  59   0.004  -9.596  -7.582
  496    HG3  GLU  59           3HG      GLU  59  -1.169  -8.301  -7.263
  497    HE2  GLU  59           2HE      GLU  59  -3.819 -10.272  -8.447
  498    H    LEU  60           HN       LEU  60   1.712  -6.636  -6.972
  499    HA   LEU  60           HA       LEU  60   4.021  -8.417  -7.471
  500    HB2  LEU  60           2HB      LEU  60   5.542  -6.478  -6.896
  501    HB3  LEU  60           3HB      LEU  60   4.773  -6.429  -8.501
  502    HG   LEU  60           HG       LEU  60   3.029  -4.886  -7.378
  503   HD11  LEU  60          1HD1      LEU  60   3.877  -3.550  -5.492
  504   HD12  LEU  60          2HD1      LEU  60   3.714  -5.266  -5.055
  505   HD13  LEU  60          3HD1      LEU  60   5.320  -4.585  -5.411
  506   HD21  LEU  60          3HD2      LEU  60   4.652  -4.174  -9.072
  507   HD22  LEU  60          1HD2      LEU  60   4.428  -2.915  -7.836
  508   HD23  LEU  60          2HD2      LEU  60   5.881  -3.940  -7.805
  509    H    SER  61           HN       SER  61   5.627  -8.181  -5.569
  510    HA   SER  61           HA       SER  61   4.012  -8.161  -3.072
  511    HB2  SER  61           2HB      SER  61   6.687  -9.486  -3.654
  512    HB3  SER  61           3HB      SER  61   5.748  -9.618  -2.148
  513    HG   SER  61           HG       SER  61   5.421 -11.406  -3.559
  514    H    LEU  62           HN       LEU  62   4.330  -6.531  -1.711
  515    HA   LEU  62           HA       LEU  62   6.855  -4.980  -1.968
  516    HB2  LEU  62           2HB      LEU  62   4.769  -3.723  -2.307
  517    HB3  LEU  62           3HB      LEU  62   4.209  -4.229  -0.695
  518    HG   LEU  62           HG       LEU  62   6.151  -3.019   0.294
  519   HD11  LEU  62          1HD1      LEU  62   7.354  -1.372  -1.084
  520   HD12  LEU  62          2HD1      LEU  62   7.626  -3.031  -1.665
  521   HD13  LEU  62          3HD1      LEU  62   6.498  -1.959  -2.529
  522   HD21  LEU  62          3HD2      LEU  62   3.919  -2.011   0.183
  523   HD22  LEU  62          1HD2      LEU  62   5.186  -0.777  -0.005
  524   HD23  LEU  62          2HD2      LEU  62   4.291  -1.354  -1.429
  525    H    ARG  63           HN       ARG  63   8.242  -4.855  -0.306
  526    HA   ARG  63           HA       ARG  63   8.070  -6.794   1.778
  527    HB2  ARG  63           2HB      ARG  63  10.103  -5.508   0.663
  528    HB3  ARG  63           3HB      ARG  63   9.833  -4.384   2.017
  529    HG2  ARG  63           2HG      ARG  63  11.554  -6.068   2.522
  530    HG3  ARG  63           3HG      ARG  63  10.155  -6.184   3.615
  531    HD2  ARG  63           2HD      ARG  63  10.006  -8.343   3.083
  532    HD3  ARG  63           3HD      ARG  63   9.534  -7.846   1.444
  533    HE   ARG  63           HE       ARG  63  12.225  -7.771   1.268
  534   HH11  ARG  63          2HH1      ARG  63  10.060 -10.179   2.670
  535   HH12  ARG  63          1HH1      ARG  63  11.093 -11.530   2.262
  536   HH21  ARG  63          2HH2      ARG  63  13.550  -9.545   0.718
  537   HH22  ARG  63          1HH2      ARG  63  13.070 -11.169   1.156
  538    H    LYS  64           HN       LYS  64   7.451  -6.673   3.857
  539    HA   LYS  64           HA       LYS  64   5.521  -4.794   4.656
  540    HB2  LYS  64           2HB      LYS  64   5.863  -7.080   5.597
  541    HB3  LYS  64           3HB      LYS  64   7.306  -6.474   6.446
  542    HG2  LYS  64           2HG      LYS  64   4.672  -5.108   6.865
  543    HG3  LYS  64           3HG      LYS  64   4.993  -6.660   7.674
  544    HD2  LYS  64           2HD      LYS  64   7.058  -4.497   7.826
  545    HD3  LYS  64           3HD      LYS  64   5.593  -4.359   8.827
  546    HE2  LYS  64           2HE      LYS  64   6.045  -6.569   9.799
  547    HE3  LYS  64           3HE      LYS  64   7.501  -6.719   8.792
  548    HZ1  LYS  64           3HZ      LYS  64   7.042  -4.658  10.843
  549    HZ2  LYS  64           1HZ      LYS  64   8.024  -5.972  11.004
  550    HZ3  LYS  64           2HZ      LYS  64   8.393  -4.797   9.908
  551    H    SER  65           HN       SER  65   9.030  -4.744   4.935
  552    HA   SER  65           HA       SER  65   9.404  -2.762   6.870
  553    HB2  SER  65           2HB      SER  65  10.933  -2.985   4.255
  554    HB3  SER  65           3HB      SER  65  11.529  -2.372   5.817
  555    HG   SER  65           HG       SER  65  12.173  -4.543   5.409
  556    H    ALA  66           HN       ALA  66   8.753  -2.380   3.362
  557    HA   ALA  66           HA       ALA  66   8.640   0.508   3.552
  558    HB1  ALA  66           1HB      ALA  66   7.870   0.388   1.217
  559    HB2  ALA  66           2HB      ALA  66   9.306  -0.628   1.479
  560    HB3  ALA  66           3HB      ALA  66   7.695  -1.376   1.366
  561    H    ALA  67           HN       ALA  67   6.265  -2.150   3.353
  562    HA   ALA  67           HA       ALA  67   3.935  -0.590   3.095
  563    HB1  ALA  67           1HB      ALA  67   2.745  -2.564   3.967
  564    HB2  ALA  67           2HB      ALA  67   3.998  -3.030   2.795
  565    HB3  ALA  67           3HB      ALA  67   4.288  -3.240   4.538
  566    H    GLU  68           HN       GLU  68   5.899  -1.318   5.897
  567    HA   GLU  68           HA       GLU  68   3.871  -0.520   7.823
  568    HB2  GLU  68           2HB      GLU  68   5.845  -2.202   8.063
  569    HB3  GLU  68           3HB      GLU  68   6.827  -0.749   8.368
  570    HG2  GLU  68           2HG      GLU  68   5.224  -0.157  10.197
  571    HG3  GLU  68           3HG      GLU  68   4.458  -1.743   9.956
  572    HE2  GLU  68           2HE      GLU  68   7.877  -1.550  11.904
  573    H    MET  69           HN       MET  69   5.949   1.146   5.734
  574    HA   MET  69           HA       MET  69   6.113   3.468   7.595
  575    HB2  MET  69           2HB      MET  69   8.232   2.415   6.625
  576    HB3  MET  69           3HB      MET  69   7.704   3.061   5.053
  577    HG2  MET  69           2HG      MET  69   9.191   4.667   5.822
  578    HG3  MET  69           3HG      MET  69   7.607   5.338   6.246
  579    HE1  MET  69           3HE      MET  69   6.705   3.851   8.861
  580    HE2  MET  69           1HE      MET  69   7.440   4.847  10.134
  581    HE3  MET  69           2HE      MET  69   6.710   5.624   8.714
  582    H    ILE  70           HN       ILE  70   4.694   2.250   4.696
  583    HA   ILE  70           HA       ILE  70   4.222   4.819   3.449
  584    HB   ILE  70           HB       ILE  70   2.984   2.078   2.979
  585   HG12  ILE  70          2HG1      ILE  70   5.076   3.653   1.449
  586   HG13  ILE  70          3HG1      ILE  70   5.382   2.244   2.493
  587   HG21  ILE  70          1HG2      ILE  70   2.117   2.997   0.867
  588   HG22  ILE  70          2HG2      ILE  70   1.438   3.848   2.274
  589   HG23  ILE  70          3HG2      ILE  70   2.733   4.605   1.315
  590   HD11  ILE  70          3HD1      ILE  70   3.744   2.248  -0.054
  591   HD12  ILE  70          1HD1      ILE  70   5.393   1.611   0.116
  592   HD13  ILE  70          2HD1      ILE  70   4.053   0.840   0.990
  593    H    GLU  71           HN       GLU  71   2.534   6.165   3.617
  594    HA   GLU  71           HA       GLU  71   0.511   5.522   5.688
  595    HB2  GLU  71           2HB      GLU  71   1.811   7.610   5.916
  596    HB3  GLU  71           3HB      GLU  71   1.217   8.144   4.326
  597    HG2  GLU  71           2HG      GLU  71  -0.751   8.822   5.153
  598    HG3  GLU  71           3HG      GLU  71  -0.909   7.403   6.211
  599    HE2  GLU  71           2HE      GLU  71  -0.014  10.694   7.920
  600    H    VAL  72           HN       VAL  72  -1.307   4.640   4.952
  601    HA   VAL  72           HA       VAL  72  -2.415   5.715   2.411
  602    HB   VAL  72           HB       VAL  72  -3.380   3.484   1.946
  603   HG11  VAL  72          1HG1      VAL  72  -1.309   2.375   1.222
  604   HG12  VAL  72          2HG1      VAL  72  -1.260   4.124   0.903
  605   HG13  VAL  72          3HG1      VAL  72  -0.367   3.445   2.285
  606   HG21  VAL  72          3HG2      VAL  72  -3.460   2.630   4.242
  607   HG22  VAL  72          1HG2      VAL  72  -2.594   1.501   3.174
  608   HG23  VAL  72          2HG2      VAL  72  -1.682   2.552   4.283
  609    H    GLU  73           HN       GLU  73  -4.815   5.170   2.223
  610    HA   GLU  73           HA       GLU  73  -6.083   5.265   4.917
  611    HB2  GLU  73           2HB      GLU  73  -6.995   6.717   2.413
  612    HB3  GLU  73           3HB      GLU  73  -7.813   6.724   3.994
  613    HG2  GLU  73           2HG      GLU  73  -5.702   7.739   4.940
  614    HG3  GLU  73           3HG      GLU  73  -5.154   7.950   3.263
  615    HE2  GLU  73           2HE      GLU  73  -7.608  10.431   2.707
  616    H    LEU  74           HN       LEU  74  -7.716   3.862   5.253
  617    HA   LEU  74           HA       LEU  74  -8.418   1.985   3.131
  618    HB2  LEU  74           2HB      LEU  74  -8.207   1.568   5.698
  619    HB3  LEU  74           3HB      LEU  74  -9.847   2.255   5.771
  620    HG   LEU  74           HG       LEU  74  -9.820  -0.211   5.778
  621   HD11  LEU  74          1HD1      LEU  74 -11.515  -0.561   4.032
  622   HD12  LEU  74          2HD1      LEU  74 -11.775   0.970   4.898
  623   HD13  LEU  74          3HD1      LEU  74 -11.047   0.978   3.274
  624   HD21  LEU  74          3HD2      LEU  74  -7.824  -0.546   4.402
  625   HD22  LEU  74          1HD2      LEU  74  -9.212  -1.439   3.740
  626   HD23  LEU  74          2HD2      LEU  74  -8.691   0.082   2.980
  627    H    GLU  75           HN       GLU  75  -9.439   3.157   1.514
  628    HA   GLU  75           HA       GLU  75 -11.494   5.084   2.197
  629    HB2  GLU  75           2HB      GLU  75 -10.045   5.335   0.204
  630    HB3  GLU  75           3HB      GLU  75 -10.801   3.886  -0.500
  631    HG2  GLU  75           2HG      GLU  75 -13.017   5.070  -0.302
  632    HG3  GLU  75           3HG      GLU  75 -12.115   6.535   0.141
  633    HE2  GLU  75           2HE      GLU  75 -12.177   5.389  -3.630
  634    H    HIS  76           HN       HIS  76 -13.373   4.461   2.941
  635    HA   HIS  76           HA       HIS  76 -14.642   2.061   1.724
  636    HB2  HIS  76           2HB      HIS  76 -14.248   1.709   4.067
  637    HB3  HIS  76           3HB      HIS  76 -14.907   3.303   4.478
  638    HD1  HIS  76           1HD      HIS  76 -17.030   3.004   5.656
  639    HD2  HIS  76           2HD      HIS  76 -16.609   0.267   2.529
  640    HE1  HIS  76           1HE      HIS  76 -19.173   1.661   5.604
  641    HE2  HIS  76           2HE      HIS  76 -18.917  -0.000   3.701
  642    H    HIS  77           HN       HIS  77 -15.533   3.159  -0.034
  643    HA   HIS  77           HA       HIS  77 -17.622   5.141   0.705
  644    HB2  HIS  77           2HB      HIS  77 -17.637   5.864  -1.593
  645    HB3  HIS  77           3HB      HIS  77 -15.978   5.912  -0.968
  646    HD1  HIS  77           1HD      HIS  77 -14.245   4.908  -2.434
  647    HD2  HIS  77           2HD      HIS  77 -18.069   3.465  -3.299
  648    HE1  HIS  77           1HE      HIS  77 -14.009   3.480  -4.512
  649    HE2  HIS  77           2HE      HIS  77 -16.332   2.602  -5.034
  650    H    HIS  78           HN       HIS  78 -19.696   4.941  -0.594
  651    HA   HIS  78           HA       HIS  78 -20.380   2.057  -0.537
  652    HB2  HIS  78           2HB      HIS  78 -22.661   2.689  -0.177
  653    HB3  HIS  78           3HB      HIS  78 -21.642   3.591   0.961
  654    HD1  HIS  78           1HD      HIS  78 -24.445   4.051  -1.186
  655    HD2  HIS  78           2HD      HIS  78 -21.106   6.363  -0.204
  656    HE1  HIS  78           1HE      HIS  78 -25.045   6.445  -1.768
  657    HE2  HIS  78           2HE      HIS  78 -23.012   7.839  -1.172
  658    H    HIS  79           HN       HIS  79 -22.008   1.280  -2.095
  659    HA   HIS  79           HA       HIS  79 -21.310   2.282  -4.790
  660    HB2  HIS  79           2HB      HIS  79 -22.662  -0.268  -3.844
  661    HB3  HIS  79           3HB      HIS  79 -22.392   0.152  -5.546
  662    HD1  HIS  79           1HD      HIS  79 -19.908   0.156  -6.400
  663    HD2  HIS  79           2HD      HIS  79 -20.446  -1.283  -2.514
  664    HE1  HIS  79           1HE      HIS  79 -17.769  -1.066  -5.793
  665    HE2  HIS  79           2HE      HIS  79 -18.106  -1.936  -3.433
  666    H    HIS  80           HN       HIS  80 -22.939   2.694  -6.368
  667    HA   HIS  80           HA       HIS  80 -25.727   2.824  -5.531
  668    HB2  HIS  80           2HB      HIS  80 -26.009   5.184  -5.563
  669    HB3  HIS  80           3HB      HIS  80 -24.645   4.860  -4.477
  670    HD1  HIS  80           1HD      HIS  80 -25.530   7.353  -6.626
  671    HD2  HIS  80           2HD      HIS  80 -22.146   4.911  -6.506
  672    HE1  HIS  80           1HE      HIS  80 -23.717   8.595  -7.884
  673    HE2  HIS  80           2HE      HIS  80 -21.664   7.107  -7.809
  674    H    HIS  81           HN       HIS  81 -27.015   4.051  -7.314
  675    HA   HIS  81           HA       HIS  81 -26.045   3.077  -9.906
  676    HB2  HIS  81           2HB      HIS  81 -28.631   4.390  -9.016
  677    HB3  HIS  81           3HB      HIS  81 -28.278   3.967 -10.702
  678    HD1  HIS  81           1HD      HIS  81 -30.088   2.685  -7.964
  679    HD2  HIS  81           2HD      HIS  81 -27.419   0.994 -10.699
  680    HE1  HIS  81           1HE      HIS  81 -30.535   0.190  -7.941
  681    HE2  HIS  81           2HE      HIS  81 -28.911  -0.826  -9.601
  Start of MODEL    2
    1    H1   MET   1           HN       MET   1  -1.636   3.152  14.288
    2    HA   MET   1           HA       MET   1  -1.766   5.353  12.496
    3    HB2  MET   1           2HB      MET   1   0.253   5.000  11.137
    4    HB3  MET   1           3HB      MET   1   0.642   5.551  12.783
    5    HG2  MET   1           2HG      MET   1   1.365   3.371  13.430
    6    HG3  MET   1           3HG      MET   1   0.730   2.647  11.943
    7    HE1  MET   1           3HE      MET   1   1.573   4.607   9.676
    8    HE2  MET   1           1HE      MET   1   3.157   3.948   9.203
    9    HE3  MET   1           2HE      MET   1   1.819   2.845   9.598
   10    H    PHE   2           HN       PHE   2  -2.066   4.682  10.252
   11    HA   PHE   2           HA       PHE   2  -2.679   1.769  10.038
   12    HB2  PHE   2           2HB      PHE   2  -4.674   3.319  10.064
   13    HB3  PHE   2           3HB      PHE   2  -4.055   4.046   8.571
   14    HD1  PHE   2           2HD      PHE   2  -5.414   0.948  10.064
   15    HD2  PHE   2           1HD      PHE   2  -4.336   2.953   6.465
   16    HE1  PHE   2           2HE      PHE   2  -6.560  -0.787   8.756
   17    HE2  PHE   2           1HE      PHE   2  -5.479   1.218   5.153
   18    HZ   PHE   2           HZ       PHE   2  -6.596  -0.655   6.297
   19    H    SER   3           HN       SER   3  -0.991   0.931   8.949
   20    HA   SER   3           HA       SER   3   0.184   2.519   6.746
   21    HB2  SER   3           2HB      SER   3   2.009   0.872   6.827
   22    HB3  SER   3           3HB      SER   3   1.722   1.598   8.427
   23    HG   SER   3           HG       SER   3   1.980  -0.687   8.521
   24    H    LEU   4           HN       LEU   4   0.967   1.070   4.837
   25    HA   LEU   4           HA       LEU   4  -1.348  -0.038   3.572
   26    HB2  LEU   4           2HB      LEU   4   0.667   0.984   2.456
   27    HB3  LEU   4           3HB      LEU   4   1.554  -0.510   2.844
   28    HG   LEU   4           HG       LEU   4   0.035  -1.803   1.447
   29   HD11  LEU   4          1HD1      LEU   4  -1.656  -0.690   0.049
   30   HD12  LEU   4          2HD1      LEU   4  -1.996  -0.467   1.781
   31   HD13  LEU   4          3HD1      LEU   4  -1.283   0.862   0.834
   32   HD21  LEU   4          3HD2      LEU   4   2.034  -0.803   0.430
   33   HD22  LEU   4          1HD2      LEU   4   0.697  -0.886  -0.740
   34   HD23  LEU   4          2HD2      LEU   4   1.105   0.663   0.034
   35    H    ARG   5           HN       ARG   5   0.978  -1.281   5.766
   36    HA   ARG   5           HA       ARG   5   0.697  -4.084   5.133
   37    HB2  ARG   5           2HB      ARG   5   2.661  -3.237   6.259
   38    HB3  ARG   5           3HB      ARG   5   1.667  -2.548   7.565
   39    HG2  ARG   5           2HG      ARG   5   0.971  -4.861   8.164
   40    HG3  ARG   5           3HG      ARG   5   2.129  -5.470   6.959
   41    HD2  ARG   5           2HD      ARG   5   3.025  -5.449   9.283
   42    HD3  ARG   5           3HD      ARG   5   3.976  -4.474   8.142
   43    HE   ARG   5           HE       ARG   5   2.574  -2.517   9.092
   44   HH11  ARG   5          2HH1      ARG   5   3.493  -5.376  10.934
   45   HH12  ARG   5          1HH1      ARG   5   3.551  -4.528  12.463
   46   HH21  ARG   5          2HH2      ARG   5   2.684  -1.410  11.084
   47   HH22  ARG   5          1HH2      ARG   5   3.091  -2.278  12.547
   48    H    ASP   6           HN       ASP   6  -1.185  -1.751   6.902
   49    HA   ASP   6           HA       ASP   6  -2.419  -3.744   8.641
   50    HB2  ASP   6           2HB      ASP   6  -2.948  -0.795   8.178
   51    HB3  ASP   6           3HB      ASP   6  -3.883  -1.796   9.310
   52    HD2  ASP   6           2HD      ASP   6  -1.238  -1.904  11.588
   53    H    ALA   7           HN       ALA   7  -2.879  -2.701   5.438
   54    HA   ALA   7           HA       ALA   7  -5.771  -3.079   5.414
   55    HB1  ALA   7           1HB      ALA   7  -5.556  -2.745   2.985
   56    HB2  ALA   7           2HB      ALA   7  -4.699  -1.478   3.893
   57    HB3  ALA   7           3HB      ALA   7  -3.785  -2.803   3.136
   58    H    LYS   8           HN       LYS   8  -6.910  -4.755   4.384
   59    HA   LYS   8           HA       LYS   8  -5.386  -7.302   4.406
   60    HB2  LYS   8           2HB      LYS   8  -8.381  -6.817   4.498
   61    HB3  LYS   8           3HB      LYS   8  -7.563  -8.391   4.642
   62    HG2  LYS   8           2HG      LYS   8  -7.301  -6.074   6.578
   63    HG3  LYS   8           3HG      LYS   8  -8.298  -7.528   6.820
   64    HD2  LYS   8           2HD      LYS   8  -6.276  -8.928   6.718
   65    HD3  LYS   8           3HD      LYS   8  -5.281  -7.468   6.488
   66    HE2  LYS   8           2HE      LYS   8  -5.189  -8.154   8.811
   67    HE3  LYS   8           3HE      LYS   8  -6.073  -6.618   8.677
   68    HZ1  LYS   8           3HZ      LYS   8  -7.301  -9.280   8.958
   69    HZ2  LYS   8           1HZ      LYS   8  -7.175  -8.151  10.152
   70    HZ3  LYS   8           2HZ      LYS   8  -8.119  -7.854   8.834
   71    H    CYS   9           HN       CYS   9  -6.337  -9.003   2.882
   72    HA   CYS   9           HA       CYS   9  -5.880  -8.125   0.212
   73    HB2  CYS   9           2HB      CYS   9  -6.865 -10.494  -0.263
   74    HB3  CYS   9           3HB      CYS   9  -5.306 -10.324   0.583
   75    HG   CYS   9           HG       CYS   9  -6.641 -12.341   1.574
   76    H    GLY  10           HN       GLY  10  -7.215  -6.720  -0.743
   77    HA2  GLY  10           1HA      GLY  10  -9.301  -6.833  -2.125
   78    HA3  GLY  10           2HA      GLY  10 -10.129  -7.356  -0.640
   79    H    GLN  11           HN       GLN  11  -8.381  -5.456   0.946
   80    HA   GLN  11           HA       GLN  11 -10.204  -3.229   0.860
   81    HB2  GLN  11           2HB      GLN  11  -7.785  -3.986   2.445
   82    HB3  GLN  11           3HB      GLN  11  -8.274  -2.275   2.426
   83    HG2  GLN  11           2HG      GLN  11  -9.200  -3.435   4.356
   84    HG3  GLN  11           3HG      GLN  11 -10.486  -2.884   3.261
   85   HE21  GLN  11          1HE2      GLN  11 -11.978  -4.359   4.095
   86   HE22  GLN  11          2HE2      GLN  11 -11.879  -6.073   3.751
   87    H    THR  12           HN       THR  12 -10.139  -1.478  -0.338
   88    HA   THR  12           HA       THR  12  -7.671  -0.914  -1.871
   89    HB   THR  12           HB       THR  12 -10.420   0.341  -2.207
   90    HG1  THR  12           1HG      THR  12 -10.662  -1.233  -3.885
   91   HG21  THR  12          3HG2      THR  12  -8.042   0.070  -4.082
   92   HG22  THR  12          1HG2      THR  12  -9.597   0.836  -4.482
   93   HG23  THR  12          2HG2      THR  12  -8.544   1.556  -3.241
   94    H    VAL  13           HN       VAL  13  -6.318   0.425  -0.879
   95    HA   VAL  13           HA       VAL  13  -7.484   2.729   0.603
   96    HB   VAL  13           HB       VAL  13  -5.366   2.837   1.850
   97   HG11  VAL  13          1HG1      VAL  13  -5.602   0.785   3.184
   98   HG12  VAL  13          2HG1      VAL  13  -7.186   1.473   2.760
   99   HG13  VAL  13          3HG1      VAL  13  -6.568   0.053   1.883
  100   HG21  VAL  13          3HG2      VAL  13  -3.879   1.954   0.117
  101   HG22  VAL  13          1HG2      VAL  13  -3.676   1.065   1.643
  102   HG23  VAL  13          2HG2      VAL  13  -4.603   0.340   0.310
  103    H    LYS  14           HN       LYS  14  -5.923   4.660   0.635
  104    HA   LYS  14           HA       LYS  14  -4.539   4.927  -1.989
  105    HB2  LYS  14           2HB      LYS  14  -6.766   5.987  -2.092
  106    HB3  LYS  14           3HB      LYS  14  -6.355   6.972  -0.667
  107    HG2  LYS  14           2HG      LYS  14  -4.549   7.135  -3.036
  108    HG3  LYS  14           3HG      LYS  14  -6.153   7.897  -3.155
  109    HD2  LYS  14           2HD      LYS  14  -4.121   8.416  -0.963
  110    HD3  LYS  14           3HD      LYS  14  -4.412   9.467  -2.369
  111    HE2  LYS  14           2HE      LYS  14  -6.488   8.730  -0.285
  112    HE3  LYS  14           3HE      LYS  14  -5.559  10.244  -0.306
  113    HZ1  LYS  14           3HZ      LYS  14  -7.405   9.336  -2.413
  114    HZ2  LYS  14           1HZ      LYS  14  -7.720  10.513  -1.304
  115    HZ3  LYS  14           2HZ      LYS  14  -6.543  10.742  -2.434
  116    H    VAL  15           HN       VAL  15  -2.511   5.678  -1.827
  117    HA   VAL  15           HA       VAL  15  -1.388   6.092   0.788
  118    HB   VAL  15           HB       VAL  15  -0.174   6.613  -1.954
  119   HG11  VAL  15          1HG1      VAL  15   1.993   6.478  -0.799
  120   HG12  VAL  15          2HG1      VAL  15   1.001   7.814  -0.170
  121   HG13  VAL  15          3HG1      VAL  15   1.151   6.302   0.758
  122   HG21  VAL  15          3HG2      VAL  15  -0.871   4.283  -1.647
  123   HG22  VAL  15          1HG2      VAL  15   0.902   4.421  -1.659
  124   HG23  VAL  15          2HG2      VAL  15   0.038   4.206  -0.118
  125    H    VAL  16           HN       VAL  16  -1.099   7.899   1.930
  126    HA   VAL  16           HA       VAL  16  -1.686  10.454   0.528
  127    HB   VAL  16           HB       VAL  16  -2.304  11.280   2.882
  128   HG11  VAL  16          1HG1      VAL  16  -4.599  10.422   2.684
  129   HG12  VAL  16          2HG1      VAL  16  -3.938  10.887   1.099
  130   HG13  VAL  16          3HG1      VAL  16  -4.032   9.169   1.556
  131   HG21  VAL  16          3HG2      VAL  16  -1.348   9.407   4.146
  132   HG22  VAL  16          1HG2      VAL  16  -3.092   9.562   4.461
  133   HG23  VAL  16          2HG2      VAL  16  -2.496   8.290   3.370
  134    H    LYS  17           HN       LYS  17   0.400   8.818   2.871
  135    HA   LYS  17           HA       LYS  17   2.330  11.039   2.528
  136    HB2  LYS  17           2HB      LYS  17   0.906  11.336   4.634
  137    HB3  LYS  17           3HB      LYS  17   1.705   9.870   5.251
  138    HG2  LYS  17           2HG      LYS  17   3.853  10.942   5.195
  139    HG3  LYS  17           3HG      LYS  17   3.174  12.366   4.371
  140    HD2  LYS  17           2HD      LYS  17   3.480  12.870   6.721
  141    HD3  LYS  17           3HD      LYS  17   1.739  12.785   6.358
  142    HE2  LYS  17           2HE      LYS  17   1.729  10.440   7.217
  143    HE3  LYS  17           3HE      LYS  17   3.431  10.643   7.686
  144    HZ1  LYS  17           3HZ      LYS  17   1.175  12.242   8.696
  145    HZ2  LYS  17           1HZ      LYS  17   1.950  11.046   9.523
  146    HZ3  LYS  17           2HZ      LYS  17   2.755  12.430   9.130
  147    H    LEU  18           HN       LEU  18   4.498  10.415   2.784
  148    HA   LEU  18           HA       LEU  18   4.883   7.473   3.063
  149    HB2  LEU  18           2HB      LEU  18   6.362   9.435   1.290
  150    HB3  LEU  18           3HB      LEU  18   6.808   7.728   1.526
  151    HG   LEU  18           HG       LEU  18   4.162   8.673   0.382
  152   HD11  LEU  18          1HD1      LEU  18   5.040   7.949  -1.799
  153   HD12  LEU  18          2HD1      LEU  18   6.016   9.268  -1.110
  154   HD13  LEU  18          3HD1      LEU  18   6.612   7.591  -1.046
  155   HD21  LEU  18          3HD2      LEU  18   4.088   6.470   1.468
  156   HD22  LEU  18          1HD2      LEU  18   3.917   6.317  -0.295
  157   HD23  LEU  18          2HD2      LEU  18   5.470   5.933   0.483
  158    H    HIS  19           HN       HIS  19   5.973   6.930   4.807
  159    HA   HIS  19           HA       HIS  19   7.121   8.973   6.495
  160    HB2  HIS  19           2HB      HIS  19   7.061   5.949   6.672
  161    HB3  HIS  19           3HB      HIS  19   7.806   6.984   7.904
  162    HD1  HIS  19           1HD      HIS  19   5.995   5.735   9.459
  163    HD2  HIS  19           2HD      HIS  19   4.502   8.487   6.692
  164    HE1  HIS  19           1HE      HIS  19   3.647   6.300  10.222
  165    HE2  HIS  19           2HE      HIS  19   2.747   7.973   8.544
  166    H    GLY  20           HN       GLY  20   8.362   6.594   4.207
  167    HA2  GLY  20           1HA      GLY  20  11.035   6.460   5.055
  168    HA3  GLY  20           2HA      GLY  20  10.478   6.279   3.375
  169    H    THR  21           HN       THR  21  12.636   7.902   5.181
  170    HA   THR  21           HA       THR  21  12.114  10.618   4.416
  171    HB   THR  21           HB       THR  21  14.759   9.410   5.299
  172    HG1  THR  21           1HG      THR  21  14.001  10.013   7.403
  173   HG21  THR  21          3HG2      THR  21  13.621  12.224   5.512
  174   HG22  THR  21          1HG2      THR  21  15.193  11.689   6.152
  175   HG23  THR  21          2HG2      THR  21  14.905  11.701   4.396
  176    H    GLY  22           HN       GLY  22  11.733  10.463   2.174
  177    HA2  GLY  22           1HA      GLY  22  12.415  11.174   0.113
  178    HA3  GLY  22           2HA      GLY  22  14.075  11.295   0.740
  179    H    ALA  23           HN       ALA  23  15.289   9.188   0.939
  180    HA   ALA  23           HA       ALA  23  15.420   7.995  -1.608
  181    HB1  ALA  23           1HB      ALA  23  16.962   6.383  -0.567
  182    HB2  ALA  23           2HB      ALA  23  17.292   8.044  -0.020
  183    HB3  ALA  23           3HB      ALA  23  16.423   6.912   1.044
  184    H    LEU  24           HN       LEU  24  13.993   6.761   1.429
  185    HA   LEU  24           HA       LEU  24  13.193   4.251   0.283
  186    HB2  LEU  24           2HB      LEU  24  13.546   4.944   2.753
  187    HB3  LEU  24           3HB      LEU  24  11.887   5.580   2.656
  188    HG   LEU  24           HG       LEU  24  12.125   3.305   3.686
  189   HD11  LEU  24          1HD1      LEU  24  10.180   2.339   2.532
  190   HD12  LEU  24          2HD1      LEU  24   9.986   4.087   2.789
  191   HD13  LEU  24          3HD1      LEU  24  10.427   3.466   1.179
  192   HD21  LEU  24          3HD2      LEU  24  13.879   2.440   2.205
  193   HD22  LEU  24          1HD2      LEU  24  12.453   1.379   2.188
  194   HD23  LEU  24          2HD2      LEU  24  12.751   2.488   0.830
  195    H    LYS  25           HN       LYS  25  11.576   7.404   0.752
  196    HA   LYS  25           HA       LYS  25   8.988   6.416  -0.026
  197    HB2  LYS  25           2HB      LYS  25   8.276   8.692   0.040
  198    HB3  LYS  25           3HB      LYS  25   9.381   8.410   1.405
  199    HG2  LYS  25           2HG      LYS  25  10.335  10.312   0.783
  200    HG3  LYS  25           3HG      LYS  25  11.075   9.350  -0.520
  201    HD2  LYS  25           2HD      LYS  25   9.334   9.980  -2.059
  202    HD3  LYS  25           3HD      LYS  25   8.412  10.778  -0.763
  203    HE2  LYS  25           2HE      LYS  25  10.311  12.344  -0.433
  204    HE3  LYS  25           3HE      LYS  25  11.138  11.586  -1.812
  205    HZ1  LYS  25           3HZ      LYS  25   8.544  12.969  -1.919
  206    HZ2  LYS  25           1HZ      LYS  25   9.979  13.576  -2.456
  207    HZ3  LYS  25           2HZ      LYS  25   9.312  12.265  -3.198
  208    H    ARG  26           HN       ARG  26  11.771   7.659  -1.764
  209    HA   ARG  26           HA       ARG  26  10.320   8.054  -4.255
  210    HB2  ARG  26           2HB      ARG  26  12.673   8.975  -3.334
  211    HB3  ARG  26           3HB      ARG  26  13.261   7.556  -4.232
  212    HG2  ARG  26           2HG      ARG  26  11.535   9.755  -5.397
  213    HG3  ARG  26           3HG      ARG  26  13.305   9.654  -5.551
  214    HD2  ARG  26           2HD      ARG  26  13.164   7.643  -6.830
  215    HD3  ARG  26           3HD      ARG  26  11.433   7.461  -6.473
  216    HE   ARG  26           HE       ARG  26  12.165   9.921  -7.872
  217   HH11  ARG  26          2HH1      ARG  26  11.263   6.535  -8.217
  218   HH12  ARG  26          1HH1      ARG  26  10.550   6.761  -9.798
  219   HH21  ARG  26          2HH2      ARG  26  11.197  10.218  -9.895
  220   HH22  ARG  26          1HH2      ARG  26  10.513   8.853 -10.750
  221    H    ARG  27           HN       ARG  27  12.198   5.502  -2.685
  222    HA   ARG  27           HA       ARG  27  12.527   3.744  -4.866
  223    HB2  ARG  27           2HB      ARG  27  13.119   3.759  -2.168
  224    HB3  ARG  27           3HB      ARG  27  11.914   2.455  -2.295
  225    HG2  ARG  27           2HG      ARG  27  14.080   1.479  -2.502
  226    HG3  ARG  27           3HG      ARG  27  13.313   1.446  -4.109
  227    HD2  ARG  27           2HD      ARG  27  14.628   3.269  -4.880
  228    HD3  ARG  27           3HD      ARG  27  15.182   3.660  -3.237
  229    HE   ARG  27           HE       ARG  27  15.898   1.006  -4.296
  230   HH11  ARG  27          2HH1      ARG  27  16.862   4.357  -3.774
  231   HH12  ARG  27          1HH1      ARG  27  18.573   4.001  -3.800
  232   HH21  ARG  27          2HH2      ARG  27  18.138   0.550  -4.273
  233   HH22  ARG  27          1HH2      ARG  27  19.294   1.849  -4.082
  234    H    ILE  28           HN       ILE  28   9.858   4.018  -2.487
  235    HA   ILE  28           HA       ILE  28   8.268   1.895  -3.443
  236    HB   ILE  28           HB       ILE  28   7.278   4.544  -2.310
  237   HG12  ILE  28          2HG1      ILE  28   8.058   2.006  -0.838
  238   HG13  ILE  28          3HG1      ILE  28   9.051   3.482  -0.923
  239   HG21  ILE  28          1HG2      ILE  28   5.367   3.204  -1.523
  240   HG22  ILE  28          2HG2      ILE  28   5.522   3.136  -3.294
  241   HG23  ILE  28          3HG2      ILE  28   6.060   1.761  -2.300
  242   HD11  ILE  28          3HD1      ILE  28   6.291   3.262   0.305
  243   HD12  ILE  28          1HD1      ILE  28   7.821   3.358   1.203
  244   HD13  ILE  28          2HD1      ILE  28   7.284   4.737   0.220
  245    H    MET  29           HN       MET  29   8.517   5.287  -4.463
  246    HA   MET  29           HA       MET  29   6.355   5.272  -6.317
  247    HB2  MET  29           2HB      MET  29   8.903   6.922  -6.242
  248    HB3  MET  29           3HB      MET  29   7.506   7.252  -7.296
  249    HG2  MET  29           2HG      MET  29   6.097   7.645  -5.357
  250    HG3  MET  29           3HG      MET  29   7.427   7.217  -4.268
  251    HE1  MET  29           3HE      MET  29   6.965   9.537  -2.987
  252    HE2  MET  29           1HE      MET  29   6.971  11.123  -3.790
  253    HE3  MET  29           2HE      MET  29   5.689   9.947  -4.157
  254    H    ASP  30           HN       ASP  30   9.690   4.187  -6.510
  255    HA   ASP  30           HA       ASP  30   9.889   4.076  -9.348
  256    HB2  ASP  30           2HB      ASP  30  11.387   2.990  -7.026
  257    HB3  ASP  30           3HB      ASP  30  11.590   2.128  -8.566
  258    HD2  ASP  30           2HD      ASP  30  13.143   5.748  -8.193
  259    H    MET  31           HN       MET  31   8.499   1.847  -6.963
  260    HA   MET  31           HA       MET  31   8.181  -0.258  -8.953
  261    HB2  MET  31           2HB      MET  31   7.323   0.122  -6.102
  262    HB3  MET  31           3HB      MET  31   6.528  -1.120  -7.099
  263    HG2  MET  31           2HG      MET  31   8.223  -2.299  -6.042
  264    HG3  MET  31           3HG      MET  31   8.921  -1.929  -7.627
  265    HE1  MET  31           3HE      MET  31   8.999  -1.295  -3.791
  266    HE2  MET  31           1HE      MET  31  10.055   0.127  -3.638
  267    HE3  MET  31           2HE      MET  31   8.445   0.295  -4.370
  268    H    GLY  32           HN       GLY  32   6.559   2.660  -8.234
  269    HA2  GLY  32           1HA      GLY  32   4.914   3.340  -9.899
  270    HA3  GLY  32           2HA      GLY  32   4.275   1.681  -9.877
  271    H    ILE  33           HN       ILE  33   5.041   2.537  -6.734
  272    HA   ILE  33           HA       ILE  33   2.209   3.290  -6.249
  273    HB   ILE  33           HB       ILE  33   4.272   2.115  -4.343
  274   HG12  ILE  33          2HG1      ILE  33   2.441   0.278  -4.241
  275   HG13  ILE  33          3HG1      ILE  33   1.888   0.969  -5.785
  276   HG21  ILE  33          1HG2      ILE  33   2.440   2.012  -2.697
  277   HG22  ILE  33          2HG2      ILE  33   2.774   3.686  -3.193
  278   HG23  ILE  33          3HG2      ILE  33   1.360   2.827  -3.851
  279   HD11  ILE  33          3HD1      ILE  33   4.645  -0.147  -5.222
  280   HD12  ILE  33          1HD1      ILE  33   3.369  -0.959  -6.152
  281   HD13  ILE  33          2HD1      ILE  33   4.090   0.543  -6.766
  282    H    THR  34           HN       THR  34   1.874   5.398  -5.957
  283    HA   THR  34           HA       THR  34   3.799   6.847  -4.249
  284    HB   THR  34           HB       THR  34   4.445   7.348  -6.584
  285    HG1  THR  34           1HG      THR  34   4.280   9.640  -6.373
  286   HG21  THR  34          3HG2      THR  34   1.634   8.462  -6.843
  287   HG22  THR  34          1HG2      THR  34   2.927   8.613  -8.055
  288   HG23  THR  34          2HG2      THR  34   2.265   7.011  -7.660
  289    H    ARG  35           HN       ARG  35   2.861   9.078  -3.690
  290    HA   ARG  35           HA       ARG  35   0.389   8.630  -2.363
  291    HB2  ARG  35           2HB      ARG  35   0.506  11.167  -2.011
  292    HB3  ARG  35           3HB      ARG  35   1.836  10.177  -1.364
  293    HG2  ARG  35           2HG      ARG  35   3.287  10.820  -3.148
  294    HG3  ARG  35           3HG      ARG  35   1.953  11.600  -4.031
  295    HD2  ARG  35           2HD      ARG  35   2.905  12.482  -1.293
  296    HD3  ARG  35           3HD      ARG  35   3.509  13.172  -2.816
  297    HE   ARG  35           HE       ARG  35   0.833  13.453  -3.108
  298   HH11  ARG  35          2HH1      ARG  35   2.945  14.135  -0.382
  299   HH12  ARG  35          1HH1      ARG  35   2.011  15.512   0.161
  300   HH21  ARG  35          2HH2      ARG  35  -0.361  15.271  -2.425
  301   HH22  ARG  35          1HH2      ARG  35   0.133  16.157  -1.000
  302    H    GLY  36           HN       GLY  36  -1.668   8.976  -2.881
  303    HA2  GLY  36           1HA      GLY  36  -3.375  10.215  -4.026
  304    HA3  GLY  36           2HA      GLY  36  -2.223  10.544  -5.341
  305    H    CYS  37           HN       CYS  37  -1.393   7.553  -4.977
  306    HA   CYS  37           HA       CYS  37  -3.335   6.607  -6.971
  307    HB2  CYS  37           2HB      CYS  37  -0.815   5.338  -5.863
  308    HB3  CYS  37           3HB      CYS  37  -1.796   4.703  -7.207
  309    HG   CYS  37           HG       CYS  37   0.443   5.687  -8.127
  310    H    GLU  38           HN       GLU  38  -4.393   4.561  -6.825
  311    HA   GLU  38           HA       GLU  38  -5.185   3.940  -4.035
  312    HB2  GLU  38           2HB      GLU  38  -6.463   3.232  -6.697
  313    HB3  GLU  38           3HB      GLU  38  -7.114   2.818  -5.094
  314    HG2  GLU  38           2HG      GLU  38  -7.391   5.172  -4.565
  315    HG3  GLU  38           3HG      GLU  38  -6.650   5.632  -6.114
  316    HE2  GLU  38           2HE      GLU  38 -10.387   4.275  -6.154
  317    H    ILE  39           HN       ILE  39  -4.637   2.093  -3.083
  318    HA   ILE  39           HA       ILE  39  -3.514  -0.066  -4.793
  319    HB   ILE  39           HB       ILE  39  -2.521   0.848  -2.061
  320   HG12  ILE  39          2HG1      ILE  39  -0.312   0.937  -3.453
  321   HG13  ILE  39          3HG1      ILE  39  -1.415   1.060  -4.844
  322   HG21  ILE  39          1HG2      ILE  39  -0.855  -0.953  -2.243
  323   HG22  ILE  39          2HG2      ILE  39  -2.513  -1.598  -2.243
  324   HG23  ILE  39          3HG2      ILE  39  -1.601  -1.486  -3.768
  325   HD11  ILE  39          3HD1      ILE  39  -1.337   2.928  -2.465
  326   HD12  ILE  39          1HD1      ILE  39  -0.691   3.280  -4.082
  327   HD13  ILE  39          2HD1      ILE  39  -2.438   3.052  -3.858
  328    H    TYR  40           HN       TYR  40  -4.701  -1.869  -4.630
  329    HA   TYR  40           HA       TYR  40  -5.905  -2.414  -1.965
  330    HB2  TYR  40           2HB      TYR  40  -7.640  -3.654  -2.970
  331    HB3  TYR  40           3HB      TYR  40  -7.536  -2.115  -3.840
  332    HD1  TYR  40           2HD      TYR  40  -6.493  -2.091  -6.153
  333    HD2  TYR  40           1HD      TYR  40  -7.414  -5.711  -4.101
  334    HE1  TYR  40           2HE      TYR  40  -6.415  -3.319  -8.281
  335    HE2  TYR  40           1HE      TYR  40  -7.349  -6.934  -6.225
  336    HH   TYR  40           HH       TYR  40  -6.652  -5.328  -9.321
  337    H    ILE  41           HN       ILE  41  -5.467  -4.304  -0.963
  338    HA   ILE  41           HA       ILE  41  -2.974  -5.509  -1.803
  339    HB   ILE  41           HB       ILE  41  -4.714  -6.547   0.448
  340   HG12  ILE  41          2HG1      ILE  41  -4.667  -4.103   0.668
  341   HG13  ILE  41          3HG1      ILE  41  -3.723  -4.900   1.950
  342   HG21  ILE  41          1HG2      ILE  41  -2.527  -7.029   1.475
  343   HG22  ILE  41          2HG2      ILE  41  -2.669  -7.784  -0.129
  344   HG23  ILE  41          3HG2      ILE  41  -1.709  -6.300   0.073
  345   HD11  ILE  41          3HD1      ILE  41  -2.594  -3.564  -0.523
  346   HD12  ILE  41          1HD1      ILE  41  -2.576  -2.886   1.118
  347   HD13  ILE  41          2HD1      ILE  41  -1.650  -4.359   0.760
  348    H    ARG  42           HN       ARG  42  -2.588  -7.477  -2.656
  349    HA   ARG  42           HA       ARG  42  -4.891  -8.987  -3.681
  350    HB2  ARG  42           2HB      ARG  42  -3.028  -8.610  -5.188
  351    HB3  ARG  42           3HB      ARG  42  -1.888  -9.312  -4.015
  352    HG2  ARG  42           2HG      ARG  42  -2.262 -10.963  -5.678
  353    HG3  ARG  42           3HG      ARG  42  -3.170 -11.478  -4.236
  354    HD2  ARG  42           2HD      ARG  42  -4.719 -11.829  -5.920
  355    HD3  ARG  42           3HD      ARG  42  -5.155 -10.200  -5.359
  356    HE   ARG  42           HE       ARG  42  -3.310 -10.486  -7.656
  357   HH11  ARG  42          2HH1      ARG  42  -6.353  -9.359  -6.288
  358   HH12  ARG  42          1HH1      ARG  42  -6.867  -8.571  -7.763
  359   HH21  ARG  42          2HH2      ARG  42  -4.031  -9.541  -9.598
  360   HH22  ARG  42          1HH2      ARG  42  -5.550  -8.675  -9.638
  361    H    LYS  43           HN       LYS  43  -1.971  -9.594  -1.698
  362    HA   LYS  43           HA       LYS  43  -3.480 -11.538  -0.084
  363    HB2  LYS  43           2HB      LYS  43  -1.090 -12.223  -1.798
  364    HB3  LYS  43           3HB      LYS  43  -1.449 -13.122  -0.305
  365    HG2  LYS  43           2HG      LYS  43  -3.617 -13.775  -1.198
  366    HG3  LYS  43           3HG      LYS  43  -3.306 -12.835  -2.677
  367    HD2  LYS  43           2HD      LYS  43  -1.426 -14.250  -3.240
  368    HD3  LYS  43           3HD      LYS  43  -1.576 -15.124  -1.697
  369    HE2  LYS  43           2HE      LYS  43  -3.746 -15.030  -3.807
  370    HE3  LYS  43           3HE      LYS  43  -2.524 -16.316  -3.698
  371    HZ1  LYS  43           3HZ      LYS  43  -4.464 -15.616  -1.601
  372    HZ2  LYS  43           1HZ      LYS  43  -4.557 -16.926  -2.595
  373    HZ3  LYS  43           2HZ      LYS  43  -3.331 -16.809  -1.500
  374    H    VAL  44           HN       VAL  44  -2.810 -11.568   2.000
  375    HA   VAL  44           HA       VAL  44  -0.204 -10.248   2.590
  376    HB   VAL  44           HB       VAL  44  -2.611 -10.509   4.434
  377   HG11  VAL  44          1HG1      VAL  44  -1.343  -9.022   5.931
  378   HG12  VAL  44          2HG1      VAL  44  -0.461 -10.534   5.615
  379   HG13  VAL  44          3HG1      VAL  44   0.019  -9.034   4.786
  380   HG21  VAL  44          3HG2      VAL  44  -3.042  -8.911   2.629
  381   HG22  VAL  44          1HG2      VAL  44  -2.852  -8.075   4.187
  382   HG23  VAL  44          2HG2      VAL  44  -1.522  -8.065   3.006
  383    H    ALA  45           HN       ALA  45   1.293 -11.766   2.989
  384    HA   ALA  45           HA       ALA  45   0.671 -14.466   3.586
  385    HB1  ALA  45           1HB      ALA  45   3.074 -14.697   4.067
  386    HB2  ALA  45           2HB      ALA  45   2.796 -13.751   2.586
  387    HB3  ALA  45           3HB      ALA  45   3.237 -12.926   4.102
  388    HA   PRO  46           HA       PRO  46  -0.343 -14.370   7.834
  389    HB2  PRO  46           2HB      PRO  46   0.412 -16.939   8.566
  390    HB3  PRO  46           3HB      PRO  46  -1.032 -16.551   7.575
  391    HG2  PRO  46           2HG      PRO  46   1.672 -17.420   6.665
  392    HG3  PRO  46           3HG      PRO  46   0.067 -18.039   6.156
  393    HD2  PRO  46           2HD      PRO  46   1.473 -16.268   4.668
  394    HD3  PRO  46           3HD      PRO  46  -0.308 -16.155   4.807
  395    H    LEU  47           HN       LEU  47   2.879 -14.667   6.750
  396    HA   LEU  47           HA       LEU  47   4.047 -14.729   9.447
  397    HB2  LEU  47           2HB      LEU  47   5.385 -14.212   6.777
  398    HB3  LEU  47           3HB      LEU  47   6.168 -14.662   8.311
  399    HG   LEU  47           HG       LEU  47   4.277 -16.426   6.734
  400   HD11  LEU  47          1HD1      LEU  47   6.292 -17.710   6.140
  401   HD12  LEU  47          2HD1      LEU  47   6.380 -16.041   5.531
  402   HD13  LEU  47          3HD1      LEU  47   7.302 -16.510   6.978
  403   HD21  LEU  47          3HD2      LEU  47   4.274 -16.871   9.148
  404   HD22  LEU  47          1HD2      LEU  47   5.057 -18.197   8.257
  405   HD23  LEU  47          2HD2      LEU  47   6.048 -17.007   9.132
  406    H    GLY  48           HN       GLY  48   2.626 -12.472   7.391
  407    HA2  GLY  48           1HA      GLY  48   2.404 -10.180   8.125
  408    HA3  GLY  48           2HA      GLY  48   4.067 -10.253   8.753
  409    H    ASP  49           HN       ASP  49   5.078 -11.688   6.427
  410    HA   ASP  49           HA       ASP  49   4.520  -9.959   4.126
  411    HB2  ASP  49           2HB      ASP  49   6.690  -9.122   3.814
  412    HB3  ASP  49           3HB      ASP  49   6.364  -8.855   5.540
  413    HD2  ASP  49           2HD      ASP  49   8.844 -11.127   6.478
  414    HA   PRO  50           HA       PRO  50   6.082  -9.682   2.300
  415    HB2  PRO  50           2HB      PRO  50   5.779 -10.310  -0.342
  416    HB3  PRO  50           3HB      PRO  50   7.293 -10.653   0.558
  417    HG2  PRO  50           2HG      PRO  50   5.044 -12.508  -0.079
  418    HG3  PRO  50           3HG      PRO  50   6.807 -12.775  -0.281
  419    HD2  PRO  50           2HD      PRO  50   5.337 -13.703   1.853
  420    HD3  PRO  50           3HD      PRO  50   7.064 -13.250   1.979
  421    H    ILE  51           HN       ILE  51   4.659  -8.225   1.250
  422    HA   ILE  51           HA       ILE  51   1.824  -9.085   1.380
  423    HB   ILE  51           HB       ILE  51   3.058  -6.300   1.393
  424   HG12  ILE  51          2HG1      ILE  51   1.694  -7.879   3.598
  425   HG13  ILE  51          3HG1      ILE  51   3.449  -7.624   3.446
  426   HG21  ILE  51          1HG2      ILE  51   0.782  -5.509   1.901
  427   HG22  ILE  51          2HG2      ILE  51   0.846  -6.328   0.323
  428   HG23  ILE  51          3HG2      ILE  51   0.168  -7.171   1.736
  429   HD11  ILE  51          3HD1      ILE  51   1.365  -5.464   3.848
  430   HD12  ILE  51          1HD1      ILE  51   2.465  -6.089   5.096
  431   HD13  ILE  51          2HD1      ILE  51   3.122  -5.210   3.699
  432    H    GLN  52           HN       GLN  52   0.955  -9.631  -0.510
  433    HA   GLN  52           HA       GLN  52   2.188  -8.658  -2.997
  434    HB2  GLN  52           2HB      GLN  52  -0.210 -10.482  -2.630
  435    HB3  GLN  52           3HB      GLN  52   0.749 -10.244  -4.110
  436    HG2  GLN  52           2HG      GLN  52   1.659 -11.566  -1.544
  437    HG3  GLN  52           3HG      GLN  52   1.297 -12.365  -3.089
  438   HE21  GLN  52          1HE2      GLN  52   3.588 -10.460  -1.265
  439   HE22  GLN  52          2HE2      GLN  52   4.914 -10.593  -2.400
  440    H    ILE  53           HN       ILE  53   1.506  -6.835  -3.954
  441    HA   ILE  53           HA       ILE  53  -1.334  -6.067  -3.510
  442    HB   ILE  53           HB       ILE  53  -0.551  -3.676  -3.810
  443   HG12  ILE  53          2HG1      ILE  53   1.934  -3.442  -2.979
  444   HG13  ILE  53          3HG1      ILE  53   2.111  -5.057  -3.707
  445   HG21  ILE  53          1HG2      ILE  53   0.189  -3.449  -1.473
  446   HG22  ILE  53          2HG2      ILE  53  -1.143  -4.618  -1.623
  447   HG23  ILE  53          3HG2      ILE  53   0.528  -5.196  -1.414
  448   HD11  ILE  53          3HD1      ILE  53   1.169  -2.557  -5.129
  449   HD12  ILE  53          1HD1      ILE  53   2.780  -3.290  -5.280
  450   HD13  ILE  53          2HD1      ILE  53   1.350  -4.171  -5.857
  451    H    ASN  54           HN       ASN  54  -2.393  -4.922  -5.250
  452    HA   ASN  54           HA       ASN  54  -1.058  -5.426  -7.873
  453    HB2  ASN  54           2HB      ASN  54  -3.068  -6.838  -7.456
  454    HB3  ASN  54           3HB      ASN  54  -4.035  -5.358  -7.271
  455   HD21  ASN  54          1HD2      ASN  54  -1.401  -5.813  -9.616
  456   HD22  ASN  54          2HD2      ASN  54  -2.416  -5.757 -11.043
  457    H    VAL  55           HN       VAL  55  -0.277  -3.572  -8.600
  458    HA   VAL  55           HA       VAL  55  -2.077  -1.223  -8.677
  459    HB   VAL  55           HB       VAL  55   0.831  -1.025  -7.791
  460   HG11  VAL  55          1HG1      VAL  55   0.263   1.313  -7.279
  461   HG12  VAL  55          2HG1      VAL  55  -0.017   0.934  -8.994
  462   HG13  VAL  55          3HG1      VAL  55  -1.392   1.039  -7.868
  463   HG21  VAL  55          3HG2      VAL  55  -0.493  -2.093  -6.033
  464   HG22  VAL  55          1HG2      VAL  55  -0.011  -0.449  -5.558
  465   HG23  VAL  55          2HG2      VAL  55  -1.673  -0.763  -6.106
  466    H    ARG  56           HN       ARG  56  -1.851  -0.026 -10.536
  467    HA   ARG  56           HA       ARG  56  -1.113   0.602 -12.610
  468    HB2  ARG  56           2HB      ARG  56   1.550  -0.608 -11.786
  469    HB3  ARG  56           3HB      ARG  56   1.267   0.531 -13.124
  470    HG2  ARG  56           2HG      ARG  56   0.755   1.172 -10.210
  471    HG3  ARG  56           3HG      ARG  56   2.266   1.553 -11.070
  472    HD2  ARG  56           2HD      ARG  56  -0.464   2.487 -11.988
  473    HD3  ARG  56           3HD      ARG  56   0.589   3.438 -10.917
  474    HE   ARG  56           HE       ARG  56   2.235   2.892 -13.008
  475   HH11  ARG  56          2HH1      ARG  56  -1.100   4.027 -12.921
  476   HH12  ARG  56          1HH1      ARG  56  -0.921   5.050 -14.329
  477   HH21  ARG  56          2HH2      ARG  56   2.481   4.279 -14.801
  478   HH22  ARG  56          1HH2      ARG  56   1.112   5.193 -15.394
  479    H    GLY  57           HN       GLY  57  -2.012  -2.272 -11.867
  480    HA2  GLY  57           1HA      GLY  57  -2.626  -4.012 -13.298
  481    HA3  GLY  57           2HA      GLY  57  -1.523  -3.375 -14.539
  482    H    TYR  58           HN       TYR  58   0.268  -3.375 -11.789
  483    HA   TYR  58           HA       TYR  58   1.499  -5.963 -12.546
  484    HB2  TYR  58           2HB      TYR  58   2.542  -3.693 -10.813
  485    HB3  TYR  58           3HB      TYR  58   3.440  -5.160 -11.241
  486    HD1  TYR  58           1HD      TYR  58   4.130  -5.514 -13.636
  487    HD2  TYR  58           2HD      TYR  58   2.460  -1.835 -12.292
  488    HE1  TYR  58           1HE      TYR  58   5.047  -4.377 -15.607
  489    HE2  TYR  58           2HE      TYR  58   3.360  -0.700 -14.274
  490    HH   TYR  58           HH       TYR  58   4.575  -0.895 -16.188
  491    H    GLU  59           HN       GLU  59   1.704  -7.666 -11.126
  492    HA   GLU  59           HA       GLU  59   0.643  -7.253  -8.396
  493    HB2  GLU  59           2HB      GLU  59   1.383  -9.827  -8.352
  494    HB3  GLU  59           3HB      GLU  59  -0.202  -9.267  -8.937
  495    HG2  GLU  59           2HG      GLU  59   0.640 -10.909 -10.450
  496    HG3  GLU  59           3HG      GLU  59   0.678  -9.324 -11.250
  497    HE2  GLU  59           2HE      GLU  59   4.023  -9.619 -11.857
  498    H    LEU  60           HN       LEU  60   2.017  -6.480  -6.936
  499    HA   LEU  60           HA       LEU  60   4.892  -7.095  -7.392
  500    HB2  LEU  60           2HB      LEU  60   3.608  -4.632  -6.183
  501    HB3  LEU  60           3HB      LEU  60   5.358  -4.929  -6.301
  502    HG   LEU  60           HG       LEU  60   3.469  -4.689  -8.658
  503   HD11  LEU  60          1HD1      LEU  60   4.526  -2.498  -9.027
  504   HD12  LEU  60          2HD1      LEU  60   3.695  -2.564  -7.455
  505   HD13  LEU  60          3HD1      LEU  60   5.468  -2.702  -7.531
  506   HD21  LEU  60          3HD2      LEU  60   5.430  -6.100  -9.089
  507   HD22  LEU  60          1HD2      LEU  60   5.540  -4.566  -9.983
  508   HD23  LEU  60          2HD2      LEU  60   6.499  -4.802  -8.503
  509    H    SER  61           HN       SER  61   6.017  -8.026  -5.860
  510    HA   SER  61           HA       SER  61   4.738  -8.640  -3.300
  511    HB2  SER  61           2HB      SER  61   6.168 -10.262  -4.638
  512    HB3  SER  61           3HB      SER  61   7.572  -9.253  -4.215
  513    HG   SER  61           HG       SER  61   7.271 -11.011  -2.762
  514    H    LEU  62           HN       LEU  62   4.661  -7.000  -1.871
  515    HA   LEU  62           HA       LEU  62   7.044  -5.231  -1.685
  516    HB2  LEU  62           2HB      LEU  62   4.860  -4.164  -2.176
  517    HB3  LEU  62           3HB      LEU  62   4.225  -4.815  -0.646
  518    HG   LEU  62           HG       LEU  62   5.975  -3.495   0.557
  519   HD11  LEU  62          1HD1      LEU  62   7.082  -1.648  -0.637
  520   HD12  LEU  62          2HD1      LEU  62   7.562  -3.229  -1.295
  521   HD13  LEU  62          3HD1      LEU  62   6.382  -2.222  -2.168
  522   HD21  LEU  62          3HD2      LEU  62   3.661  -2.706   0.353
  523   HD22  LEU  62          1HD2      LEU  62   4.803  -1.343   0.325
  524   HD23  LEU  62          2HD2      LEU  62   4.063  -1.911  -1.189
  525    H    ARG  63           HN       ARG  63   8.224  -5.147   0.131
  526    HA   ARG  63           HA       ARG  63   7.733  -7.170   2.159
  527    HB2  ARG  63           2HB      ARG  63   9.957  -5.876   1.132
  528    HB3  ARG  63           3HB      ARG  63   9.766  -5.137   2.740
  529    HG2  ARG  63           2HG      ARG  63   9.888  -8.117   2.226
  530    HG3  ARG  63           3HG      ARG  63  11.280  -7.113   2.697
  531    HD2  ARG  63           2HD      ARG  63  10.244  -6.544   4.790
  532    HD3  ARG  63           3HD      ARG  63   8.724  -7.329   4.307
  533    HE   ARG  63           HE       ARG  63   9.869  -9.478   4.431
  534   HH11  ARG  63          2HH1      ARG  63  11.501  -6.713   5.873
  535   HH12  ARG  63          1HH1      ARG  63  12.479  -7.690   6.946
  536   HH21  ARG  63          2HH2      ARG  63  11.137 -10.745   5.834
  537   HH22  ARG  63          1HH2      ARG  63  12.272  -9.978   6.921
  538    H    LYS  64           HN       LYS  64   7.117  -6.879   4.263
  539    HA   LYS  64           HA       LYS  64   5.276  -4.828   4.826
  540    HB2  LYS  64           2HB      LYS  64   5.472  -5.625   7.204
  541    HB3  LYS  64           3HB      LYS  64   5.123  -6.889   6.001
  542    HG2  LYS  64           2HG      LYS  64   6.692  -7.930   7.313
  543    HG3  LYS  64           3HG      LYS  64   7.716  -7.237   6.032
  544    HD2  LYS  64           2HD      LYS  64   8.824  -6.773   8.069
  545    HD3  LYS  64           3HD      LYS  64   8.061  -5.244   7.572
  546    HE2  LYS  64           2HE      LYS  64   6.193  -5.678   9.113
  547    HE3  LYS  64           3HE      LYS  64   6.956  -7.203   9.610
  548    HZ1  LYS  64           3HZ      LYS  64   8.102  -4.516   9.971
  549    HZ2  LYS  64           1HZ      LYS  64   7.416  -5.433  11.155
  550    HZ3  LYS  64           2HZ      LYS  64   8.811  -5.932  10.433
  551    H    SER  65           HN       SER  65   8.749  -4.909   5.225
  552    HA   SER  65           HA       SER  65   9.072  -2.909   7.189
  553    HB2  SER  65           2HB      SER  65  10.877  -3.345   4.788
  554    HB3  SER  65           3HB      SER  65  11.329  -2.776   6.413
  555    HG   SER  65           HG       SER  65  11.817  -5.003   6.083
  556    H    ALA  66           HN       ALA  66   8.794  -2.653   3.627
  557    HA   ALA  66           HA       ALA  66   8.907   0.239   3.686
  558    HB1  ALA  66           1HB      ALA  66   8.290   0.073   1.309
  559    HB2  ALA  66           2HB      ALA  66   9.613  -1.046   1.717
  560    HB3  ALA  66           3HB      ALA  66   7.954  -1.662   1.520
  561    H    ALA  67           HN       ALA  67   6.369  -2.238   3.652
  562    HA   ALA  67           HA       ALA  67   4.186  -0.532   3.070
  563    HB1  ALA  67           1HB      ALA  67   2.787  -2.324   4.014
  564    HB2  ALA  67           2HB      ALA  67   4.060  -2.979   2.959
  565    HB3  ALA  67           3HB      ALA  67   4.234  -3.075   4.728
  566    H    GLU  68           HN       GLU  68   5.909  -1.176   6.079
  567    HA   GLU  68           HA       GLU  68   4.025  -0.008   7.872
  568    HB2  GLU  68           2HB      GLU  68   7.046  -0.263   7.975
  569    HB3  GLU  68           3HB      GLU  68   6.063   0.363   9.320
  570    HG2  GLU  68           2HG      GLU  68   4.922  -1.757   9.526
  571    HG3  GLU  68           3HG      GLU  68   5.775  -2.391   8.103
  572    HE2  GLU  68           2HE      GLU  68   8.509  -3.252   9.999
  573    H    MET  69           HN       MET  69   6.475   1.341   5.725
  574    HA   MET  69           HA       MET  69   6.333   3.961   7.037
  575    HB2  MET  69           2HB      MET  69   7.846   3.075   4.559
  576    HB3  MET  69           3HB      MET  69   8.047   4.617   5.425
  577    HG2  MET  69           2HG      MET  69   8.746   3.316   7.441
  578    HG3  MET  69           3HG      MET  69   8.687   1.843   6.460
  579    HE1  MET  69           3HE      MET  69  11.169   1.205   6.966
  580    HE2  MET  69           1HE      MET  69  12.538   2.331   6.831
  581    HE3  MET  69           2HE      MET  69  11.276   2.612   8.052
  582    H    ILE  70           HN       ILE  70   4.344   2.373   4.962
  583    HA   ILE  70           HA       ILE  70   3.842   4.754   3.280
  584    HB   ILE  70           HB       ILE  70   2.638   1.964   3.097
  585   HG12  ILE  70          2HG1      ILE  70   4.792   3.315   1.439
  586   HG13  ILE  70          3HG1      ILE  70   5.052   2.013   2.625
  587   HG21  ILE  70          1HG2      ILE  70   1.827   2.714   0.895
  588   HG22  ILE  70          2HG2      ILE  70   1.167   3.722   2.205
  589   HG23  ILE  70          3HG2      ILE  70   2.503   4.333   1.198
  590   HD11  ILE  70          3HD1      ILE  70   3.430   1.799   0.077
  591   HD12  ILE  70          1HD1      ILE  70   5.060   1.137   0.327
  592   HD13  ILE  70          2HD1      ILE  70   3.693   0.498   1.263
  593    H    GLU  71           HN       GLU  71   2.580   6.213   4.180
  594    HA   GLU  71           HA       GLU  71   0.483   5.472   6.086
  595    HB2  GLU  71           2HB      GLU  71   1.942   7.545   6.233
  596    HB3  GLU  71           3HB      GLU  71   1.054   8.170   4.822
  597    HG2  GLU  71           2HG      GLU  71  -0.086   9.175   6.536
  598    HG3  GLU  71           3HG      GLU  71  -1.050   7.699   6.316
  599    HE2  GLU  71           2HE      GLU  71   1.256   7.924   9.560
  600    H    VAL  72           HN       VAL  72  -1.403   4.690   5.330
  601    HA   VAL  72           HA       VAL  72  -2.355   5.788   2.738
  602    HB   VAL  72           HB       VAL  72  -3.513   3.615   2.365
  603   HG11  VAL  72          1HG1      VAL  72  -1.512   2.339   1.723
  604   HG12  VAL  72          2HG1      VAL  72  -1.342   4.063   1.323
  605   HG13  VAL  72          3HG1      VAL  72  -0.513   3.393   2.749
  606   HG21  VAL  72          3HG2      VAL  72  -3.665   2.878   4.694
  607   HG22  VAL  72          1HG2      VAL  72  -2.868   1.648   3.687
  608   HG23  VAL  72          2HG2      VAL  72  -1.896   2.686   4.755
  609    H    GLU  73           HN       GLU  73  -4.664   5.750   2.415
  610    HA   GLU  73           HA       GLU  73  -6.186   5.881   4.972
  611    HB2  GLU  73           2HB      GLU  73  -5.781   8.124   3.983
  612    HB3  GLU  73           3HB      GLU  73  -6.587   7.584   2.491
  613    HG2  GLU  73           2HG      GLU  73  -8.069   8.926   3.912
  614    HG3  GLU  73           3HG      GLU  73  -8.671   7.269   3.692
  615    HE2  GLU  73           2HE      GLU  73  -7.857   8.522   7.321
  616    H    LEU  74           HN       LEU  74  -8.063   4.747   5.032
  617    HA   LEU  74           HA       LEU  74  -8.585   3.075   2.628
  618    HB2  LEU  74           2HB      LEU  74  -7.941   1.884   4.654
  619    HB3  LEU  74           3HB      LEU  74  -9.261   2.668   5.555
  620    HG   LEU  74           HG       LEU  74 -10.917   1.419   4.377
  621   HD11  LEU  74          1HD1      LEU  74 -10.377  -0.215   2.613
  622   HD12  LEU  74          2HD1      LEU  74  -9.912   1.434   2.136
  623   HD13  LEU  74          3HD1      LEU  74  -8.670   0.280   2.683
  624   HD21  LEU  74          3HD2      LEU  74  -9.780   0.281   6.237
  625   HD22  LEU  74          1HD2      LEU  74 -10.293  -0.884   4.995
  626   HD23  LEU  74          2HD2      LEU  74  -8.587  -0.392   5.101
  627    H    GLU  75           HN       GLU  75 -10.585   2.898   1.726
  628    HA   GLU  75           HA       GLU  75 -12.288   5.151   1.884
  629    HB2  GLU  75           2HB      GLU  75 -12.081   3.614  -0.064
  630    HB3  GLU  75           3HB      GLU  75 -12.958   2.374   0.864
  631    HG2  GLU  75           2HG      GLU  75 -14.441   3.519  -0.692
  632    HG3  GLU  75           3HG      GLU  75 -14.910   3.843   0.991
  633    HE2  GLU  75           2HE      GLU  75 -14.260   7.229   0.658
  634    H    HIS  76           HN       HIS  76 -13.979   5.666   3.092
  635    HA   HIS  76           HA       HIS  76 -15.448   5.637   4.822
  636    HB2  HIS  76           2HB      HIS  76 -15.708   2.728   4.014
  637    HB3  HIS  76           3HB      HIS  76 -16.743   3.520   5.217
  638    HD1  HIS  76           1HD      HIS  76 -16.879   2.579   1.831
  639    HD2  HIS  76           2HD      HIS  76 -17.802   6.100   3.875
  640    HE1  HIS  76           1HE      HIS  76 -18.450   3.880   0.326
  641    HE2  HIS  76           2HE      HIS  76 -19.008   6.017   1.576
  642    H    HIS  77           HN       HIS  77 -13.580   6.116   6.122
  643    HA   HIS  77           HA       HIS  77 -12.789   3.874   7.911
  644    HB2  HIS  77           2HB      HIS  77 -10.880   5.420   8.526
  645    HB3  HIS  77           3HB      HIS  77 -10.857   4.791   6.868
  646    HD1  HIS  77           1HD      HIS  77 -11.092   6.445   4.950
  647    HD2  HIS  77           2HD      HIS  77 -11.462   8.209   8.719
  648    HE1  HIS  77           1HE      HIS  77 -11.061   8.949   4.565
  649    HE2  HIS  77           2HE      HIS  77 -11.285  10.013   6.858
  650    H    HIS  78           HN       HIS  78 -12.595   4.304  10.183
  651    HA   HIS  78           HA       HIS  78 -13.376   5.078  12.199
  652    HB2  HIS  78           2HB      HIS  78 -12.473   7.299  11.039
  653    HB3  HIS  78           3HB      HIS  78 -14.197   7.712  11.019
  654    HD1  HIS  78           1HD      HIS  78 -15.400   7.805  13.430
  655    HD2  HIS  78           2HD      HIS  78 -11.225   7.686  13.438
  656    HE1  HIS  78           1HE      HIS  78 -14.673   8.587  15.728
  657    HE2  HIS  78           2HE      HIS  78 -12.135   8.517  15.728
  658    H    HIS  79           HN       HIS  79 -15.090   3.916  10.034
  659    HA   HIS  79           HA       HIS  79 -17.683   5.245  10.305
  660    HB2  HIS  79           2HB      HIS  79 -16.879   4.294   8.159
  661    HB3  HIS  79           3HB      HIS  79 -16.862   2.680   8.894
  662    HD1  HIS  79           1HD      HIS  79 -19.082   1.437   9.117
  663    HD2  HIS  79           2HD      HIS  79 -19.459   5.304   7.580
  664    HE1  HIS  79           1HE      HIS  79 -21.433   1.602   8.185
  665    HE2  HIS  79           2HE      HIS  79 -21.661   3.957   7.265
  666    H    HIS  80           HN       HIS  80 -18.265   5.006  12.479
  667    HA   HIS  80           HA       HIS  80 -18.606   2.202  13.401
  668    HB2  HIS  80           2HB      HIS  80 -17.406   3.973  14.832
  669    HB3  HIS  80           3HB      HIS  80 -19.008   4.697  15.063
  670    HD1  HIS  80           1HD      HIS  80 -20.866   2.956  16.131
  671    HD2  HIS  80           2HD      HIS  80 -16.826   1.996  16.606
  672    HE1  HIS  80           1HE      HIS  80 -20.757   1.262  18.013
  673    HE2  HIS  80           2HE      HIS  80 -18.306   0.680  18.292
  674    H    HIS  81           HN       HIS  81 -20.420   1.685  12.179
  675    HA   HIS  81           HA       HIS  81 -22.884   3.161  12.981
  676    HB2  HIS  81           2HB      HIS  81 -22.451   3.604  10.652
  677    HB3  HIS  81           3HB      HIS  81 -22.160   1.887  10.325
  678    HD1  HIS  81           1HD      HIS  81 -24.051   0.754   9.238
  679    HD2  HIS  81           2HD      HIS  81 -25.322   3.935  11.628
  680    HE1  HIS  81           1HE      HIS  81 -26.564   0.884   8.959
  681    HE2  HIS  81           2HE      HIS  81 -27.333   2.817  10.411
  Start of MODEL    3
    1    H1   MET   1           HN       MET   1  -2.208   5.530  13.450
    2    HA   MET   1           HA       MET   1  -1.144   6.854  11.171
    3    HB2  MET   1           2HB      MET   1   1.050   6.498  12.140
    4    HB3  MET   1           3HB      MET   1   0.693   4.775  12.401
    5    HG2  MET   1           2HG      MET   1   0.502   4.496   9.939
    6    HG3  MET   1           3HG      MET   1   0.997   6.186   9.742
    7    HE1  MET   1           3HE      MET   1   2.913   5.260   8.107
    8    HE2  MET   1           1HE      MET   1   4.125   4.053   8.595
    9    HE3  MET   1           2HE      MET   1   2.417   3.583   8.438
   10    H    PHE   2           HN       PHE   2  -2.211   5.989   9.497
   11    HA   PHE   2           HA       PHE   2  -3.198   3.210   9.801
   12    HB2  PHE   2           2HB      PHE   2  -4.728   5.185   9.201
   13    HB3  PHE   2           3HB      PHE   2  -3.933   5.168   7.616
   14    HD1  PHE   2           1HD      PHE   2  -4.217   3.232   6.112
   15    HD2  PHE   2           2HD      PHE   2  -6.291   3.486   9.823
   16    HE1  PHE   2           1HE      PHE   2  -5.754   1.466   5.372
   17    HE2  PHE   2           2HE      PHE   2  -7.829   1.720   9.085
   18    HZ   PHE   2           HZ       PHE   2  -7.565   0.710   6.857
   19    H    SER   3           HN       SER   3  -1.408   1.986   9.310
   20    HA   SER   3           HA       SER   3   0.211   2.759   6.995
   21    HB2  SER   3           2HB      SER   3   1.595   0.771   7.705
   22    HB3  SER   3           3HB      SER   3   1.434   2.057   8.925
   23    HG   SER   3           HG       SER   3   1.114  -0.045   9.803
   24    H    LEU   4           HN       LEU   4   0.812   1.219   5.343
   25    HA   LEU   4           HA       LEU   4  -1.459   0.057   4.082
   26    HB2  LEU   4           2HB      LEU   4   0.484   0.885   2.863
   27    HB3  LEU   4           3HB      LEU   4   1.508  -0.361   3.618
   28    HG   LEU   4           HG       LEU   4   0.284  -2.109   2.441
   29   HD11  LEU   4          1HD1      LEU   4  -1.383  -1.539   0.727
   30   HD12  LEU   4          2HD1      LEU   4  -1.906  -1.011   2.344
   31   HD13  LEU   4          3HD1      LEU   4  -1.264   0.177   1.184
   32   HD21  LEU   4          3HD2      LEU   4   2.240  -1.082   1.371
   33   HD22  LEU   4          1HD2      LEU   4   1.036  -1.580   0.159
   34   HD23  LEU   4          2HD2      LEU   4   1.188   0.135   0.607
   35    H    ARG   5           HN       ARG   5   0.999  -1.200   6.248
   36    HA   ARG   5           HA       ARG   5   0.447  -3.992   5.782
   37    HB2  ARG   5           2HB      ARG   5   2.397  -2.544   7.023
   38    HB3  ARG   5           3HB      ARG   5   1.463  -3.125   8.423
   39    HG2  ARG   5           2HG      ARG   5   2.344  -5.052   6.305
   40    HG3  ARG   5           3HG      ARG   5   3.498  -4.483   7.534
   41    HD2  ARG   5           2HD      ARG   5   2.626  -6.476   8.411
   42    HD3  ARG   5           3HD      ARG   5   1.752  -5.185   9.263
   43    HE   ARG   5           HE       ARG   5  -0.088  -5.595   7.573
   44   HH11  ARG   5          2HH1      ARG   5   2.176  -8.144   8.487
   45   HH12  ARG   5          1HH1      ARG   5   1.041  -9.430   8.150
   46   HH21  ARG   5          2HH2      ARG   5  -1.545  -7.263   7.157
   47   HH22  ARG   5          1HH2      ARG   5  -1.069  -8.929   7.396
   48    H    ASP   6           HN       ASP   6  -0.857  -1.471   7.887
   49    HA   ASP   6           HA       ASP   6  -2.171  -3.134   9.773
   50    HB2  ASP   6           2HB      ASP   6  -1.800  -0.715  10.078
   51    HB3  ASP   6           3HB      ASP   6  -2.962  -0.374   8.778
   52    HD2  ASP   6           2HD      ASP   6  -4.414  -1.621  12.278
   53    H    ALA   7           HN       ALA   7  -3.084  -2.121   6.516
   54    HA   ALA   7           HA       ALA   7  -5.820  -3.044   6.764
   55    HB1  ALA   7           1HB      ALA   7  -5.896  -2.702   4.330
   56    HB2  ALA   7           2HB      ALA   7  -5.177  -1.302   5.161
   57    HB3  ALA   7           3HB      ALA   7  -4.133  -2.464   4.309
   58    H    LYS   8           HN       LYS   8  -6.729  -4.831   5.491
   59    HA   LYS   8           HA       LYS   8  -4.819  -7.112   5.428
   60    HB2  LYS   8           2HB      LYS   8  -7.815  -7.015   5.854
   61    HB3  LYS   8           3HB      LYS   8  -6.916  -8.520   5.544
   62    HG2  LYS   8           2HG      LYS   8  -6.326  -8.684   7.683
   63    HG3  LYS   8           3HG      LYS   8  -5.687  -7.023   7.694
   64    HD2  LYS   8           2HD      LYS   8  -8.647  -7.624   7.895
   65    HD3  LYS   8           3HD      LYS   8  -7.588  -7.556   9.325
   66    HE2  LYS   8           2HE      LYS   8  -7.789  -5.298   7.322
   67    HE3  LYS   8           3HE      LYS   8  -8.854  -5.426   8.739
   68    HZ1  LYS   8           3HZ      LYS   8  -5.914  -5.270   8.816
   69    HZ2  LYS   8           1HZ      LYS   8  -6.951  -4.042   9.181
   70    HZ3  LYS   8           2HZ      LYS   8  -6.904  -5.390  10.129
   71    H    CYS   9           HN       CYS   9  -5.953  -8.938   3.900
   72    HA   CYS   9           HA       CYS   9  -5.471  -7.926   1.257
   73    HB2  CYS   9           2HB      CYS   9  -6.827 -10.545   1.910
   74    HB3  CYS   9           3HB      CYS   9  -5.753 -10.154   0.544
   75    HG   CYS   9           HG       CYS   9  -4.601 -11.907   2.106
   76    H    GLY  10           HN       GLY  10  -6.856  -7.548  -0.456
   77    HA2  GLY  10           1HA      GLY  10  -8.896  -7.554  -1.587
   78    HA3  GLY  10           2HA      GLY  10  -9.709  -8.127  -0.113
   79    H    GLN  11           HN       GLN  11  -7.762  -5.567   0.775
   80    HA   GLN  11           HA       GLN  11 -10.125  -3.780   0.667
   81    HB2  GLN  11           2HB      GLN  11  -7.640  -3.679   2.402
   82    HB3  GLN  11           3HB      GLN  11  -8.982  -2.512   2.456
   83    HG2  GLN  11           2HG      GLN  11 -10.499  -4.472   2.980
   84    HG3  GLN  11           3HG      GLN  11  -9.026  -5.443   3.196
   85   HE21  GLN  11          1HE2      GLN  11 -11.016  -2.847   4.467
   86   HE22  GLN  11          2HE2      GLN  11 -10.245  -2.750   6.036
   87    H    THR  12           HN       THR  12  -9.949  -1.621   0.080
   88    HA   THR  12           HA       THR  12  -7.735  -1.121  -1.832
   89    HB   THR  12           HB       THR  12 -10.372   0.370  -1.599
   90    HG1  THR  12           1HG      THR  12 -11.060  -1.032  -3.305
   91   HG21  THR  12          3HG2      THR  12  -8.387   0.052  -3.876
   92   HG22  THR  12          1HG2      THR  12  -9.902   0.981  -3.940
   93   HG23  THR  12          2HG2      THR  12  -8.589   1.500  -2.858
   94    H    VAL  13           HN       VAL  13  -6.149   0.134  -1.094
   95    HA   VAL  13           HA       VAL  13  -6.876   2.227   0.892
   96    HB   VAL  13           HB       VAL  13  -4.500   2.107   1.650
   97   HG11  VAL  13          1HG1      VAL  13  -4.730   0.005   2.901
   98   HG12  VAL  13          2HG1      VAL  13  -6.264   0.903   2.851
   99   HG13  VAL  13          3HG1      VAL  13  -6.024  -0.511   1.796
  100   HG21  VAL  13          3HG2      VAL  13  -3.526   1.192  -0.401
  101   HG22  VAL  13          1HG2      VAL  13  -3.133   0.173   1.004
  102   HG23  VAL  13          2HG2      VAL  13  -4.398  -0.338  -0.139
  103    H    LYS  14           HN       LYS  14  -6.379   4.294   0.486
  104    HA   LYS  14           HA       LYS  14  -5.102   4.874  -2.115
  105    HB2  LYS  14           2HB      LYS  14  -7.246   5.948  -1.600
  106    HB3  LYS  14           3HB      LYS  14  -6.540   6.667  -0.133
  107    HG2  LYS  14           2HG      LYS  14  -4.987   7.966  -1.504
  108    HG3  LYS  14           3HG      LYS  14  -5.660   7.230  -2.978
  109    HD2  LYS  14           2HD      LYS  14  -7.204   8.921  -0.987
  110    HD3  LYS  14           3HD      LYS  14  -6.573   9.484  -2.554
  111    HE2  LYS  14           2HE      LYS  14  -7.965   7.780  -3.695
  112    HE3  LYS  14           3HE      LYS  14  -8.629   7.294  -2.121
  113    HZ1  LYS  14           3HZ      LYS  14  -8.870   9.966  -3.330
  114    HZ2  LYS  14           1HZ      LYS  14 -10.066   8.834  -3.254
  115    HZ3  LYS  14           2HZ      LYS  14  -9.487   9.514  -1.868
  116    H    VAL  15           HN       VAL  15  -3.150   5.802  -2.325
  117    HA   VAL  15           HA       VAL  15  -1.453   5.932   0.025
  118    HB   VAL  15           HB       VAL  15  -0.839   6.864  -2.801
  119   HG11  VAL  15          1HG1      VAL  15   1.499   6.428  -2.174
  120   HG12  VAL  15          2HG1      VAL  15   0.748   7.631  -1.101
  121   HG13  VAL  15          3HG1      VAL  15   0.971   5.955  -0.543
  122   HG21  VAL  15          3HG2      VAL  15  -1.648   4.554  -2.837
  123   HG22  VAL  15          1HG2      VAL  15   0.094   4.624  -3.190
  124   HG23  VAL  15          2HG2      VAL  15  -0.467   4.113  -1.581
  125    H    VAL  16           HN       VAL  16  -1.427   7.619   1.378
  126    HA   VAL  16           HA       VAL  16  -1.982  10.277   0.180
  127    HB   VAL  16           HB       VAL  16  -2.747  10.971   2.478
  128   HG11  VAL  16          1HG1      VAL  16  -4.975   9.942   2.252
  129   HG12  VAL  16          2HG1      VAL  16  -4.324  10.438   0.672
  130   HG13  VAL  16          3HG1      VAL  16  -4.297   8.724   1.148
  131   HG21  VAL  16          3HG2      VAL  16  -1.687   9.187   3.786
  132   HG22  VAL  16          1HG2      VAL  16  -3.443   9.219   4.064
  133   HG23  VAL  16          2HG2      VAL  16  -2.736   7.982   3.001
  134    H    LYS  17           HN       LYS  17  -0.076   8.618   2.754
  135    HA   LYS  17           HA       LYS  17   1.864  10.854   2.459
  136    HB2  LYS  17           2HB      LYS  17   0.980   9.623   5.088
  137    HB3  LYS  17           3HB      LYS  17   2.244  10.859   4.879
  138    HG2  LYS  17           2HG      LYS  17   0.570  12.437   4.047
  139    HG3  LYS  17           3HG      LYS  17  -0.696  11.201   4.238
  140    HD2  LYS  17           2HD      LYS  17  -0.190  11.107   6.666
  141    HD3  LYS  17           3HD      LYS  17   0.994  12.418   6.443
  142    HE2  LYS  17           2HE      LYS  17  -0.806  13.874   5.586
  143    HE3  LYS  17           3HE      LYS  17  -1.979  12.569   5.859
  144    HZ1  LYS  17           3HZ      LYS  17  -0.367  13.888   7.939
  145    HZ2  LYS  17           1HZ      LYS  17  -1.970  14.147   7.658
  146    HZ3  LYS  17           2HZ      LYS  17  -1.457  12.676   8.193
  147    H    LEU  18           HN       LEU  18   4.017  10.363   2.942
  148    HA   LEU  18           HA       LEU  18   4.609   7.452   3.139
  149    HB2  LEU  18           2HB      LEU  18   5.954   9.522   1.376
  150    HB3  LEU  18           3HB      LEU  18   6.525   7.853   1.619
  151    HG   LEU  18           HG       LEU  18   3.868   8.635   0.379
  152   HD11  LEU  18          1HD1      LEU  18   4.873   7.882  -1.738
  153   HD12  LEU  18          2HD1      LEU  18   5.770   9.253  -1.045
  154   HD13  LEU  18          3HD1      LEU  18   6.419   7.601  -0.903
  155   HD21  LEU  18          3HD2      LEU  18   3.825   6.464   1.526
  156   HD22  LEU  18          1HD2      LEU  18   3.738   6.256  -0.240
  157   HD23  LEU  18          2HD2      LEU  18   5.268   5.952   0.617
  158    H    HIS  19           HN       HIS  19   5.485   7.189   5.112
  159    HA   HIS  19           HA       HIS  19   6.900   9.446   6.355
  160    HB2  HIS  19           2HB      HIS  19   6.235   6.677   7.406
  161    HB3  HIS  19           3HB      HIS  19   6.987   7.976   8.350
  162    HD1  HIS  19           1HD      HIS  19   5.466  10.040   8.968
  163    HD2  HIS  19           2HD      HIS  19   3.478   6.854   7.138
  164    HE1  HIS  19           1HE      HIS  19   2.995  10.417   9.379
  165    HE2  HIS  19           2HE      HIS  19   1.791   8.481   8.267
  166    H    GLY  20           HN       GLY  20   7.749   7.021   4.270
  167    HA2  GLY  20           1HA      GLY  20  10.121   6.007   5.537
  168    HA3  GLY  20           2HA      GLY  20   9.685   5.868   3.818
  169    H    THR  21           HN       THR  21  12.296   6.191   4.549
  170    HA   THR  21           HA       THR  21  13.069   8.982   4.474
  171    HB   THR  21           HB       THR  21  15.369   7.880   3.989
  172    HG1  THR  21           1HG      THR  21  15.370   5.629   4.520
  173   HG21  THR  21          3HG2      THR  21  13.848   7.147   6.517
  174   HG22  THR  21          1HG2      THR  21  15.618   7.181   6.343
  175   HG23  THR  21          2HG2      THR  21  14.684   8.690   6.210
  176    H    GLY  22           HN       GLY  22  14.892   9.504   2.722
  177    HA2  GLY  22           1HA      GLY  22  13.489   9.915   0.323
  178    HA3  GLY  22           2HA      GLY  22  15.246  10.089   0.539
  179    H    ALA  23           HN       ALA  23  15.947   7.430   1.107
  180    HA   ALA  23           HA       ALA  23  16.107   6.382  -1.540
  181    HB1  ALA  23           1HB      ALA  23  17.176   4.436  -0.477
  182    HB2  ALA  23           2HB      ALA  23  17.812   5.965   0.176
  183    HB3  ALA  23           3HB      ALA  23  16.639   5.014   1.118
  184    H    LEU  24           HN       LEU  24  14.192   5.386   1.318
  185    HA   LEU  24           HA       LEU  24  12.895   3.194   0.033
  186    HB2  LEU  24           2HB      LEU  24  12.365   4.881   2.456
  187    HB3  LEU  24           3HB      LEU  24  11.087   3.795   1.859
  188    HG   LEU  24           HG       LEU  24  12.369   2.791   3.682
  189   HD11  LEU  24          1HD1      LEU  24  12.892   0.651   2.586
  190   HD12  LEU  24          2HD1      LEU  24  11.380   1.351   1.963
  191   HD13  LEU  24          3HD1      LEU  24  12.875   1.461   1.002
  192   HD21  LEU  24          3HD2      LEU  24  14.516   3.907   3.309
  193   HD22  LEU  24          1HD2      LEU  24  14.720   2.143   3.375
  194   HD23  LEU  24          2HD2      LEU  24  14.744   2.980   1.807
  195    H    LYS  25           HN       LYS  25  11.921   6.585   0.566
  196    HA   LYS  25           HA       LYS  25   9.354   6.492  -0.530
  197    HB2  LYS  25           2HB      LYS  25  11.015   8.415   0.513
  198    HB3  LYS  25           3HB      LYS  25  10.906   8.906  -1.194
  199    HG2  LYS  25           2HG      LYS  25   8.436   8.876  -1.002
  200    HG3  LYS  25           3HG      LYS  25   8.605   8.500   0.729
  201    HD2  LYS  25           2HD      LYS  25   9.716  10.960  -0.658
  202    HD3  LYS  25           3HD      LYS  25   8.231  10.909   0.322
  203    HE2  LYS  25           2HE      LYS  25   9.510  10.292   2.296
  204    HE3  LYS  25           3HE      LYS  25  11.003  10.201   1.337
  205    HZ1  LYS  25           3HZ      LYS  25   9.404  12.631   1.793
  206    HZ2  LYS  25           1HZ      LYS  25  10.835  12.271   2.528
  207    HZ3  LYS  25           2HZ      LYS  25  10.791  12.548   0.904
  208    H    ARG  26           HN       ARG  26  12.458   7.227  -2.166
  209    HA   ARG  26           HA       ARG  26  11.390   7.772  -4.706
  210    HB2  ARG  26           2HB      ARG  26  13.724   8.215  -4.098
  211    HB3  ARG  26           3HB      ARG  26  14.040   6.465  -4.013
  212    HG2  ARG  26           2HG      ARG  26  13.311   6.361  -6.449
  213    HG3  ARG  26           3HG      ARG  26  13.397   8.138  -6.446
  214    HD2  ARG  26           2HD      ARG  26  15.757   8.037  -5.807
  215    HD3  ARG  26           3HD      ARG  26  15.679   6.262  -5.760
  216    HE   ARG  26           HE       ARG  26  15.215   7.853  -8.242
  217   HH11  ARG  26          2HH1      ARG  26  16.605   5.079  -6.558
  218   HH12  ARG  26          1HH1      ARG  26  17.320   4.407  -8.005
  219   HH21  ARG  26          2HH2      ARG  26  16.153   6.968 -10.108
  220   HH22  ARG  26          1HH2      ARG  26  17.063   5.478 -10.015
  221    H    ARG  27           HN       ARG  27  12.476   4.637  -3.320
  222    HA   ARG  27           HA       ARG  27  12.066   3.213  -5.766
  223    HB2  ARG  27           2HB      ARG  27  13.484   2.513  -3.757
  224    HB3  ARG  27           3HB      ARG  27  11.958   1.979  -3.012
  225    HG2  ARG  27           2HG      ARG  27  11.561   0.426  -4.819
  226    HG3  ARG  27           3HG      ARG  27  12.988   1.028  -5.697
  227    HD2  ARG  27           2HD      ARG  27  14.381   0.295  -3.720
  228    HD3  ARG  27           3HD      ARG  27  12.926  -0.501  -3.083
  229    HE   ARG  27           HE       ARG  27  13.467  -1.260  -5.813
  230   HH11  ARG  27          2HH1      ARG  27  14.378  -1.896  -2.465
  231   HH12  ARG  27          1HH1      ARG  27  14.941  -3.516  -2.801
  232   HH21  ARG  27          2HH2      ARG  27  14.219  -3.365  -6.226
  233   HH22  ARG  27          1HH2      ARG  27  14.852  -4.344  -4.922
  234    H    ILE  28           HN       ILE  28  10.031   3.754  -2.873
  235    HA   ILE  28           HA       ILE  28   7.868   2.102  -3.694
  236    HB   ILE  28           HB       ILE  28   7.787   4.645  -2.013
  237   HG12  ILE  28          2HG1      ILE  28   7.972   1.732  -1.170
  238   HG13  ILE  28          3HG1      ILE  28   9.328   2.887  -1.169
  239   HG21  ILE  28          1HG2      ILE  28   5.685   3.723  -1.115
  240   HG22  ILE  28          2HG2      ILE  28   5.574   3.997  -2.870
  241   HG23  ILE  28          3HG2      ILE  28   5.808   2.348  -2.238
  242   HD11  ILE  28          3HD1      ILE  28   6.798   3.110   0.482
  243   HD12  ILE  28          1HD1      ILE  28   8.391   2.609   1.088
  244   HD13  ILE  28          2HD1      ILE  28   8.155   4.262   0.484
  245    H    MET  29           HN       MET  29   8.667   5.503  -4.331
  246    HA   MET  29           HA       MET  29   6.227   6.089  -5.720
  247    HB2  MET  29           2HB      MET  29   8.936   7.431  -5.639
  248    HB3  MET  29           3HB      MET  29   7.586   8.048  -6.620
  249    HG2  MET  29           2HG      MET  29   6.218   8.191  -4.538
  250    HG3  MET  29           3HG      MET  29   7.652   7.723  -3.609
  251    HE1  MET  29           3HE      MET  29  10.011   9.209  -5.087
  252    HE2  MET  29           1HE      MET  29  10.075  10.741  -4.187
  253    HE3  MET  29           2HE      MET  29   9.798   9.214  -3.320
  254    H    ASP  30           HN       ASP  30   9.323   4.716  -6.664
  255    HA   ASP  30           HA       ASP  30   9.031   5.049  -9.488
  256    HB2  ASP  30           2HB      ASP  30  11.157   4.468  -8.323
  257    HB3  ASP  30           3HB      ASP  30  10.494   2.859  -7.968
  258    HD2  ASP  30           2HD      ASP  30  11.666   3.637 -11.686
  259    H    MET  31           HN       MET  31   7.703   2.788  -7.167
  260    HA   MET  31           HA       MET  31   6.918   0.761  -9.071
  261    HB2  MET  31           2HB      MET  31   5.675   1.326  -6.363
  262    HB3  MET  31           3HB      MET  31   5.709  -0.217  -7.251
  263    HG2  MET  31           2HG      MET  31   8.065  -0.449  -6.884
  264    HG3  MET  31           3HG      MET  31   8.170   1.177  -6.186
  265    HE1  MET  31           3HE      MET  31   9.133   0.813  -3.913
  266    HE2  MET  31           1HE      MET  31   8.811  -0.613  -2.899
  267    HE3  MET  31           2HE      MET  31   9.551  -0.813  -4.505
  268    H    GLY  32           HN       GLY  32   5.757   3.893  -8.358
  269    HA2  GLY  32           1HA      GLY  32   3.962   4.820  -9.678
  270    HA3  GLY  32           2HA      GLY  32   3.167   3.229  -9.661
  271    H    ILE  33           HN       ILE  33   4.476   3.692  -6.669
  272    HA   ILE  33           HA       ILE  33   1.870   4.521  -5.555
  273    HB   ILE  33           HB       ILE  33   4.373   3.513  -4.140
  274   HG12  ILE  33          2HG1      ILE  33   1.862   1.977  -4.879
  275   HG13  ILE  33          3HG1      ILE  33   3.408   1.876  -5.757
  276   HG21  ILE  33          1HG2      ILE  33   2.847   3.085  -2.258
  277   HG22  ILE  33          2HG2      ILE  33   2.859   4.805  -2.707
  278   HG23  ILE  33          3HG2      ILE  33   1.499   3.767  -3.197
  279   HD11  ILE  33          3HD1      ILE  33   2.955   1.123  -2.856
  280   HD12  ILE  33          1HD1      ILE  33   3.137  -0.017  -4.206
  281   HD13  ILE  33          2HD1      ILE  33   4.500   1.021  -3.735
  282    H    THR  34           HN       THR  34   1.832   6.753  -5.882
  283    HA   THR  34           HA       THR  34   4.071   8.240  -4.591
  284    HB   THR  34           HB       THR  34   3.464  10.076  -6.272
  285    HG1  THR  34           1HG      THR  34   2.368   9.285  -8.150
  286   HG21  THR  34          3HG2      THR  34   4.521   7.455  -7.382
  287   HG22  THR  34          1HG2      THR  34   4.758   9.060  -8.108
  288   HG23  THR  34          2HG2      THR  34   5.478   8.687  -6.526
  289    H    ARG  35           HN       ARG  35   0.688   8.583  -5.674
  290    HA   ARG  35           HA       ARG  35  -0.275   9.680  -3.221
  291    HB2  ARG  35           2HB      ARG  35   1.294  11.515  -4.016
  292    HB3  ARG  35           3HB      ARG  35   0.218  11.716  -5.419
  293    HG2  ARG  35           2HG      ARG  35  -0.380  13.398  -3.878
  294    HG3  ARG  35           3HG      ARG  35  -1.648  12.153  -3.768
  295    HD2  ARG  35           2HD      ARG  35  -0.809  11.326  -1.718
  296    HD3  ARG  35           3HD      ARG  35   0.738  12.178  -1.912
  297    HE   ARG  35           HE       ARG  35  -1.862  13.552  -1.403
  298   HH11  ARG  35          2HH1      ARG  35   1.596  13.138  -0.896
  299   HH12  ARG  35          1HH1      ARG  35   1.746  14.547   0.131
  300   HH21  ARG  35          2HH2      ARG  35  -1.650  15.417  -0.092
  301   HH22  ARG  35          1HH2      ARG  35  -0.094  15.838   0.586
  302    H    GLY  36           HN       GLY  36  -2.491   9.594  -3.274
  303    HA2  GLY  36           1HA      GLY  36  -4.614   9.898  -4.160
  304    HA3  GLY  36           2HA      GLY  36  -3.886  10.306  -5.730
  305    H    CYS  37           HN       CYS  37  -2.295   7.786  -5.764
  306    HA   CYS  37           HA       CYS  37  -4.164   6.159  -7.162
  307    HB2  CYS  37           2HB      CYS  37  -1.732   6.137  -7.564
  308    HB3  CYS  37           3HB      CYS  37  -1.482   5.409  -5.958
  309    HG   CYS  37           HG       CYS  37  -1.038   3.628  -7.820
  310    H    GLU  38           HN       GLU  38  -5.318   4.388  -6.609
  311    HA   GLU  38           HA       GLU  38  -5.292   3.686  -3.728
  312    HB2  GLU  38           2HB      GLU  38  -7.526   2.538  -4.408
  313    HB3  GLU  38           3HB      GLU  38  -7.459   4.293  -4.124
  314    HG2  GLU  38           2HG      GLU  38  -8.718   4.193  -6.033
  315    HG3  GLU  38           3HG      GLU  38  -7.089   4.415  -6.705
  316    HE2  GLU  38           2HE      GLU  38  -7.420   1.534  -8.517
  317    H    ILE  39           HN       ILE  39  -4.742   1.744  -3.061
  318    HA   ILE  39           HA       ILE  39  -3.737  -0.092  -5.160
  319    HB   ILE  39           HB       ILE  39  -2.844   0.257  -2.268
  320   HG12  ILE  39          2HG1      ILE  39  -1.474   1.000  -4.869
  321   HG13  ILE  39          3HG1      ILE  39  -2.215   2.137  -3.717
  322   HG21  ILE  39          1HG2      ILE  39  -1.018  -1.287  -2.855
  323   HG22  ILE  39          2HG2      ILE  39  -2.609  -2.058  -3.048
  324   HG23  ILE  39          3HG2      ILE  39  -1.715  -1.491  -4.478
  325   HD11  ILE  39          3HD1      ILE  39   0.148   0.325  -3.159
  326   HD12  ILE  39          1HD1      ILE  39   0.232   2.074  -3.458
  327   HD13  ILE  39          2HD1      ILE  39  -0.593   1.463  -2.008
  328    H    TYR  40           HN       TYR  40  -4.767  -1.907  -5.397
  329    HA   TYR  40           HA       TYR  40  -6.487  -2.940  -3.262
  330    HB2  TYR  40           2HB      TYR  40  -7.330  -3.108  -5.513
  331    HB3  TYR  40           3HB      TYR  40  -5.845  -3.901  -6.067
  332    HD1  TYR  40           1HD      TYR  40  -8.653  -4.384  -3.628
  333    HD2  TYR  40           2HD      TYR  40  -5.778  -6.228  -6.172
  334    HE1  TYR  40           1HE      TYR  40  -9.644  -6.581  -3.155
  335    HE2  TYR  40           2HE      TYR  40  -6.764  -8.423  -5.701
  336    HH   TYR  40           HH       TYR  40  -8.364  -9.582  -4.592
  337    H    ILE  41           HN       ILE  41  -5.459  -3.886  -1.604
  338    HA   ILE  41           HA       ILE  41  -2.959  -5.277  -1.887
  339    HB   ILE  41           HB       ILE  41  -5.021  -5.529   0.340
  340   HG12  ILE  41          2HG1      ILE  41  -2.654  -3.645   0.072
  341   HG13  ILE  41          3HG1      ILE  41  -4.368  -3.186  -0.070
  342   HG21  ILE  41          1HG2      ILE  41  -3.087  -6.207   1.707
  343   HG22  ILE  41          2HG2      ILE  41  -3.320  -7.304   0.326
  344   HG23  ILE  41          3HG2      ILE  41  -2.033  -6.076   0.280
  345   HD11  ILE  41          3HD1      ILE  41  -3.025  -4.310   2.400
  346   HD12  ILE  41          1HD1      ILE  41  -3.470  -2.610   2.146
  347   HD13  ILE  41          2HD1      ILE  41  -4.738  -3.849   2.259
  348    H    ARG  42           HN       ARG  42  -2.723  -7.133  -2.975
  349    HA   ARG  42           HA       ARG  42  -5.108  -8.679  -3.614
  350    HB2  ARG  42           2HB      ARG  42  -2.917  -8.098  -5.046
  351    HB3  ARG  42           3HB      ARG  42  -2.389  -9.655  -4.362
  352    HG2  ARG  42           2HG      ARG  42  -5.040  -9.325  -5.778
  353    HG3  ARG  42           3HG      ARG  42  -3.533  -9.705  -6.647
  354    HD2  ARG  42           2HD      ARG  42  -4.293 -11.379  -4.283
  355    HD3  ARG  42           3HD      ARG  42  -5.170 -11.611  -5.811
  356    HE   ARG  42           HE       ARG  42  -2.518 -11.655  -6.544
  357   HH11  ARG  42          2HH1      ARG  42  -4.406 -13.407  -4.137
  358   HH12  ARG  42          1HH1      ARG  42  -3.480 -14.880  -4.305
  359   HH21  ARG  42          2HH2      ARG  42  -1.363 -13.596  -6.792
  360   HH22  ARG  42          1HH2      ARG  42  -1.759 -14.986  -5.807
  361    H    LYS  43           HN       LYS  43  -1.977  -9.346  -1.934
  362    HA   LYS  43           HA       LYS  43  -3.372 -11.219  -0.198
  363    HB2  LYS  43           2HB      LYS  43  -2.965 -12.524  -2.314
  364    HB3  LYS  43           3HB      LYS  43  -1.219 -12.312  -2.035
  365    HG2  LYS  43           2HG      LYS  43  -1.378 -13.526   0.064
  366    HG3  LYS  43           3HG      LYS  43  -3.141 -13.674  -0.128
  367    HD2  LYS  43           2HD      LYS  43  -2.726 -14.925  -2.264
  368    HD3  LYS  43           3HD      LYS  43  -0.989 -14.903  -1.875
  369    HE2  LYS  43           2HE      LYS  43  -2.048 -17.019  -1.199
  370    HE3  LYS  43           3HE      LYS  43  -1.416 -16.122   0.199
  371    HZ1  LYS  43           3HZ      LYS  43  -4.230 -16.177  -0.672
  372    HZ2  LYS  43           1HZ      LYS  43  -3.607 -16.992   0.619
  373    HZ3  LYS  43           2HZ      LYS  43  -3.642 -15.344   0.625
  374    H    VAL  44           HN       VAL  44  -2.535 -10.933   1.729
  375    HA   VAL  44           HA       VAL  44   0.296 -10.109   1.958
  376    HB   VAL  44           HB       VAL  44  -1.808 -10.370   4.139
  377   HG11  VAL  44          1HG1      VAL  44  -0.268  -8.986   5.464
  378   HG12  VAL  44          2HG1      VAL  44   0.500 -10.504   4.945
  379   HG13  VAL  44          3HG1      VAL  44   0.887  -8.980   4.111
  380   HG21  VAL  44          3HG2      VAL  44  -2.484  -8.689   2.495
  381   HG22  VAL  44          1HG2      VAL  44  -2.014  -7.924   4.030
  382   HG23  VAL  44          2HG2      VAL  44  -0.898  -7.894   2.644
  383    H    ALA  45           HN       ALA  45   1.846 -11.502   2.590
  384    HA   ALA  45           HA       ALA  45   1.205 -14.283   2.950
  385    HB1  ALA  45           1HB      ALA  45   3.620 -14.545   3.368
  386    HB2  ALA  45           2HB      ALA  45   3.317 -13.537   1.934
  387    HB3  ALA  45           3HB      ALA  45   3.793 -12.777   3.473
  388    HA   PRO  46           HA       PRO  46   0.367 -14.384   7.289
  389    HB2  PRO  46           2HB      PRO  46   1.316 -16.942   7.869
  390    HB3  PRO  46           3HB      PRO  46  -0.244 -16.587   7.058
  391    HG2  PRO  46           2HG      PRO  46   2.371 -17.317   5.829
  392    HG3  PRO  46           3HG      PRO  46   0.741 -17.974   5.468
  393    HD2  PRO  46           2HD      PRO  46   1.909 -16.118   3.896
  394    HD3  PRO  46           3HD      PRO  46   0.158 -16.040   4.258
  395    H    LEU  47           HN       LEU  47   3.559 -14.923   5.977
  396    HA   LEU  47           HA       LEU  47   4.997 -14.814   8.474
  397    HB2  LEU  47           2HB      LEU  47   5.878 -14.047   5.673
  398    HB3  LEU  47           3HB      LEU  47   6.941 -14.365   7.064
  399    HG   LEU  47           HG       LEU  47   5.092 -16.412   5.822
  400   HD11  LEU  47          1HD1      LEU  47   7.117 -17.374   4.804
  401   HD12  LEU  47          2HD1      LEU  47   6.815 -15.722   4.217
  402   HD13  LEU  47          3HD1      LEU  47   8.077 -16.018   5.438
  403   HD21  LEU  47          3HD2      LEU  47   5.661 -16.818   8.174
  404   HD22  LEU  47          1HD2      LEU  47   6.442 -18.014   7.115
  405   HD23  LEU  47          2HD2      LEU  47   7.392 -16.669   7.786
  406    H    GLY  48           HN       GLY  48   3.462 -12.506   6.382
  407    HA2  GLY  48           1HA      GLY  48   2.974 -10.290   7.029
  408    HA3  GLY  48           2HA      GLY  48   4.319 -10.337   8.190
  409    H    ASP  49           HN       ASP  49   5.809 -11.694   5.802
  410    HA   ASP  49           HA       ASP  49   6.343  -9.289   4.172
  411    HB2  ASP  49           2HB      ASP  49   7.857  -9.036   6.054
  412    HB3  ASP  49           3HB      ASP  49   8.394 -10.724   5.896
  413    HD2  ASP  49           2HD      ASP  49  10.773  -9.847   3.601
  414    HA   PRO  50           HA       PRO  50   6.595  -8.767   2.644
  415    HB2  PRO  50           2HB      PRO  50   6.538  -8.571  -0.064
  416    HB3  PRO  50           3HB      PRO  50   8.072  -8.876   0.814
  417    HG2  PRO  50           2HG      PRO  50   6.372 -10.771  -0.702
  418    HG3  PRO  50           3HG      PRO  50   8.161 -10.696  -0.587
  419    HD2  PRO  50           2HD      PRO  50   6.384 -12.382   0.876
  420    HD3  PRO  50           3HD      PRO  50   8.120 -12.108   1.214
  421    H    ILE  51           HN       ILE  51   4.934  -7.564   1.080
  422    HA   ILE  51           HA       ILE  51   2.380  -9.088   1.214
  423    HB   ILE  51           HB       ILE  51   2.888  -6.086   1.364
  424   HG12  ILE  51          2HG1      ILE  51   1.893  -8.072   3.432
  425   HG13  ILE  51          3HG1      ILE  51   3.489  -7.286   3.408
  426   HG21  ILE  51          1HG2      ILE  51   0.469  -5.874   1.766
  427   HG22  ILE  51          2HG2      ILE  51   0.802  -6.587   0.171
  428   HG23  ILE  51          3HG2      ILE  51   0.274  -7.624   1.518
  429   HD11  ILE  51          3HD1      ILE  51   0.822  -5.889   3.736
  430   HD12  ILE  51          1HD1      ILE  51   1.989  -6.210   5.036
  431   HD13  ILE  51          2HD1      ILE  51   2.418  -5.103   3.715
  432    H    GLN  52           HN       GLN  52   1.178  -9.315  -0.632
  433    HA   GLN  52           HA       GLN  52   2.376  -8.204  -3.102
  434    HB2  GLN  52           2HB      GLN  52   0.156 -10.247  -2.756
  435    HB3  GLN  52           3HB      GLN  52   0.950  -9.793  -4.283
  436    HG2  GLN  52           2HG      GLN  52   2.252 -11.171  -1.922
  437    HG3  GLN  52           3HG      GLN  52   1.768 -11.935  -3.451
  438   HE21  GLN  52          1HE2      GLN  52   4.414 -11.822  -2.196
  439   HE22  GLN  52          2HE2      GLN  52   5.469 -11.040  -3.355
  440    H    ILE  53           HN       ILE  53   1.617  -6.303  -3.774
  441    HA   ILE  53           HA       ILE  53  -1.288  -5.768  -3.380
  442    HB   ILE  53           HB       ILE  53  -0.653  -3.326  -3.429
  443   HG12  ILE  53          2HG1      ILE  53   2.154  -4.418  -3.046
  444   HG13  ILE  53          3HG1      ILE  53   1.543  -3.642  -4.527
  445   HG21  ILE  53          1HG2      ILE  53   0.109  -3.261  -1.088
  446   HG22  ILE  53          2HG2      ILE  53  -1.155  -4.490  -1.325
  447   HG23  ILE  53          3HG2      ILE  53   0.551  -4.981  -1.183
  448   HD11  ILE  53          3HD1      ILE  53   1.794  -2.335  -1.808
  449   HD12  ILE  53          1HD1      ILE  53   2.883  -2.076  -3.188
  450   HD13  ILE  53          2HD1      ILE  53   1.186  -1.560  -3.291
  451    H    ASN  54           HN       ASN  54  -2.462  -5.073  -5.154
  452    HA   ASN  54           HA       ASN  54  -0.999  -5.400  -7.699
  453    HB2  ASN  54           2HB      ASN  54  -3.135  -6.663  -7.198
  454    HB3  ASN  54           3HB      ASN  54  -3.989  -5.108  -7.295
  455   HD21  ASN  54          1HD2      ASN  54  -2.325  -7.627  -9.052
  456   HD22  ASN  54          2HD2      ASN  54  -2.747  -7.076 -10.658
  457    H    VAL  55           HN       VAL  55  -0.101  -3.640  -8.456
  458    HA   VAL  55           HA       VAL  55  -1.786  -1.203  -8.686
  459    HB   VAL  55           HB       VAL  55   1.196  -1.257  -8.065
  460   HG11  VAL  55          1HG1      VAL  55   1.013   1.193  -7.924
  461   HG12  VAL  55          2HG1      VAL  55   0.569   0.597  -9.540
  462   HG13  VAL  55          3HG1      VAL  55  -0.699   1.089  -8.392
  463   HG21  VAL  55          3HG2      VAL  55  -0.156  -1.814  -6.101
  464   HG22  VAL  55          1HG2      VAL  55   0.590  -0.211  -5.924
  465   HG23  VAL  55          2HG2      VAL  55  -1.132  -0.347  -6.348
  466    H    ARG  56           HN       ARG  56  -1.738  -0.258 -10.680
  467    HA   ARG  56           HA       ARG  56  -1.311   0.020 -12.906
  468    HB2  ARG  56           2HB      ARG  56   1.405  -1.241 -12.408
  469    HB3  ARG  56           3HB      ARG  56   0.935  -0.159 -13.742
  470    HG2  ARG  56           2HG      ARG  56   1.138   0.583 -10.811
  471    HG3  ARG  56           3HG      ARG  56   2.287   1.024 -12.098
  472    HD2  ARG  56           2HD      ARG  56   0.694   2.423 -13.171
  473    HD3  ARG  56           3HD      ARG  56  -0.640   1.783 -12.188
  474    HE   ARG  56           HE       ARG  56   0.735   2.834 -10.235
  475   HH11  ARG  56          2HH1      ARG  56   0.534   4.122 -13.503
  476   HH12  ARG  56          1HH1      ARG  56   0.698   5.787 -12.992
  477   HH21  ARG  56          2HH2      ARG  56   0.915   5.009  -9.573
  478   HH22  ARG  56          1HH2      ARG  56   0.913   6.290 -10.765
  479    H    GLY  57           HN       GLY  57  -2.278  -2.608 -11.685
  480    HA2  GLY  57           1HA      GLY  57  -3.183  -4.478 -12.718
  481    HA3  GLY  57           2HA      GLY  57  -2.321  -4.054 -14.215
  482    H    TYR  58           HN       TYR  58  -0.397  -4.121 -11.354
  483    HA   TYR  58           HA       TYR  58   0.446  -6.920 -11.900
  484    HB2  TYR  58           2HB      TYR  58   1.855  -4.800 -12.890
  485    HB3  TYR  58           3HB      TYR  58   2.597  -4.967 -11.289
  486    HD1  TYR  58           1HD      TYR  58   3.703  -7.150 -10.674
  487    HD2  TYR  58           2HD      TYR  58   2.307  -6.367 -14.622
  488    HE1  TYR  58           1HE      TYR  58   5.108  -8.972 -11.533
  489    HE2  TYR  58           2HE      TYR  58   3.706  -8.189 -15.481
  490    HH   TYR  58           HH       TYR  58   5.191  -9.827 -14.994
  491    H    GLU  59           HN       GLU  59   0.943  -8.063 -10.058
  492    HA   GLU  59           HA       GLU  59   0.537  -6.660  -7.523
  493    HB2  GLU  59           2HB      GLU  59   0.892  -8.953  -6.526
  494    HB3  GLU  59           3HB      GLU  59  -0.519  -8.761  -7.594
  495    HG2  GLU  59           2HG      GLU  59   2.090  -9.880  -8.602
  496    HG3  GLU  59           3HG      GLU  59   0.885 -10.901  -7.788
  497    HE2  GLU  59           2HE      GLU  59   0.197  -9.725 -11.488
  498    H    LEU  60           HN       LEU  60   2.095  -5.562  -6.665
  499    HA   LEU  60           HA       LEU  60   4.902  -6.325  -7.185
  500    HB2  LEU  60           2HB      LEU  60   3.778  -3.889  -5.770
  501    HB3  LEU  60           3HB      LEU  60   5.447  -4.129  -6.341
  502    HG   LEU  60           HG       LEU  60   2.993  -3.890  -8.100
  503   HD11  LEU  60          1HD1      LEU  60   3.916  -1.696  -8.722
  504   HD12  LEU  60          2HD1      LEU  60   3.553  -1.782  -6.983
  505   HD13  LEU  60          3HD1      LEU  60   5.234  -1.921  -7.550
  506   HD21  LEU  60          3HD2      LEU  60   4.748  -5.297  -9.083
  507   HD22  LEU  60          1HD2      LEU  60   4.612  -3.751  -9.951
  508   HD23  LEU  60          2HD2      LEU  60   5.945  -4.009  -8.801
  509    H    SER  61           HN       SER  61   6.267  -7.049  -5.629
  510    HA   SER  61           HA       SER  61   5.055  -7.791  -3.067
  511    HB2  SER  61           2HB      SER  61   7.868  -8.238  -4.131
  512    HB3  SER  61           3HB      SER  61   7.147  -9.000  -2.693
  513    HG   SER  61           HG       SER  61   7.035 -10.340  -4.560
  514    H    LEU  62           HN       LEU  62   4.852  -6.181  -1.647
  515    HA   LEU  62           HA       LEU  62   7.175  -4.357  -1.293
  516    HB2  LEU  62           2HB      LEU  62   4.922  -3.374  -1.815
  517    HB3  LEU  62           3HB      LEU  62   4.345  -4.031  -0.265
  518    HG   LEU  62           HG       LEU  62   6.044  -2.660   0.907
  519   HD11  LEU  62          1HD1      LEU  62   7.183  -0.852  -0.317
  520   HD12  LEU  62          2HD1      LEU  62   7.662  -2.452  -0.927
  521   HD13  LEU  62          3HD1      LEU  62   6.505  -1.460  -1.844
  522   HD21  LEU  62          3HD2      LEU  62   3.739  -1.867   0.638
  523   HD22  LEU  62          1HD2      LEU  62   4.890  -0.511   0.599
  524   HD23  LEU  62          2HD2      LEU  62   4.175  -1.114  -0.915
  525    H    ARG  63           HN       ARG  63   8.389  -4.547   0.476
  526    HA   ARG  63           HA       ARG  63   7.856  -6.744   2.268
  527    HB2  ARG  63           2HB      ARG  63   9.931  -4.551   2.541
  528    HB3  ARG  63           3HB      ARG  63   9.941  -6.151   3.321
  529    HG2  ARG  63           2HG      ARG  63   9.869  -7.006   0.827
  530    HG3  ARG  63           3HG      ARG  63  10.545  -5.394   0.490
  531    HD2  ARG  63           2HD      ARG  63  12.389  -6.875   0.778
  532    HD3  ARG  63           3HD      ARG  63  12.295  -5.873   2.242
  533    HE   ARG  63           HE       ARG  63  10.812  -8.085   2.890
  534   HH11  ARG  63          2HH1      ARG  63  14.103  -7.496   1.795
  535   HH12  ARG  63          1HH1      ARG  63  14.732  -8.970   2.498
  536   HH21  ARG  63          2HH2      ARG  63  11.627 -10.028   3.742
  537   HH22  ARG  63          1HH2      ARG  63  13.330 -10.402   3.600
  538    H    LYS  64           HN       LYS  64   7.758  -6.625   4.593
  539    HA   LYS  64           HA       LYS  64   5.639  -4.956   5.446
  540    HB2  LYS  64           2HB      LYS  64   6.233  -5.796   7.747
  541    HB3  LYS  64           3HB      LYS  64   5.926  -7.048   6.519
  542    HG2  LYS  64           2HG      LYS  64   7.768  -7.889   7.625
  543    HG3  LYS  64           3HG      LYS  64   8.513  -7.052   6.241
  544    HD2  LYS  64           2HD      LYS  64   9.789  -6.523   8.199
  545    HD3  LYS  64           3HD      LYS  64   8.876  -5.068   7.732
  546    HE2  LYS  64           2HE      LYS  64   7.184  -5.579   9.441
  547    HE3  LYS  64           3HE      LYS  64   8.089  -7.037   9.905
  548    HZ1  LYS  64           3HZ      LYS  64   9.081  -4.273  10.096
  549    HZ2  LYS  64           1HZ      LYS  64   8.564  -5.197  11.359
  550    HZ3  LYS  64           2HZ      LYS  64   9.920  -5.626  10.526
  551    H    SER  65           HN       SER  65   9.095  -4.456   5.449
  552    HA   SER  65           HA       SER  65   9.295  -2.474   7.455
  553    HB2  SER  65           2HB      SER  65  10.844  -2.583   4.844
  554    HB3  SER  65           3HB      SER  65  11.367  -1.869   6.388
  555    HG   SER  65           HG       SER  65  12.243  -3.968   6.037
  556    H    ALA  66           HN       ALA  66   8.670  -2.181   3.935
  557    HA   ALA  66           HA       ALA  66   8.246   0.680   4.123
  558    HB1  ALA  66           1HB      ALA  66   7.595   0.502   1.757
  559    HB2  ALA  66           2HB      ALA  66   9.119  -0.358   2.078
  560    HB3  ALA  66           3HB      ALA  66   7.603  -1.272   1.890
  561    H    ALA  67           HN       ALA  67   6.207  -2.223   4.037
  562    HA   ALA  67           HA       ALA  67   3.737  -0.916   3.578
  563    HB1  ALA  67           1HB      ALA  67   2.714  -2.971   4.457
  564    HB2  ALA  67           2HB      ALA  67   4.057  -3.334   3.349
  565    HB3  ALA  67           3HB      ALA  67   4.291  -3.475   5.108
  566    H    GLU  68           HN       GLU  68   5.548  -1.515   6.578
  567    HA   GLU  68           HA       GLU  68   3.381  -0.390   8.200
  568    HB2  GLU  68           2HB      GLU  68   6.144  -1.455   8.790
  569    HB3  GLU  68           3HB      GLU  68   5.204  -0.575  10.020
  570    HG2  GLU  68           2HG      GLU  68   4.208  -3.033   8.563
  571    HG3  GLU  68           3HG      GLU  68   5.039  -3.075  10.133
  572    HE2  GLU  68           2HE      GLU  68   1.960  -2.675  11.598
  573    H    MET  69           HN       MET  69   5.427   1.014   6.099
  574    HA   MET  69           HA       MET  69   5.992   3.326   7.898
  575    HB2  MET  69           2HB      MET  69   7.952   2.069   6.870
  576    HB3  MET  69           3HB      MET  69   7.396   2.677   5.293
  577    HG2  MET  69           2HG      MET  69   9.184   4.069   6.153
  578    HG3  MET  69           3HG      MET  69   7.667   4.982   6.089
  579    HE1  MET  69           3HE      MET  69  10.270   3.139   8.381
  580    HE2  MET  69           1HE      MET  69   9.515   3.270   9.986
  581    HE3  MET  69           2HE      MET  69   8.766   2.253   8.734
  582    H    ILE  70           HN       ILE  70   4.237   2.208   5.163
  583    HA   ILE  70           HA       ILE  70   3.925   4.889   4.017
  584    HB   ILE  70           HB       ILE  70   2.638   2.231   3.278
  585   HG12  ILE  70          2HG1      ILE  70   4.850   3.835   1.956
  586   HG13  ILE  70          3HG1      ILE  70   5.061   2.331   2.884
  587   HG21  ILE  70          1HG2      ILE  70   1.900   3.363   1.218
  588   HG22  ILE  70          2HG2      ILE  70   1.199   4.126   2.663
  589   HG23  ILE  70          3HG2      ILE  70   2.566   4.896   1.824
  590   HD11  ILE  70          3HD1      ILE  70   3.516   2.623   0.297
  591   HD12  ILE  70          1HD1      ILE  70   5.130   1.902   0.463
  592   HD13  ILE  70          2HD1      ILE  70   3.729   1.119   1.224
  593    H    GLU  71           HN       GLU  71   2.258   6.232   4.297
  594    HA   GLU  71           HA       GLU  71   0.137   5.426   6.211
  595    HB2  GLU  71           2HB      GLU  71   1.426   7.498   6.627
  596    HB3  GLU  71           3HB      GLU  71   0.887   8.133   5.054
  597    HG2  GLU  71           2HG      GLU  71  -0.565   9.190   6.467
  598    HG3  GLU  71           3HG      GLU  71  -1.503   7.738   6.051
  599    HE2  GLU  71           2HE      GLU  71  -1.811   7.136   9.413
  600    H    VAL  72           HN       VAL  72  -1.701   4.673   5.350
  601    HA   VAL  72           HA       VAL  72  -2.492   5.760   2.697
  602    HB   VAL  72           HB       VAL  72  -3.574   3.546   2.247
  603   HG11  VAL  72          1HG1      VAL  72  -1.498   2.377   1.642
  604   HG12  VAL  72          2HG1      VAL  72  -1.398   4.115   1.278
  605   HG13  VAL  72          3HG1      VAL  72  -0.579   3.457   2.714
  606   HG21  VAL  72          3HG2      VAL  72  -3.757   2.760   4.561
  607   HG22  VAL  72          1HG2      VAL  72  -2.874   1.586   3.557
  608   HG23  VAL  72          2HG2      VAL  72  -1.983   2.650   4.670
  609    H    GLU  73           HN       GLU  73  -4.904   5.040   2.288
  610    HA   GLU  73           HA       GLU  73  -6.484   5.438   4.767
  611    HB2  GLU  73           2HB      GLU  73  -6.249   7.637   3.697
  612    HB3  GLU  73           3HB      GLU  73  -6.841   6.960   2.162
  613    HG2  GLU  73           2HG      GLU  73  -8.968   6.354   3.429
  614    HG3  GLU  73           3HG      GLU  73  -8.362   7.400   4.732
  615    HE2  GLU  73           2HE      GLU  73 -10.034   9.065   1.618
  616    H    LEU  74           HN       LEU  74  -8.118   4.014   4.901
  617    HA   LEU  74           HA       LEU  74  -8.723   2.227   2.717
  618    HB2  LEU  74           2HB      LEU  74  -9.253   2.348   5.470
  619    HB3  LEU  74           3HB      LEU  74 -10.845   2.472   4.684
  620    HG   LEU  74           HG       LEU  74 -10.389   0.172   5.220
  621   HD11  LEU  74          1HD1      LEU  74 -10.598  -0.862   2.999
  622   HD12  LEU  74          2HD1      LEU  74 -11.587   0.610   3.132
  623   HD13  LEU  74          3HD1      LEU  74 -10.044   0.651   2.246
  624   HD21  LEU  74          3HD2      LEU  74  -7.944   0.299   5.323
  625   HD22  LEU  74          1HD2      LEU  74  -8.468  -1.042   4.280
  626   HD23  LEU  74          2HD2      LEU  74  -7.872   0.468   3.552
  627    H    GLU  75           HN       GLU  75  -9.670   2.945   0.904
  628    HA   GLU  75           HA       GLU  75 -10.806   5.502   0.674
  629    HB2  GLU  75           2HB      GLU  75  -9.865   4.162  -1.191
  630    HB3  GLU  75           3HB      GLU  75 -11.308   3.122  -1.133
  631    HG2  GLU  75           2HG      GLU  75 -12.729   4.930  -1.775
  632    HG3  GLU  75           3HG      GLU  75 -11.412   6.109  -1.591
  633    HE2  GLU  75           2HE      GLU  75 -10.289   5.519  -4.776
  634    H    HIS  76           HN       HIS  76 -12.514   6.240   1.624
  635    HA   HIS  76           HA       HIS  76 -14.603   4.519   2.591
  636    HB2  HIS  76           2HB      HIS  76 -15.706   6.809   3.108
  637    HB3  HIS  76           3HB      HIS  76 -14.237   6.331   3.978
  638    HD1  HIS  76           1HD      HIS  76 -15.452   8.725   1.300
  639    HD2  HIS  76           2HD      HIS  76 -12.034   7.966   3.579
  640    HE1  HIS  76           1HE      HIS  76 -13.898  10.693   0.926
  641    HE2  HIS  76           2HE      HIS  76 -11.824  10.225   2.311
  642    H    HIS  77           HN       HIS  77 -16.130   3.659   1.443
  643    HA   HIS  77           HA       HIS  77 -17.553   5.389  -0.528
  644    HB2  HIS  77           2HB      HIS  77 -17.049   2.395  -0.641
  645    HB3  HIS  77           3HB      HIS  77 -18.214   3.247  -1.671
  646    HD1  HIS  77           1HD      HIS  77 -17.227   4.926  -3.449
  647    HD2  HIS  77           2HD      HIS  77 -14.416   2.536  -1.491
  648    HE1  HIS  77           1HE      HIS  77 -15.105   5.056  -4.827
  649    HE2  HIS  77           2HE      HIS  77 -13.404   3.607  -3.631
  650    H    HIS  78           HN       HIS  78 -19.628   5.763   0.040
  651    HA   HIS  78           HA       HIS  78 -21.602   5.645   1.212
  652    HB2  HIS  78           2HB      HIS  78 -21.694   3.460  -0.044
  653    HB3  HIS  78           3HB      HIS  78 -21.017   2.669   1.392
  654    HD1  HIS  78           1HD      HIS  78 -24.070   4.754   0.428
  655    HD2  HIS  78           2HD      HIS  78 -22.904   1.803   3.144
  656    HE1  HIS  78           1HE      HIS  78 -26.164   4.087   1.691
  657    HE2  HIS  78           2HE      HIS  78 -25.448   2.293   3.336
  658    H    HIS  79           HN       HIS  79 -19.151   6.211   2.582
  659    HA   HIS  79           HA       HIS  79 -18.354   6.557   4.688
  660    HB2  HIS  79           2HB      HIS  79 -20.868   5.189   5.700
  661    HB3  HIS  79           3HB      HIS  79 -19.720   6.133   6.669
  662    HD1  HIS  79           1HD      HIS  79 -22.916   6.456   5.247
  663    HD2  HIS  79           2HD      HIS  79 -19.559   8.939   5.366
  664    HE1  HIS  79           1HE      HIS  79 -23.759   8.803   4.806
  665    HE2  HIS  79           2HE      HIS  79 -21.719  10.313   4.893
  666    H    HIS  80           HN       HIS  80 -20.121   3.485   5.096
  667    HA   HIS  80           HA       HIS  80 -17.924   1.732   4.840
  668    HB2  HIS  80           2HB      HIS  80 -17.227   3.038   6.948
  669    HB3  HIS  80           3HB      HIS  80 -18.596   2.246   7.752
  670    HD1  HIS  80           1HD      HIS  80 -15.121   1.899   7.542
  671    HD2  HIS  80           2HD      HIS  80 -18.270  -0.815   7.141
  672    HE1  HIS  80           1HE      HIS  80 -14.132  -0.395   7.958
  673    HE2  HIS  80           2HE      HIS  80 -16.047  -2.043   7.706
  674    H    HIS  81           HN       HIS  81 -20.904   2.603   6.525
  675    HA   HIS  81           HA       HIS  81 -22.086   0.016   5.718
  676    HB2  HIS  81           2HB      HIS  81 -21.341  -0.394   7.992
  677    HB3  HIS  81           3HB      HIS  81 -22.078   1.122   8.547
  678    HD1  HIS  81           1HD      HIS  81 -24.582   1.140   9.018
  679    HD2  HIS  81           2HD      HIS  81 -23.203  -2.499   7.491
  680    HE1  HIS  81           1HE      HIS  81 -26.477  -0.514   9.314
  681    HE2  HIS  81           2HE      HIS  81 -25.639  -2.716   8.379
  Start of MODEL    4
    1    H1   MET   1           HN       MET   1  -0.304   4.016  13.341
    2    HA   MET   1           HA       MET   1  -2.283   5.869  12.484
    3    HB2  MET   1           2HB      MET   1  -1.386   6.824  10.489
    4    HB3  MET   1           3HB      MET   1  -0.260   7.202  11.814
    5    HG2  MET   1           2HG      MET   1   0.122   4.966   9.807
    6    HG3  MET   1           3HG      MET   1   0.850   6.576   9.675
    7    HE1  MET   1           3HE      MET   1   3.266   5.531   9.462
    8    HE2  MET   1           1HE      MET   1   3.936   4.335  10.595
    9    HE3  MET   1           2HE      MET   1   2.557   3.901   9.559
   10    H    PHE   2           HN       PHE   2  -3.000   5.278  10.095
   11    HA   PHE   2           HA       PHE   2  -3.120   2.349  10.084
   12    HB2  PHE   2           2HB      PHE   2  -5.137   3.792   9.708
   13    HB3  PHE   2           3HB      PHE   2  -4.413   4.332   8.184
   14    HD1  PHE   2           2HD      PHE   2  -5.560   1.292  10.001
   15    HD2  PHE   2           1HD      PHE   2  -4.693   3.064   6.225
   16    HE1  PHE   2           2HE      PHE   2  -6.516  -0.666   8.863
   17    HE2  PHE   2           1HE      PHE   2  -5.645   1.109   5.088
   18    HZ   PHE   2           HZ       PHE   2  -6.559  -0.760   6.404
   19    H    SER   3           HN       SER   3  -1.338   1.410   9.337
   20    HA   SER   3           HA       SER   3   0.055   2.569   7.007
   21    HB2  SER   3           2HB      SER   3   0.772   0.091   8.610
   22    HB3  SER   3           3HB      SER   3   1.833   1.064   7.563
   23    HG   SER   3           HG       SER   3   2.116   1.533   9.798
   24    H    LEU   4           HN       LEU   4   0.596   1.244   5.155
   25    HA   LEU   4           HA       LEU   4  -1.605  -0.220   4.107
   26    HB2  LEU   4           2HB      LEU   4   0.114   0.942   2.760
   27    HB3  LEU   4           3HB      LEU   4   1.307  -0.281   3.261
   28    HG   LEU   4           HG       LEU   4   0.066  -2.013   2.088
   29   HD11  LEU   4          1HD1      LEU   4  -1.872  -1.450   0.680
   30   HD12  LEU   4          2HD1      LEU   4  -2.196  -1.110   2.396
   31   HD13  LEU   4          3HD1      LEU   4  -1.821   0.225   1.280
   32   HD21  LEU   4          3HD2      LEU   4   1.767  -0.728   0.871
   33   HD22  LEU   4          1HD2      LEU   4   0.446  -1.225  -0.212
   34   HD23  LEU   4          2HD2      LEU   4   0.531   0.452   0.377
   35    H    ARG   5           HN       ARG   5   1.237  -1.158   5.939
   36    HA   ARG   5           HA       ARG   5   1.131  -3.976   5.563
   37    HB2  ARG   5           2HB      ARG   5   2.747  -2.223   6.854
   38    HB3  ARG   5           3HB      ARG   5   1.832  -2.870   8.237
   39    HG2  ARG   5           2HG      ARG   5   3.380  -4.540   6.247
   40    HG3  ARG   5           3HG      ARG   5   3.986  -4.017   7.837
   41    HD2  ARG   5           2HD      ARG   5   1.716  -5.915   7.222
   42    HD3  ARG   5           3HD      ARG   5   3.217  -6.240   8.115
   43    HE   ARG   5           HE       ARG   5   0.758  -5.232   9.171
   44   HH11  ARG   5          2HH1      ARG   5   4.241  -4.753   9.495
   45   HH12  ARG   5          1HH1      ARG   5   4.144  -4.346  11.193
   46   HH21  ARG   5          2HH2      ARG   5   0.657  -4.769  11.371
   47   HH22  ARG   5          1HH2      ARG   5   2.110  -4.356  12.255
   48    H    ASP   6           HN       ASP   6  -0.809  -1.744   7.437
   49    HA   ASP   6           HA       ASP   6  -1.869  -3.885   9.170
   50    HB2  ASP   6           2HB      ASP   6  -1.190  -1.556   9.971
   51    HB3  ASP   6           3HB      ASP   6  -2.630  -0.951   9.124
   52    HD2  ASP   6           2HD      ASP   6  -3.385  -3.344  12.223
   53    H    ALA   7           HN       ALA   7  -2.472  -2.695   6.133
   54    HA   ALA   7           HA       ALA   7  -5.378  -2.751   6.230
   55    HB1  ALA   7           1HB      ALA   7  -5.226  -2.528   3.783
   56    HB2  ALA   7           2HB      ALA   7  -4.188  -1.343   4.608
   57    HB3  ALA   7           3HB      ALA   7  -3.469  -2.795   3.869
   58    H    LYS   8           HN       LYS   8  -6.663  -4.258   4.900
   59    HA   LYS   8           HA       LYS   8  -5.482  -6.987   5.087
   60    HB2  LYS   8           2HB      LYS   8  -8.337  -6.052   5.489
   61    HB3  LYS   8           3HB      LYS   8  -7.870  -7.761   5.320
   62    HG2  LYS   8           2HG      LYS   8  -8.081  -7.405   7.632
   63    HG3  LYS   8           3HG      LYS   8  -6.329  -7.376   7.318
   64    HD2  LYS   8           2HD      LYS   8  -6.439  -4.885   7.251
   65    HD3  LYS   8           3HD      LYS   8  -8.152  -4.990   7.723
   66    HE2  LYS   8           2HE      LYS   8  -5.793  -6.030   9.326
   67    HE3  LYS   8           3HE      LYS   8  -6.705  -4.543   9.660
   68    HZ1  LYS   8           3HZ      LYS   8  -7.806  -7.273   9.712
   69    HZ2  LYS   8           1HZ      LYS   8  -7.440  -6.361  11.034
   70    HZ3  LYS   8           2HZ      LYS   8  -8.652  -5.892  10.021
   71    H    CYS   9           HN       CYS   9  -6.168  -8.549   3.520
   72    HA   CYS   9           HA       CYS   9  -6.008  -7.512   0.872
   73    HB2  CYS   9           2HB      CYS   9  -6.407  -9.861   0.185
   74    HB3  CYS   9           3HB      CYS   9  -5.128  -9.687   1.412
   75    HG   CYS   9           HG       CYS   9  -6.430 -11.922   1.796
   76    H    GLY  10           HN       GLY  10  -7.506  -7.638  -0.872
   77    HA2  GLY  10           1HA      GLY  10  -9.635  -7.946  -1.810
   78    HA3  GLY  10           2HA      GLY  10 -10.309  -8.218  -0.186
   79    H    GLN  11           HN       GLN  11  -8.443  -5.572   0.205
   80    HA   GLN  11           HA       GLN  11 -10.738  -3.768  -0.394
   81    HB2  GLN  11           2HB      GLN  11  -8.684  -3.645   1.836
   82    HB3  GLN  11           3HB      GLN  11  -9.930  -2.413   1.520
   83    HG2  GLN  11           2HG      GLN  11 -11.686  -4.013   1.984
   84    HG3  GLN  11           3HG      GLN  11 -10.492  -5.315   2.176
   85   HE21  GLN  11          1HE2      GLN  11  -9.218  -5.419   4.039
   86   HE22  GLN  11          2HE2      GLN  11  -9.612  -4.503   5.478
   87    H    THR  12           HN       THR  12 -10.110  -1.454  -0.643
   88    HA   THR  12           HA       THR  12  -7.531  -1.246  -2.122
   89    HB   THR  12           HB       THR  12 -10.079   0.317  -2.686
   90    HG1  THR  12           1HG      THR  12 -10.265  -1.132  -4.479
   91   HG21  THR  12          3HG2      THR  12  -7.535  -0.086  -4.299
   92   HG22  THR  12          1HG2      THR  12  -8.955   0.851  -4.817
   93   HG23  THR  12          2HG2      THR  12  -7.993   1.395  -3.424
   94    H    VAL  13           HN       VAL  13  -6.217   0.451  -1.631
   95    HA   VAL  13           HA       VAL  13  -7.279   2.395   0.353
   96    HB   VAL  13           HB       VAL  13  -5.044   2.460   1.397
   97   HG11  VAL  13          1HG1      VAL  13  -5.129   0.282   2.535
   98   HG12  VAL  13          2HG1      VAL  13  -6.754   0.975   2.331
   99   HG13  VAL  13          3HG1      VAL  13  -6.207  -0.339   1.263
  100   HG21  VAL  13          3HG2      VAL  13  -3.715   1.793  -0.551
  101   HG22  VAL  13          1HG2      VAL  13  -3.354   0.758   0.850
  102   HG23  VAL  13          2HG2      VAL  13  -4.393   0.150  -0.460
  103    H    LYS  14           HN       LYS  14  -6.251   4.476   0.374
  104    HA   LYS  14           HA       LYS  14  -4.930   5.152  -2.211
  105    HB2  LYS  14           2HB      LYS  14  -7.097   6.285  -1.779
  106    HB3  LYS  14           3HB      LYS  14  -6.426   6.948  -0.269
  107    HG2  LYS  14           2HG      LYS  14  -4.625   8.018  -1.701
  108    HG3  LYS  14           3HG      LYS  14  -5.613   7.567  -3.111
  109    HD2  LYS  14           2HD      LYS  14  -6.415   9.364  -0.806
  110    HD3  LYS  14           3HD      LYS  14  -6.115   9.844  -2.493
  111    HE2  LYS  14           2HE      LYS  14  -8.015   8.417  -3.203
  112    HE3  LYS  14           3HE      LYS  14  -8.337   8.034  -1.498
  113    HZ1  LYS  14           3HZ      LYS  14  -8.420  10.721  -2.695
  114    HZ2  LYS  14           1HZ      LYS  14  -9.732   9.809  -2.288
  115    HZ3  LYS  14           2HZ      LYS  14  -8.719  10.365  -1.113
  116    H    VAL  15           HN       VAL  15  -2.817   5.621  -2.076
  117    HA   VAL  15           HA       VAL  15  -1.519   5.773   0.495
  118    HB   VAL  15           HB       VAL  15  -0.403   6.466  -2.245
  119   HG11  VAL  15          1HG1      VAL  15   1.773   5.943  -1.230
  120   HG12  VAL  15          2HG1      VAL  15   0.962   7.281  -0.382
  121   HG13  VAL  15          3HG1      VAL  15   0.974   5.650   0.332
  122   HG21  VAL  15          3HG2      VAL  15  -1.374   4.220  -2.218
  123   HG22  VAL  15          1HG2      VAL  15   0.402   4.146  -2.303
  124   HG23  VAL  15          2HG2      VAL  15  -0.428   3.821  -0.763
  125    H    VAL  16           HN       VAL  16  -1.276   7.519   1.770
  126    HA   VAL  16           HA       VAL  16  -1.619  10.149   0.436
  127    HB   VAL  16           HB       VAL  16  -2.248  10.962   2.790
  128   HG11  VAL  16          1HG1      VAL  16  -4.595  10.282   2.490
  129   HG12  VAL  16          2HG1      VAL  16  -3.846  10.734   0.941
  130   HG13  VAL  16          3HG1      VAL  16  -4.081   9.017   1.350
  131   HG21  VAL  16          3HG2      VAL  16  -1.480   8.991   4.033
  132   HG22  VAL  16          1HG2      VAL  16  -3.218   9.270   4.293
  133   HG23  VAL  16          2HG2      VAL  16  -2.680   7.984   3.188
  134    H    LYS  17           HN       LYS  17   0.268   8.370   2.888
  135    HA   LYS  17           HA       LYS  17   2.289  10.523   2.604
  136    HB2  LYS  17           2HB      LYS  17   1.036   9.487   5.115
  137    HB3  LYS  17           3HB      LYS  17   2.755   9.950   5.139
  138    HG2  LYS  17           2HG      LYS  17   2.200  12.196   4.426
  139    HG3  LYS  17           3HG      LYS  17   0.486  11.752   4.250
  140    HD2  LYS  17           2HD      LYS  17   1.872  11.329   6.881
  141    HD3  LYS  17           3HD      LYS  17   1.326  12.961   6.423
  142    HE2  LYS  17           2HE      LYS  17  -0.932  12.304   6.327
  143    HE3  LYS  17           3HE      LYS  17  -0.520  10.576   6.274
  144    HZ1  LYS  17           3HZ      LYS  17  -0.142  12.357   8.589
  145    HZ2  LYS  17           1HZ      LYS  17  -1.333  11.229   8.429
  146    HZ3  LYS  17           2HZ      LYS  17   0.241  10.754   8.538
  147    H    LEU  18           HN       LEU  18   4.201   9.814   2.082
  148    HA   LEU  18           HA       LEU  18   4.840   6.959   2.568
  149    HB2  LEU  18           2HB      LEU  18   6.161   9.064   0.828
  150    HB3  LEU  18           3HB      LEU  18   6.749   7.397   1.032
  151    HG   LEU  18           HG       LEU  18   4.123   8.240  -0.228
  152   HD11  LEU  18          1HD1      LEU  18   5.132   7.376  -2.300
  153   HD12  LEU  18          2HD1      LEU  18   6.091   8.710  -1.618
  154   HD13  LEU  18          3HD1      LEU  18   6.639   7.028  -1.420
  155   HD21  LEU  18          3HD2      LEU  18   3.919   6.108   0.975
  156   HD22  LEU  18          1HD2      LEU  18   3.860   5.856  -0.786
  157   HD23  LEU  18          2HD2      LEU  18   5.348   5.483   0.115
  158    H    HIS  19           HN       HIS  19   5.654   6.721   4.603
  159    HA   HIS  19           HA       HIS  19   7.152   8.865   5.867
  160    HB2  HIS  19           2HB      HIS  19   6.588   6.002   6.703
  161    HB3  HIS  19           3HB      HIS  19   7.471   7.173   7.702
  162    HD1  HIS  19           1HD      HIS  19   5.940   7.820   9.546
  163    HD2  HIS  19           2HD      HIS  19   3.964   7.639   5.863
  164    HE1  HIS  19           1HE      HIS  19   3.564   8.588   9.974
  165    HE2  HIS  19           2HE      HIS  19   2.374   8.479   7.741
  166    H    GLY  20           HN       GLY  20   7.951   6.541   3.586
  167    HA2  GLY  20           1HA      GLY  20  10.576   5.817   4.434
  168    HA3  GLY  20           2HA      GLY  20   9.972   5.835   2.761
  169    H    THR  21           HN       THR  21  12.387   6.972   4.589
  170    HA   THR  21           HA       THR  21  12.231   9.792   3.968
  171    HB   THR  21           HB       THR  21  14.700   9.656   4.836
  172    HG1  THR  21           1HG      THR  21  14.998   7.769   6.141
  173   HG21  THR  21          3HG2      THR  21  12.346   8.935   6.618
  174   HG22  THR  21          1HG2      THR  21  13.885   9.638   7.165
  175   HG23  THR  21          2HG2      THR  21  12.806  10.578   6.109
  176    H    GLY  22           HN       GLY  22  12.055   9.867   1.712
  177    HA2  GLY  22           1HA      GLY  22  13.003  10.513  -0.265
  178    HA3  GLY  22           2HA      GLY  22  14.592  10.434   0.529
  179    H    ALA  23           HN       ALA  23  15.743   8.408   0.548
  180    HA   ALA  23           HA       ALA  23  15.759   7.134  -1.963
  181    HB1  ALA  23           1HB      ALA  23  17.279   5.504  -0.918
  182    HB2  ALA  23           2HB      ALA  23  17.679   7.168  -0.433
  183    HB3  ALA  23           3HB      ALA  23  16.808   6.099   0.692
  184    H    LEU  24           HN       LEU  24  14.202   6.232   1.093
  185    HA   LEU  24           HA       LEU  24  13.193   3.713   0.162
  186    HB2  LEU  24           2HB      LEU  24  12.640   5.556   2.455
  187    HB3  LEU  24           3HB      LEU  24  11.441   4.300   2.068
  188    HG   LEU  24           HG       LEU  24  12.963   3.604   3.849
  189   HD11  LEU  24          1HD1      LEU  24  13.609   1.430   2.893
  190   HD12  LEU  24          2HD1      LEU  24  11.987   1.923   2.355
  191   HD13  LEU  24          3HD1      LEU  24  13.377   2.084   1.256
  192   HD21  LEU  24          3HD2      LEU  24  14.943   4.885   3.186
  193   HD22  LEU  24          1HD2      LEU  24  15.337   3.162   3.383
  194   HD23  LEU  24          2HD2      LEU  24  15.143   3.846   1.754
  195    H    LYS  25           HN       LYS  25  11.824   7.031   0.307
  196    HA   LYS  25           HA       LYS  25   9.215   6.170  -0.499
  197    HB2  LYS  25           2HB      LYS  25   8.617   8.451  -0.625
  198    HB3  LYS  25           3HB      LYS  25   9.749   8.293   0.740
  199    HG2  LYS  25           2HG      LYS  25  11.525   9.275  -0.544
  200    HG3  LYS  25           3HG      LYS  25  10.519   9.283  -2.012
  201    HD2  LYS  25           2HD      LYS  25   9.883  10.800   0.539
  202    HD3  LYS  25           3HD      LYS  25  10.652  11.506  -0.902
  203    HE2  LYS  25           2HE      LYS  25   8.699  11.063  -2.240
  204    HE3  LYS  25           3HE      LYS  25   7.950  10.128  -0.928
  205    HZ1  LYS  25           3HZ      LYS  25   8.545  13.009  -0.855
  206    HZ2  LYS  25           1HZ      LYS  25   7.054  12.342  -1.066
  207    HZ3  LYS  25           2HZ      LYS  25   7.850  12.142   0.362
  208    H    ARG  26           HN       ARG  26  12.110   7.204  -2.282
  209    HA   ARG  26           HA       ARG  26  10.724   7.601  -4.753
  210    HB2  ARG  26           2HB      ARG  26  12.952   8.540  -4.396
  211    HB3  ARG  26           3HB      ARG  26  13.638   6.900  -4.284
  212    HG2  ARG  26           2HG      ARG  26  13.015   6.445  -6.589
  213    HG3  ARG  26           3HG      ARG  26  12.218   8.032  -6.714
  214    HD2  ARG  26           2HD      ARG  26  14.382   9.140  -6.355
  215    HD3  ARG  26           3HD      ARG  26  15.174   7.553  -6.243
  216    HE   ARG  26           HE       ARG  26  13.739   7.666  -8.679
  217   HH11  ARG  26          2HH1      ARG  26  16.487   9.213  -7.123
  218   HH12  ARG  26          1HH1      ARG  26  17.339   9.496  -8.624
  219   HH21  ARG  26          2HH2      ARG  26  14.869   8.007 -10.630
  220   HH22  ARG  26          1HH2      ARG  26  16.422   8.811 -10.613
  221    H    ARG  27           HN       ARG  27  12.477   4.773  -3.363
  222    HA   ARG  27           HA       ARG  27  12.148   3.076  -5.592
  223    HB2  ARG  27           2HB      ARG  27  12.235   2.455  -2.630
  224    HB3  ARG  27           3HB      ARG  27  12.228   1.207  -3.900
  225    HG2  ARG  27           2HG      ARG  27  14.306   2.193  -4.824
  226    HG3  ARG  27           3HG      ARG  27  14.327   3.346  -3.468
  227    HD2  ARG  27           2HD      ARG  27  14.425   1.450  -1.882
  228    HD3  ARG  27           3HD      ARG  27  14.456   0.321  -3.253
  229    HE   ARG  27           HE       ARG  27  16.551   2.293  -3.427
  230   HH11  ARG  27          2HH1      ARG  27  15.651  -0.813  -2.013
  231   HH12  ARG  27          1HH1      ARG  27  17.306  -1.290  -1.714
  232   HH21  ARG  27          2HH2      ARG  27  18.684   1.683  -2.988
  233   HH22  ARG  27          1HH2      ARG  27  19.025   0.124  -2.266
  234    H    ILE  28           HN       ILE  28  10.020   3.695  -2.807
  235    HA   ILE  28           HA       ILE  28   7.972   1.873  -3.514
  236    HB   ILE  28           HB       ILE  28   7.898   4.482  -1.954
  237   HG12  ILE  28          2HG1      ILE  28   7.932   1.588  -1.043
  238   HG13  ILE  28          3HG1      ILE  28   9.335   2.683  -1.052
  239   HG21  ILE  28          1HG2      ILE  28   5.751   3.716  -1.037
  240   HG22  ILE  28          2HG2      ILE  28   5.660   3.950  -2.798
  241   HG23  ILE  28          3HG2      ILE  28   5.792   2.308  -2.123
  242   HD11  ILE  28          3HD1      ILE  28   6.800   3.053   0.563
  243   HD12  ILE  28          1HD1      ILE  28   8.362   2.498   1.200
  244   HD13  ILE  28          2HD1      ILE  28   8.205   4.145   0.556
  245    H    MET  29           HN       MET  29   8.358   5.368  -4.269
  246    HA   MET  29           HA       MET  29   5.847   5.435  -5.704
  247    HB2  MET  29           2HB      MET  29   6.329   7.719  -6.156
  248    HB3  MET  29           3HB      MET  29   6.817   7.371  -4.480
  249    HG2  MET  29           2HG      MET  29   8.560   8.663  -5.181
  250    HG3  MET  29           3HG      MET  29   9.181   7.045  -5.545
  251    HE1  MET  29           3HE      MET  29  10.970   8.461  -7.072
  252    HE2  MET  29           1HE      MET  29  10.476   9.492  -8.435
  253    HE3  MET  29           2HE      MET  29  10.095   9.981  -6.768
  254    H    ASP  30           HN       ASP  30   9.206   4.923  -6.567
  255    HA   ASP  30           HA       ASP  30   9.019   5.303  -9.369
  256    HB2  ASP  30           2HB      ASP  30  11.160   5.067  -8.274
  257    HB3  ASP  30           3HB      ASP  30  10.741   3.436  -7.706
  258    HD2  ASP  30           2HD      ASP  30  11.900   2.042 -10.606
  259    H    MET  31           HN       MET  31   8.127   2.583  -7.281
  260    HA   MET  31           HA       MET  31   7.575   0.802  -9.492
  261    HB2  MET  31           2HB      MET  31   6.800   0.762  -6.566
  262    HB3  MET  31           3HB      MET  31   6.341  -0.513  -7.720
  263    HG2  MET  31           2HG      MET  31   8.699  -0.976  -8.165
  264    HG3  MET  31           3HG      MET  31   9.178   0.320  -7.057
  265    HE1  MET  31           3HE      MET  31   7.109   0.013  -4.684
  266    HE2  MET  31           1HE      MET  31   8.008  -1.057  -3.585
  267    HE3  MET  31           2HE      MET  31   8.858   0.245  -4.448
  268    H    GLY  32           HN       GLY  32   5.838   3.395  -7.914
  269    HA2  GLY  32           1HA      GLY  32   4.040   4.097  -9.645
  270    HA3  GLY  32           2HA      GLY  32   3.346   2.505  -9.266
  271    H    ILE  33           HN       ILE  33   4.595   3.248  -6.408
  272    HA   ILE  33           HA       ILE  33   2.014   4.259  -5.435
  273    HB   ILE  33           HB       ILE  33   4.512   3.484  -3.879
  274   HG12  ILE  33          2HG1      ILE  33   2.039   1.845  -4.517
  275   HG13  ILE  33          3HG1      ILE  33   3.632   1.645  -5.286
  276   HG21  ILE  33          1HG2      ILE  33   2.964   3.258  -1.981
  277   HG22  ILE  33          2HG2      ILE  33   2.956   4.913  -2.631
  278   HG23  ILE  33          3HG2      ILE  33   1.621   3.801  -3.012
  279   HD11  ILE  33          3HD1      ILE  33   3.010   1.248  -2.349
  280   HD12  ILE  33          1HD1      ILE  33   3.267  -0.046  -3.538
  281   HD13  ILE  33          2HD1      ILE  33   4.602   1.047  -3.118
  282    H    THR  34           HN       THR  34   2.157   6.395  -6.372
  283    HA   THR  34           HA       THR  34   4.430   8.042  -5.417
  284    HB   THR  34           HB       THR  34   3.570   9.617  -7.268
  285    HG1  THR  34           1HG      THR  34   2.261   8.533  -8.839
  286   HG21  THR  34          3HG2      THR  34   4.533   6.848  -8.055
  287   HG22  THR  34          1HG2      THR  34   4.647   8.311  -9.059
  288   HG23  THR  34          2HG2      THR  34   5.562   8.205  -7.538
  289    H    ARG  35           HN       ARG  35   1.893   7.464  -3.829
  290    HA   ARG  35           HA       ARG  35   0.495   8.623  -2.429
  291    HB2  ARG  35           2HB      ARG  35   2.409  10.090  -1.977
  292    HB3  ARG  35           3HB      ARG  35   1.981  11.088  -3.387
  293    HG2  ARG  35           2HG      ARG  35  -0.261  11.478  -2.235
  294    HG3  ARG  35           3HG      ARG  35   0.491  10.780  -0.780
  295    HD2  ARG  35           2HD      ARG  35   0.679  13.199  -0.711
  296    HD3  ARG  35           3HD      ARG  35   2.289  12.484  -0.929
  297    HE   ARG  35           HE       ARG  35   1.188  13.045  -3.478
  298   HH11  ARG  35          2HH1      ARG  35   2.454  14.739  -0.654
  299   HH12  ARG  35          1HH1      ARG  35   2.958  16.136  -1.574
  300   HH21  ARG  35          2HH2      ARG  35   1.835  14.860  -4.652
  301   HH22  ARG  35          1HH2      ARG  35   2.608  16.205  -3.841
  302    H    GLY  36           HN       GLY  36  -1.618   9.009  -2.726
  303    HA2  GLY  36           1HA      GLY  36  -3.516   9.903  -3.799
  304    HA3  GLY  36           2HA      GLY  36  -2.481  10.527  -5.103
  305    H    CYS  37           HN       CYS  37  -1.190   7.694  -4.880
  306    HA   CYS  37           HA       CYS  37  -2.776   6.490  -7.002
  307    HB2  CYS  37           2HB      CYS  37  -0.262   6.445  -6.832
  308    HB3  CYS  37           3HB      CYS  37  -0.441   5.345  -5.442
  309    HG   CYS  37           HG       CYS  37   0.378   4.010  -7.533
  310    H    GLU  38           HN       GLU  38  -3.895   4.528  -6.888
  311    HA   GLU  38           HA       GLU  38  -4.781   3.868  -4.136
  312    HB2  GLU  38           2HB      GLU  38  -6.740   2.876  -5.182
  313    HB3  GLU  38           3HB      GLU  38  -6.530   4.565  -5.699
  314    HG2  GLU  38           2HG      GLU  38  -5.401   3.626  -7.780
  315    HG3  GLU  38           3HG      GLU  38  -6.030   2.043  -7.277
  316    HE2  GLU  38           2HE      GLU  38  -8.413   4.403  -9.192
  317    H    ILE  39           HN       ILE  39  -4.695   1.815  -3.334
  318    HA   ILE  39           HA       ILE  39  -3.208  -0.151  -4.993
  319    HB   ILE  39           HB       ILE  39  -2.768   0.480  -2.046
  320   HG12  ILE  39          2HG1      ILE  39  -0.995   0.826  -4.480
  321   HG13  ILE  39          3HG1      ILE  39  -1.723   2.117  -3.495
  322   HG21  ILE  39          1HG2      ILE  39  -1.019  -1.249  -2.126
  323   HG22  ILE  39          2HG2      ILE  39  -2.622  -1.928  -2.494
  324   HG23  ILE  39          3HG2      ILE  39  -1.462  -1.618  -3.808
  325   HD11  ILE  39          3HD1      ILE  39   0.344   0.113  -2.555
  326   HD12  ILE  39          1HD1      ILE  39   0.656   1.817  -2.952
  327   HD13  ILE  39          2HD1      ILE  39  -0.384   1.407  -1.572
  328    H    TYR  40           HN       TYR  40  -4.316  -1.953  -5.237
  329    HA   TYR  40           HA       TYR  40  -6.353  -2.692  -3.224
  330    HB2  TYR  40           2HB      TYR  40  -6.909  -2.779  -5.642
  331    HB3  TYR  40           3HB      TYR  40  -5.615  -3.965  -5.882
  332    HD1  TYR  40           2HD      TYR  40  -5.854  -6.267  -4.952
  333    HD2  TYR  40           1HD      TYR  40  -9.033  -3.439  -4.697
  334    HE1  TYR  40           2HE      TYR  40  -7.431  -8.085  -4.476
  335    HE2  TYR  40           1HE      TYR  40 -10.612  -5.261  -4.231
  336    HH   TYR  40           HH       TYR  40  -9.577  -8.666  -4.042
  337    H    ILE  41           HN       ILE  41  -5.712  -3.907  -1.540
  338    HA   ILE  41           HA       ILE  41  -3.148  -5.245  -1.608
  339    HB   ILE  41           HB       ILE  41  -5.331  -5.502   0.495
  340   HG12  ILE  41          2HG1      ILE  41  -3.685  -3.909   1.742
  341   HG13  ILE  41          3HG1      ILE  41  -3.127  -3.485   0.105
  342   HG21  ILE  41          1HG2      ILE  41  -3.478  -6.197   1.972
  343   HG22  ILE  41          2HG2      ILE  41  -3.629  -7.281   0.569
  344   HG23  ILE  41          3HG2      ILE  41  -2.342  -6.052   0.611
  345   HD11  ILE  41          3HD1      ILE  41  -5.957  -3.212   1.145
  346   HD12  ILE  41          1HD1      ILE  41  -4.805  -1.880   0.917
  347   HD13  ILE  41          2HD1      ILE  41  -5.397  -2.788  -0.490
  348    H    ARG  42           HN       ARG  42  -2.759  -7.144  -2.475
  349    HA   ARG  42           HA       ARG  42  -5.007  -8.756  -3.411
  350    HB2  ARG  42           2HB      ARG  42  -2.013  -9.187  -3.691
  351    HB3  ARG  42           3HB      ARG  42  -3.293 -10.048  -4.580
  352    HG2  ARG  42           2HG      ARG  42  -2.746  -7.074  -4.760
  353    HG3  ARG  42           3HG      ARG  42  -2.181  -8.294  -5.924
  354    HD2  ARG  42           2HD      ARG  42  -5.078  -7.701  -5.243
  355    HD3  ARG  42           3HD      ARG  42  -4.223  -7.151  -6.699
  356    HE   ARG  42           HE       ARG  42  -3.953  -9.947  -6.568
  357   HH11  ARG  42          2HH1      ARG  42  -6.474  -7.531  -7.023
  358   HH12  ARG  42          1HH1      ARG  42  -7.499  -8.598  -7.955
  359   HH21  ARG  42          2HH2      ARG  42  -5.296 -11.331  -7.759
  360   HH22  ARG  42          1HH2      ARG  42  -6.830 -10.755  -8.372
  361    H    LYS  43           HN       LYS  43  -2.115  -9.263  -1.336
  362    HA   LYS  43           HA       LYS  43  -3.539 -11.329   0.174
  363    HB2  LYS  43           2HB      LYS  43  -2.571 -12.326  -2.034
  364    HB3  LYS  43           3HB      LYS  43  -0.993 -12.143  -1.230
  365    HG2  LYS  43           2HG      LYS  43  -3.297 -13.707  -0.052
  366    HG3  LYS  43           3HG      LYS  43  -2.040 -14.427  -1.087
  367    HD2  LYS  43           2HD      LYS  43  -0.331 -13.575   0.550
  368    HD3  LYS  43           3HD      LYS  43  -1.678 -13.108   1.616
  369    HE2  LYS  43           2HE      LYS  43  -0.861 -15.261   2.318
  370    HE3  LYS  43           3HE      LYS  43  -2.458 -15.481   1.570
  371    HZ1  LYS  43           3HZ      LYS  43   0.132 -15.961   0.254
  372    HZ2  LYS  43           1HZ      LYS  43  -0.890 -17.125   0.819
  373    HZ3  LYS  43           2HZ      LYS  43  -1.350 -16.167  -0.440
  374    H    VAL  44           HN       VAL  44  -2.832 -11.326   2.228
  375    HA   VAL  44           HA       VAL  44  -0.257  -9.952   2.777
  376    HB   VAL  44           HB       VAL  44  -2.464 -10.714   4.727
  377   HG11  VAL  44          1HG1      VAL  44  -1.305  -9.188   6.269
  378   HG12  VAL  44          2HG1      VAL  44  -0.246 -10.519   5.751
  379   HG13  VAL  44          3HG1      VAL  44  -0.053  -8.900   5.039
  380   HG21  VAL  44          3HG2      VAL  44  -3.265  -9.054   3.114
  381   HG22  VAL  44          1HG2      VAL  44  -3.071  -8.331   4.726
  382   HG23  VAL  44          2HG2      VAL  44  -1.857  -8.024   3.464
  383    H    ALA  45           HN       ALA  45   1.428 -11.292   2.892
  384    HA   ALA  45           HA       ALA  45   1.250 -14.093   3.102
  385    HB1  ALA  45           1HB      ALA  45   3.679 -14.026   3.487
  386    HB2  ALA  45           2HB      ALA  45   3.196 -12.903   2.196
  387    HB3  ALA  45           3HB      ALA  45   3.578 -12.281   3.819
  388    HA   PRO  46           HA       PRO  46   0.388 -15.130   7.255
  389    HB2  PRO  46           2HB      PRO  46   2.630 -17.144   7.039
  390    HB3  PRO  46           3HB      PRO  46   0.901 -17.362   7.459
  391    HG2  PRO  46           2HG      PRO  46   1.862 -18.066   5.086
  392    HG3  PRO  46           3HG      PRO  46   0.196 -17.431   5.283
  393    HD2  PRO  46           2HD      PRO  46   2.675 -16.135   4.178
  394    HD3  PRO  46           3HD      PRO  46   0.958 -15.884   3.740
  395    H    LEU  47           HN       LEU  47   3.853 -14.862   6.421
  396    HA   LEU  47           HA       LEU  47   4.673 -14.473   9.175
  397    HB2  LEU  47           2HB      LEU  47   6.090 -15.423   7.356
  398    HB3  LEU  47           3HB      LEU  47   6.109 -13.819   6.586
  399    HG   LEU  47           HG       LEU  47   8.149 -14.594   7.949
  400   HD11  LEU  47          1HD1      LEU  47   8.626 -12.299   8.688
  401   HD12  LEU  47          2HD1      LEU  47   7.870 -12.326   7.079
  402   HD13  LEU  47          3HD1      LEU  47   6.905 -11.888   8.509
  403   HD21  LEU  47          3HD2      LEU  47   6.928 -15.363   9.925
  404   HD22  LEU  47          1HD2      LEU  47   8.073 -14.070  10.350
  405   HD23  LEU  47          2HD2      LEU  47   6.338 -13.707  10.212
  406    H    GLY  48           HN       GLY  48   3.465 -12.465   6.589
  407    HA2  GLY  48           1HA      GLY  48   2.706 -10.226   7.061
  408    HA3  GLY  48           2HA      GLY  48   3.997 -10.074   8.275
  409    H    ASP  49           HN       ASP  49   5.497 -11.675   5.936
  410    HA   ASP  49           HA       ASP  49   6.098  -9.313   4.246
  411    HB2  ASP  49           2HB      ASP  49   7.715  -9.357   6.155
  412    HB3  ASP  49           3HB      ASP  49   8.207 -10.991   5.658
  413    HD2  ASP  49           2HD      ASP  49  10.064  -9.744   2.975
  414    HA   PRO  50           HA       PRO  50   6.288  -8.810   2.694
  415    HB2  PRO  50           2HB      PRO  50   6.180  -8.607  -0.019
  416    HB3  PRO  50           3HB      PRO  50   7.709  -8.998   0.834
  417    HG2  PRO  50           2HG      PRO  50   5.923 -10.772  -0.710
  418    HG3  PRO  50           3HG      PRO  50   7.704 -10.846  -0.513
  419    HD2  PRO  50           2HD      PRO  50   5.677 -12.332   0.892
  420    HD3  PRO  50           3HD      PRO  50   7.437 -12.315   1.213
  421    H    ILE  51           HN       ILE  51   4.623  -7.407   1.456
  422    HA   ILE  51           HA       ILE  51   2.003  -8.780   1.600
  423    HB   ILE  51           HB       ILE  51   2.675  -5.808   1.531
  424   HG12  ILE  51          2HG1      ILE  51   1.528  -5.976   3.855
  425   HG13  ILE  51          3HG1      ILE  51   1.912  -7.710   3.741
  426   HG21  ILE  51          1HG2      ILE  51   0.279  -5.446   1.972
  427   HG22  ILE  51          2HG2      ILE  51   0.534  -6.294   0.429
  428   HG23  ILE  51          3HG2      ILE  51  -0.003  -7.199   1.865
  429   HD11  ILE  51          3HD1      ILE  51   3.906  -5.435   3.624
  430   HD12  ILE  51          1HD1      ILE  51   3.630  -6.499   5.018
  431   HD13  ILE  51          2HD1      ILE  51   4.289  -7.169   3.511
  432    H    GLN  52           HN       GLN  52   0.897  -9.250  -0.200
  433    HA   GLN  52           HA       GLN  52   2.009  -8.400  -2.783
  434    HB2  GLN  52           2HB      GLN  52  -0.237 -10.282  -2.009
  435    HB3  GLN  52           3HB      GLN  52   0.166  -9.873  -3.693
  436    HG2  GLN  52           2HG      GLN  52   1.149 -11.982  -3.192
  437    HG3  GLN  52           3HG      GLN  52   2.454 -10.781  -3.298
  438   HE21  GLN  52          1HE2      GLN  52   3.671 -10.271  -1.482
  439   HE22  GLN  52          2HE2      GLN  52   3.580 -11.203  -0.002
  440    H    ILE  53           HN       ILE  53   1.310  -6.658  -3.836
  441    HA   ILE  53           HA       ILE  53  -1.461  -5.726  -3.307
  442    HB   ILE  53           HB       ILE  53  -0.624  -3.368  -3.386
  443   HG12  ILE  53          2HG1      ILE  53   2.112  -4.646  -3.091
  444   HG13  ILE  53          3HG1      ILE  53   1.492  -3.898  -4.582
  445   HG21  ILE  53          1HG2      ILE  53   0.257  -3.323  -1.088
  446   HG22  ILE  53          2HG2      ILE  53  -1.104  -4.458  -1.240
  447   HG23  ILE  53          3HG2      ILE  53   0.564  -5.074  -1.172
  448   HD11  ILE  53          3HD1      ILE  53   1.943  -2.490  -1.941
  449   HD12  ILE  53          1HD1      ILE  53   2.985  -2.367  -3.373
  450   HD13  ILE  53          2HD1      ILE  53   1.324  -1.744  -3.434
  451    H    ASN  54           HN       ASN  54  -2.416  -4.498  -5.009
  452    HA   ASN  54           HA       ASN  54  -1.066  -4.926  -7.630
  453    HB2  ASN  54           2HB      ASN  54  -3.300  -5.988  -7.299
  454    HB3  ASN  54           3HB      ASN  54  -3.994  -4.373  -7.039
  455   HD21  ASN  54          1HD2      ASN  54  -4.556  -6.452  -9.089
  456   HD22  ASN  54          2HD2      ASN  54  -4.336  -5.656 -10.632
  457    H    VAL  55           HN       VAL  55   0.019  -3.193  -8.250
  458    HA   VAL  55           HA       VAL  55  -1.347  -0.562  -8.002
  459    HB   VAL  55           HB       VAL  55   1.633  -1.114  -7.706
  460   HG11  VAL  55          1HG1      VAL  55   1.864   1.308  -7.328
  461   HG12  VAL  55          2HG1      VAL  55   1.218   0.961  -8.948
  462   HG13  VAL  55          3HG1      VAL  55   0.130   1.522  -7.656
  463   HG21  VAL  55          3HG2      VAL  55   0.340  -1.652  -5.696
  464   HG22  VAL  55          1HG2      VAL  55   1.353  -0.213  -5.436
  465   HG23  VAL  55          2HG2      VAL  55  -0.392  -0.031  -5.726
  466    H    ARG  56           HN       ARG  56  -1.731   0.350  -9.910
  467    HA   ARG  56           HA       ARG  56  -1.524   0.976 -12.098
  468    HB2  ARG  56           2HB      ARG  56   1.320  -0.055 -11.818
  469    HB3  ARG  56           3HB      ARG  56   0.701   0.931 -13.165
  470    HG2  ARG  56           2HG      ARG  56   0.683   1.844 -10.280
  471    HG3  ARG  56           3HG      ARG  56   2.018   2.175 -11.410
  472    HD2  ARG  56           2HD      ARG  56  -0.869   2.962 -11.894
  473    HD3  ARG  56           3HD      ARG  56   0.359   4.038 -11.191
  474    HE   ARG  56           HE       ARG  56   1.319   2.952 -13.642
  475   HH11  ARG  56          2HH1      ARG  56  -1.060   5.232 -12.403
  476   HH12  ARG  56          1HH1      ARG  56  -1.017   6.243 -13.830
  477   HH21  ARG  56          2HH2      ARG  56   1.381   4.274 -15.488
  478   HH22  ARG  56          1HH2      ARG  56   0.370   5.698 -15.582
  479    H    GLY  57           HN       GLY  57  -2.109  -1.918 -11.175
  480    HA2  GLY  57           1HA      GLY  57  -3.083  -3.588 -12.525
  481    HA3  GLY  57           2HA      GLY  57  -2.156  -2.993 -13.922
  482    H    TYR  58           HN       TYR  58   0.068  -3.008 -11.579
  483    HA   TYR  58           HA       TYR  58   1.029  -5.677 -12.408
  484    HB2  TYR  58           2HB      TYR  58   2.423  -3.336 -11.065
  485    HB3  TYR  58           3HB      TYR  58   3.198  -4.882 -11.451
  486    HD1  TYR  58           1HD      TYR  58   3.220  -5.597 -13.927
  487    HD2  TYR  58           2HD      TYR  58   2.388  -1.611 -12.669
  488    HE1  TYR  58           1HE      TYR  58   3.766  -4.775 -16.172
  489    HE2  TYR  58           2HE      TYR  58   2.934  -0.786 -14.917
  490    HH   TYR  58           HH       TYR  58   3.616  -1.324 -17.022
  491    H    GLU  59           HN       GLU  59   1.048  -7.356 -11.064
  492    HA   GLU  59           HA       GLU  59   0.284  -7.087  -8.279
  493    HB2  GLU  59           2HB      GLU  59   1.556  -9.410  -9.759
  494    HB3  GLU  59           3HB      GLU  59   0.788  -9.476  -8.156
  495    HG2  GLU  59           2HG      GLU  59  -0.697  -8.654 -10.652
  496    HG3  GLU  59           3HG      GLU  59  -0.567 -10.343 -10.116
  497    HE2  GLU  59           2HE      GLU  59  -3.290  -8.130  -8.486
  498    H    LEU  60           HN       LEU  60   1.629  -6.203  -6.841
  499    HA   LEU  60           HA       LEU  60   4.553  -6.621  -7.229
  500    HB2  LEU  60           2HB      LEU  60   3.114  -4.316  -5.878
  501    HB3  LEU  60           3HB      LEU  60   4.874  -4.489  -6.071
  502    HG   LEU  60           HG       LEU  60   2.857  -4.133  -8.300
  503   HD11  LEU  60          1HD1      LEU  60   3.906  -1.924  -8.579
  504   HD12  LEU  60          2HD1      LEU  60   3.188  -2.104  -6.961
  505   HD13  LEU  60          3HD1      LEU  60   4.950  -2.244  -7.174
  506   HD21  LEU  60          3HD2      LEU  60   4.769  -5.513  -8.979
  507   HD22  LEU  60          1HD2      LEU  60   4.827  -3.915  -9.758
  508   HD23  LEU  60          2HD2      LEU  60   5.888  -4.267  -8.374
  509    H    SER  61           HN       SER  61   5.848  -6.625  -5.264
  510    HA   SER  61           HA       SER  61   4.323  -7.534  -2.878
  511    HB2  SER  61           2HB      SER  61   6.351  -9.047  -2.466
  512    HB3  SER  61           3HB      SER  61   5.228  -9.534  -3.758
  513    HG   SER  61           HG       SER  61   7.433  -9.655  -4.402
  514    H    LEU  62           HN       LEU  62   4.584  -6.085  -1.320
  515    HA   LEU  62           HA       LEU  62   7.163  -4.607  -1.212
  516    HB2  LEU  62           2HB      LEU  62   4.344  -3.923  -0.612
  517    HB3  LEU  62           3HB      LEU  62   5.552  -3.303   0.539
  518    HG   LEU  62           HG       LEU  62   4.978  -1.670  -1.204
  519   HD11  LEU  62          1HD1      LEU  62   7.279  -1.090  -1.857
  520   HD12  LEU  62          2HD1      LEU  62   7.196  -1.622  -0.162
  521   HD13  LEU  62          3HD1      LEU  62   7.814  -2.727  -1.413
  522   HD21  LEU  62          3HD2      LEU  62   4.481  -3.225  -3.033
  523   HD22  LEU  62          1HD2      LEU  62   5.693  -2.023  -3.532
  524   HD23  LEU  62          2HD2      LEU  62   6.200  -3.677  -3.121
  525    H    ARG  63           HN       ARG  63   8.435  -4.665   0.573
  526    HA   ARG  63           HA       ARG  63   8.095  -6.914   2.315
  527    HB2  ARG  63           2HB      ARG  63  10.073  -4.726   1.955
  528    HB3  ARG  63           3HB      ARG  63  10.015  -5.498   3.557
  529    HG2  ARG  63           2HG      ARG  63  11.677  -6.587   2.183
  530    HG3  ARG  63           3HG      ARG  63  10.320  -7.700   2.481
  531    HD2  ARG  63           2HD      ARG  63   9.398  -6.945   0.227
  532    HD3  ARG  63           3HD      ARG  63  10.979  -6.181  -0.050
  533    HE   ARG  63           HE       ARG  63  10.608  -9.099   0.455
  534   HH11  ARG  63          2HH1      ARG  63  12.241  -6.415  -1.136
  535   HH12  ARG  63          1HH1      ARG  63  13.285  -7.452  -2.082
  536   HH21  ARG  63          2HH2      ARG  63  11.955 -10.438  -0.787
  537   HH22  ARG  63          1HH2      ARG  63  13.122  -9.734  -1.885
  538    H    LYS  64           HN       LYS  64   8.021  -6.882   4.626
  539    HA   LYS  64           HA       LYS  64   5.723  -5.570   5.576
  540    HB2  LYS  64           2HB      LYS  64   6.743  -7.664   6.480
  541    HB3  LYS  64           3HB      LYS  64   8.030  -6.674   7.209
  542    HG2  LYS  64           2HG      LYS  64   6.281  -5.470   8.516
  543    HG3  LYS  64           3HG      LYS  64   5.077  -6.610   7.870
  544    HD2  LYS  64           2HD      LYS  64   6.364  -8.487   8.838
  545    HD3  LYS  64           3HD      LYS  64   7.520  -7.321   9.524
  546    HE2  LYS  64           2HE      LYS  64   5.562  -6.263  10.731
  547    HE3  LYS  64           3HE      LYS  64   4.587  -7.653  10.206
  548    HZ1  LYS  64           3HZ      LYS  64   7.027  -7.794  11.850
  549    HZ2  LYS  64           1HZ      LYS  64   5.486  -7.976  12.403
  550    HZ3  LYS  64           2HZ      LYS  64   6.123  -9.084  11.362
  551    H    SER  65           HN       SER  65   9.176  -4.832   6.087
  552    HA   SER  65           HA       SER  65   8.773  -2.694   7.918
  553    HB2  SER  65           2HB      SER  65  11.096  -3.060   5.994
  554    HB3  SER  65           3HB      SER  65  11.104  -2.207   7.557
  555    HG   SER  65           HG       SER  65  11.971  -4.335   7.700
  556    H    ALA  66           HN       ALA  66   8.844  -2.818   4.363
  557    HA   ALA  66           HA       ALA  66   8.853   0.070   4.100
  558    HB1  ALA  66           1HB      ALA  66   8.400  -0.363   1.719
  559    HB2  ALA  66           2HB      ALA  66   9.733  -1.374   2.323
  560    HB3  ALA  66           3HB      ALA  66   8.116  -2.080   2.088
  561    H    ALA  67           HN       ALA  67   6.376  -2.498   4.045
  562    HA   ALA  67           HA       ALA  67   4.262  -0.775   3.172
  563    HB1  ALA  67           1HB      ALA  67   2.776  -2.640   3.786
  564    HB2  ALA  67           2HB      ALA  67   4.195  -3.210   2.878
  565    HB3  ALA  67           3HB      ALA  67   4.121  -3.426   4.644
  566    H    GLU  68           HN       GLU  68   5.699  -1.354   6.307
  567    HA   GLU  68           HA       GLU  68   3.380  -0.252   7.721
  568    HB2  GLU  68           2HB      GLU  68   4.833  -0.414   9.726
  569    HB3  GLU  68           3HB      GLU  68   4.639  -1.955   8.857
  570    HG2  GLU  68           2HG      GLU  68   6.842  -1.637   7.821
  571    HG3  GLU  68           3HG      GLU  68   7.035  -0.110   8.710
  572    HE2  GLU  68           2HE      GLU  68   7.101  -3.394  10.968
  573    H    MET  69           HN       MET  69   5.899   1.005   5.896
  574    HA   MET  69           HA       MET  69   5.897   3.554   7.424
  575    HB2  MET  69           2HB      MET  69   7.654   2.609   5.133
  576    HB3  MET  69           3HB      MET  69   7.771   4.195   5.933
  577    HG2  MET  69           2HG      MET  69   8.271   3.060   8.064
  578    HG3  MET  69           3HG      MET  69   8.201   1.495   7.237
  579    HE1  MET  69           3HE      MET  69  10.178   4.820   7.780
  580    HE2  MET  69           1HE      MET  69  11.443   4.733   6.532
  581    HE3  MET  69           2HE      MET  69   9.743   4.959   6.058
  582    H    ILE  70           HN       ILE  70   4.129   2.042   5.120
  583    HA   ILE  70           HA       ILE  70   3.708   4.492   3.510
  584    HB   ILE  70           HB       ILE  70   2.588   1.687   3.121
  585   HG12  ILE  70          2HG1      ILE  70   4.773   3.159   1.613
  586   HG13  ILE  70          3HG1      ILE  70   5.040   1.859   2.801
  587   HG21  ILE  70          1HG2      ILE  70   1.891   2.520   0.911
  588   HG22  ILE  70          2HG2      ILE  70   1.127   3.448   2.222
  589   HG23  ILE  70          3HG2      ILE  70   2.502   4.138   1.327
  590   HD11  ILE  70          3HD1      ILE  70   3.543   1.594   0.180
  591   HD12  ILE  70          1HD1      ILE  70   5.189   1.006   0.497
  592   HD13  ILE  70          2HD1      ILE  70   3.813   0.296   1.367
  593    H    GLU  71           HN       GLU  71   2.269   5.863   4.245
  594    HA   GLU  71           HA       GLU  71   0.082   4.947   6.000
  595    HB2  GLU  71           2HB      GLU  71   1.369   6.889   6.684
  596    HB3  GLU  71           3HB      GLU  71   1.050   7.687   5.125
  597    HG2  GLU  71           2HG      GLU  71  -0.948   8.441   5.785
  598    HG3  GLU  71           3HG      GLU  71  -1.375   6.910   6.581
  599    HE2  GLU  71           2HE      GLU  71  -0.966   8.655   9.521
  600    H    VAL  72           HN       VAL  72  -1.877   4.503   5.221
  601    HA   VAL  72           HA       VAL  72  -2.624   5.724   2.623
  602    HB   VAL  72           HB       VAL  72  -3.670   3.550   1.962
  603   HG11  VAL  72          1HG1      VAL  72  -1.583   2.439   1.292
  604   HG12  VAL  72          2HG1      VAL  72  -1.481   4.202   1.080
  605   HG13  VAL  72          3HG1      VAL  72  -0.683   3.426   2.468
  606   HG21  VAL  72          3HG2      VAL  72  -3.890   2.569   4.197
  607   HG22  VAL  72          1HG2      VAL  72  -2.987   1.485   3.113
  608   HG23  VAL  72          2HG2      VAL  72  -2.119   2.452   4.328
  609    H    GLU  73           HN       GLU  73  -4.885   5.696   2.136
  610    HA   GLU  73           HA       GLU  73  -6.600   5.743   4.562
  611    HB2  GLU  73           2HB      GLU  73  -7.044   6.761   1.737
  612    HB3  GLU  73           3HB      GLU  73  -8.268   6.801   3.028
  613    HG2  GLU  73           2HG      GLU  73  -6.679   8.229   4.350
  614    HG3  GLU  73           3HG      GLU  73  -5.666   8.325   2.893
  615    HE2  GLU  73           2HE      GLU  73  -7.953  10.439   1.303
  616    H    LEU  74           HN       LEU  74  -8.122   4.168   4.874
  617    HA   LEU  74           HA       LEU  74  -8.346   2.024   2.918
  618    HB2  LEU  74           2HB      LEU  74  -8.613   2.028   5.554
  619    HB3  LEU  74           3HB      LEU  74 -10.303   2.420   5.155
  620    HG   LEU  74           HG       LEU  74 -10.006   0.037   5.567
  621   HD11  LEU  74          1HD1      LEU  74 -11.031  -0.843   3.515
  622   HD12  LEU  74          2HD1      LEU  74 -11.720   0.733   3.968
  623   HD13  LEU  74          3HD1      LEU  74 -10.536   0.625   2.642
  624   HD21  LEU  74          3HD2      LEU  74  -7.657  -0.157   4.898
  625   HD22  LEU  74          1HD2      LEU  74  -8.661  -1.359   4.055
  626   HD23  LEU  74          2HD2      LEU  74  -8.115   0.100   3.197
  627    H    GLU  75           HN       GLU  75  -9.331   2.508   1.028
  628    HA   GLU  75           HA       GLU  75 -11.344   4.592   0.878
  629    HB2  GLU  75           2HB      GLU  75 -10.159   2.675  -1.140
  630    HB3  GLU  75           3HB      GLU  75 -11.455   3.826  -1.549
  631    HG2  GLU  75           2HG      GLU  75  -8.745   4.584  -0.427
  632    HG3  GLU  75           3HG      GLU  75  -9.187   4.628  -2.148
  633    HE2  GLU  75           2HE      GLU  75 -10.375   7.568   0.191
  634    H    HIS  76           HN       HIS  76 -12.343   2.858   2.647
  635    HA   HIS  76           HA       HIS  76 -14.241   1.068   1.342
  636    HB2  HIS  76           2HB      HIS  76 -13.425   0.456   3.531
  637    HB3  HIS  76           3HB      HIS  76 -13.899   2.027   4.202
  638    HD1  HIS  76           1HD      HIS  76 -15.435  -1.190   2.875
  639    HD2  HIS  76           2HD      HIS  76 -16.473   2.167   5.130
  640    HE1  HIS  76           1HE      HIS  76 -17.748  -1.648   3.802
  641    HE2  HIS  76           2HE      HIS  76 -18.374   0.392   5.179
  642    H    HIS  77           HN       HIS  77 -16.085   1.710   0.451
  643    HA   HIS  77           HA       HIS  77 -16.883   4.458   0.560
  644    HB2  HIS  77           2HB      HIS  77 -17.313   2.998  -1.379
  645    HB3  HIS  77           3HB      HIS  77 -18.428   2.028  -0.397
  646    HD1  HIS  77           1HD      HIS  77 -20.788   2.602  -0.800
  647    HD2  HIS  77           2HD      HIS  77 -18.278   5.901  -1.301
  648    HE1  HIS  77           1HE      HIS  77 -22.284   4.532  -1.470
  649    HE2  HIS  77           2HE      HIS  77 -20.756   6.535  -1.777
  650    H    HIS  78           HN       HIS  78 -17.798   5.434   2.198
  651    HA   HIS  78           HA       HIS  78 -19.924   3.996   3.686
  652    HB2  HIS  78           2HB      HIS  78 -17.857   3.883   5.030
  653    HB3  HIS  78           3HB      HIS  78 -17.709   5.647   4.947
  654    HD1  HIS  78           1HD      HIS  78 -19.864   2.924   6.469
  655    HD2  HIS  78           2HD      HIS  78 -19.220   7.038   6.803
  656    HE1  HIS  78           1HE      HIS  78 -21.137   3.676   8.530
  657    HE2  HIS  78           2HE      HIS  78 -20.739   6.175   8.727
  658    H    HIS  79           HN       HIS  79 -21.415   5.153   2.449
  659    HA   HIS  79           HA       HIS  79 -21.304   8.104   2.656
  660    HB2  HIS  79           2HB      HIS  79 -21.690   7.056   0.439
  661    HB3  HIS  79           3HB      HIS  79 -23.161   6.294   1.071
  662    HD1  HIS  79           1HD      HIS  79 -25.278   7.593   0.833
  663    HD2  HIS  79           2HD      HIS  79 -21.885  10.007   0.463
  664    HE1  HIS  79           1HE      HIS  79 -26.114   9.898   0.181
  665    HE2  HIS  79           2HE      HIS  79 -24.049  11.356  -0.035
  666    H    HIS  80           HN       HIS  80 -22.387   9.105   4.204
  667    HA   HIS  80           HA       HIS  80 -25.020   8.036   5.008
  668    HB2  HIS  80           2HB      HIS  80 -23.223   7.148   6.583
  669    HB3  HIS  80           3HB      HIS  80 -22.947   8.829   7.076
  670    HD1  HIS  80           1HD      HIS  80 -24.716   5.942   8.129
  671    HD2  HIS  80           2HD      HIS  80 -25.663  10.005   7.933
  672    HE1  HIS  80           1HE      HIS  80 -26.662   6.291   9.712
  673    HE2  HIS  80           2HE      HIS  80 -27.229   8.763   9.593
  674    H    HIS  81           HN       HIS  81 -22.600  10.561   5.827
  675    HA   HIS  81           HA       HIS  81 -24.592  12.623   5.113
  676    HB2  HIS  81           2HB      HIS  81 -24.751  12.048   7.597
  677    HB3  HIS  81           3HB      HIS  81 -23.105  12.690   7.753
  678    HD1  HIS  81           1HD      HIS  81 -26.667  13.709   7.235
  679    HD2  HIS  81           2HD      HIS  81 -22.908  15.503   7.572
  680    HE1  HIS  81           1HE      HIS  81 -27.094  16.186   7.584
  681    HE2  HIS  81           2HE      HIS  81 -24.805  17.265   7.785
  Start of MODEL    5
    1    H1   MET   1           HN       MET   1  -0.410   6.423  13.632
    2    HA   MET   1           HA       MET   1  -1.003   7.833  11.243
    3    HB2  MET   1           2HB      MET   1   0.926   7.327   9.841
    4    HB3  MET   1           3HB      MET   1   1.384   8.378  11.203
    5    HG2  MET   1           2HG      MET   1   3.147   6.893  11.101
    6    HG3  MET   1           3HG      MET   1   2.119   6.178  12.354
    7    HE1  MET   1           3HE      MET   1   3.278   5.986   8.592
    8    HE2  MET   1           1HE      MET   1   2.310   4.625   7.981
    9    HE3  MET   1           2HE      MET   1   1.511   6.143   8.443
   10    H    PHE   2           HN       PHE   2  -1.334   6.367   9.384
   11    HA   PHE   2           HA       PHE   2  -1.959   3.635  10.402
   12    HB2  PHE   2           2HB      PHE   2  -3.868   5.177   9.725
   13    HB3  PHE   2           3HB      PHE   2  -3.253   5.075   8.067
   14    HD1  PHE   2           1HD      PHE   2  -3.411   2.975   6.810
   15    HD2  PHE   2           2HD      PHE   2  -4.984   3.309  10.753
   16    HE1  PHE   2           1HE      PHE   2  -4.682   0.903   6.473
   17    HE2  PHE   2           2HE      PHE   2  -6.262   1.238  10.420
   18    HZ   PHE   2           HZ       PHE   2  -6.125   0.037   8.272
   19    H    SER   3           HN       SER   3  -0.526   2.187   9.707
   20    HA   SER   3           HA       SER   3   1.030   2.746   7.289
   21    HB2  SER   3           2HB      SER   3   1.153   0.286   9.061
   22    HB3  SER   3           3HB      SER   3   2.415   0.929   7.982
   23    HG   SER   3           HG       SER   3   2.783   1.452  10.191
   24    H    LEU   4           HN       LEU   4   1.279   1.242   5.564
   25    HA   LEU   4           HA       LEU   4  -1.177   0.338   4.479
   26    HB2  LEU   4           2HB      LEU   4   0.765   0.999   3.143
   27    HB3  LEU   4           3HB      LEU   4   1.680  -0.396   3.765
   28    HG   LEU   4           HG       LEU   4   0.118  -1.917   2.644
   29   HD11  LEU   4          1HD1      LEU   4  -1.525  -1.047   1.031
   30   HD12  LEU   4          2HD1      LEU   4  -1.881  -0.497   2.684
   31   HD13  LEU   4          3HD1      LEU   4  -1.121   0.615   1.520
   32   HD21  LEU   4          3HD2      LEU   4   2.156  -1.177   1.493
   33   HD22  LEU   4          1HD2      LEU   4   0.831  -1.443   0.336
   34   HD23  LEU   4          2HD2      LEU   4   1.273   0.212   0.815
   35    H    ARG   5           HN       ARG   5   1.217  -1.257   6.493
   36    HA   ARG   5           HA       ARG   5   0.474  -3.940   5.817
   37    HB2  ARG   5           2HB      ARG   5   1.674  -4.493   7.985
   38    HB3  ARG   5           3HB      ARG   5   2.619  -3.638   6.741
   39    HG2  ARG   5           2HG      ARG   5   3.213  -2.644   8.784
   40    HG3  ARG   5           3HG      ARG   5   2.093  -1.501   8.005
   41    HD2  ARG   5           2HD      ARG   5   0.263  -2.318   9.427
   42    HD3  ARG   5           3HD      ARG   5   1.369  -3.476  10.196
   43    HE   ARG   5           HE       ARG   5   2.670  -1.175  10.644
   44   HH11  ARG   5          2HH1      ARG   5  -0.708  -2.065  11.142
   45   HH12  ARG   5          1HH1      ARG   5  -0.951  -0.895  12.419
   46   HH21  ARG   5          2HH2      ARG   5   2.331   0.366  12.261
   47   HH22  ARG   5          1HH2      ARG   5   0.774   0.484  13.052
   48    H    ASP   6           HN       ASP   6  -1.334  -1.617   7.430
   49    HA   ASP   6           HA       ASP   6  -2.440  -3.516   9.393
   50    HB2  ASP   6           2HB      ASP   6  -1.983  -1.001   9.795
   51    HB3  ASP   6           3HB      ASP   6  -3.476  -0.734   8.870
   52    HD2  ASP   6           2HD      ASP   6  -3.739  -2.306  12.507
   53    H    ALA   7           HN       ALA   7  -2.950  -2.610   6.167
   54    HA   ALA   7           HA       ALA   7  -5.829  -3.220   6.233
   55    HB1  ALA   7           1HB      ALA   7  -5.758  -2.705   3.829
   56    HB2  ALA   7           2HB      ALA   7  -5.034  -1.397   4.796
   57    HB3  ALA   7           3HB      ALA   7  -3.989  -2.539   3.918
   58    H    LYS   8           HN       LYS   8  -6.730  -4.885   4.800
   59    HA   LYS   8           HA       LYS   8  -4.878  -7.218   4.716
   60    HB2  LYS   8           2HB      LYS   8  -7.777  -6.992   5.500
   61    HB3  LYS   8           3HB      LYS   8  -7.123  -8.528   4.878
   62    HG2  LYS   8           2HG      LYS   8  -7.111  -8.590   7.278
   63    HG3  LYS   8           3HG      LYS   8  -5.432  -8.490   6.700
   64    HD2  LYS   8           2HD      LYS   8  -5.338  -6.132   7.233
   65    HD3  LYS   8           3HD      LYS   8  -7.064  -6.125   7.669
   66    HE2  LYS   8           2HE      LYS   8  -4.937  -7.777   9.071
   67    HE3  LYS   8           3HE      LYS   8  -5.519  -6.195   9.635
   68    HZ1  LYS   8           3HZ      LYS   8  -7.174  -8.607   9.292
   69    HZ2  LYS   8           1HZ      LYS   8  -6.648  -8.000  10.731
   70    HZ3  LYS   8           2HZ      LYS   8  -7.714  -7.139   9.816
   71    H    CYS   9           HN       CYS   9  -5.980  -9.023   3.280
   72    HA   CYS   9           HA       CYS   9  -5.670  -8.039   0.621
   73    HB2  CYS   9           2HB      CYS   9  -6.502 -10.456   0.111
   74    HB3  CYS   9           3HB      CYS   9  -4.937 -10.208   0.926
   75    HG   CYS   9           HG       CYS   9  -6.116 -12.334   1.894
   76    H    GLY  10           HN       GLY  10  -7.049  -7.645  -1.009
   77    HA2  GLY  10           1HA      GLY  10  -9.052  -7.583  -2.169
   78    HA3  GLY  10           2HA      GLY  10  -9.867  -8.363  -0.794
   79    H    GLN  11           HN       GLN  11  -8.020  -5.743   0.266
   80    HA   GLN  11           HA       GLN  11 -10.438  -4.004   0.204
   81    HB2  GLN  11           2HB      GLN  11  -8.118  -4.141   2.148
   82    HB3  GLN  11           3HB      GLN  11  -9.318  -2.827   2.134
   83    HG2  GLN  11           2HG      GLN  11 -11.102  -4.504   2.508
   84    HG3  GLN  11           3HG      GLN  11  -9.856  -5.767   2.617
   85   HE21  GLN  11          1HE2      GLN  11  -8.506  -5.873   4.438
   86   HE22  GLN  11          2HE2      GLN  11  -8.869  -4.995   5.910
   87    H    THR  12           HN       THR  12 -10.244  -1.836  -0.346
   88    HA   THR  12           HA       THR  12  -7.824  -1.256  -1.959
   89    HB   THR  12           HB       THR  12 -10.506   0.183  -1.984
   90    HG1  THR  12           1HG      THR  12 -10.885  -1.102  -3.871
   91   HG21  THR  12          3HG2      THR  12  -8.212   0.104  -3.978
   92   HG22  THR  12          1HG2      THR  12  -9.742   0.987  -4.189
   93   HG23  THR  12          2HG2      THR  12  -8.614   1.463  -2.900
   94    H    VAL  13           HN       VAL  13  -6.362   0.107  -1.165
   95    HA   VAL  13           HA       VAL  13  -7.302   2.146   0.793
   96    HB   VAL  13           HB       VAL  13  -5.037   2.105   1.776
   97   HG11  VAL  13          1HG1      VAL  13  -5.206  -0.063   2.921
   98   HG12  VAL  13          2HG1      VAL  13  -6.797   0.712   2.753
   99   HG13  VAL  13          3HG1      VAL  13  -6.342  -0.629   1.676
  100   HG21  VAL  13          3HG2      VAL  13  -3.788   1.364  -0.199
  101   HG22  VAL  13          1HG2      VAL  13  -3.447   0.317   1.199
  102   HG23  VAL  13          2HG2      VAL  13  -4.546  -0.242  -0.084
  103    H    LYS  14           HN       LYS  14  -6.370   4.238   0.660
  104    HA   LYS  14           HA       LYS  14  -5.019   4.739  -1.938
  105    HB2  LYS  14           2HB      LYS  14  -6.636   6.522  -0.121
  106    HB3  LYS  14           3HB      LYS  14  -5.599   7.159  -1.420
  107    HG2  LYS  14           2HG      LYS  14  -6.881   5.772  -3.038
  108    HG3  LYS  14           3HG      LYS  14  -7.979   5.322  -1.712
  109    HD2  LYS  14           2HD      LYS  14  -7.469   8.089  -2.832
  110    HD3  LYS  14           3HD      LYS  14  -8.973   7.141  -2.919
  111    HE2  LYS  14           2HE      LYS  14  -8.547   7.203  -0.224
  112    HE3  LYS  14           3HE      LYS  14  -7.865   8.770  -0.711
  113    HZ1  LYS  14           3HZ      LYS  14 -10.577   7.815  -1.336
  114    HZ2  LYS  14           1HZ      LYS  14 -10.195   8.937  -0.191
  115    HZ3  LYS  14           2HZ      LYS  14  -9.944   9.270  -1.786
  116    H    VAL  15           HN       VAL  15  -3.032   5.471  -2.025
  117    HA   VAL  15           HA       VAL  15  -1.525   5.752   0.454
  118    HB   VAL  15           HB       VAL  15  -0.658   6.207  -2.425
  119   HG11  VAL  15          1HG1      VAL  15   1.625   5.945  -1.551
  120   HG12  VAL  15          2HG1      VAL  15   0.793   7.326  -0.798
  121   HG13  VAL  15          3HG1      VAL  15   0.976   5.799   0.098
  122   HG21  VAL  15          3HG2      VAL  15  -1.458   3.924  -2.046
  123   HG22  VAL  15          1HG2      VAL  15   0.306   3.953  -2.279
  124   HG23  VAL  15          2HG2      VAL  15  -0.372   3.769  -0.644
  125    H    VAL  16           HN       VAL  16  -1.506   7.608   1.587
  126    HA   VAL  16           HA       VAL  16  -2.059  10.082   0.044
  127    HB   VAL  16           HB       VAL  16  -2.667  11.060   2.311
  128   HG11  VAL  16          1HG1      VAL  16  -4.910  10.050   2.303
  129   HG12  VAL  16          2HG1      VAL  16  -4.339  10.379   0.651
  130   HG13  VAL  16          3HG1      VAL  16  -4.306   8.718   1.291
  131   HG21  VAL  16          3HG2      VAL  16  -1.548   9.394   3.720
  132   HG22  VAL  16          1HG2      VAL  16  -3.284   9.480   4.093
  133   HG23  VAL  16          2HG2      VAL  16  -2.652   8.135   3.117
  134    H    LYS  17           HN       LYS  17   0.084   8.673   2.513
  135    HA   LYS  17           HA       LYS  17   1.961  10.892   1.916
  136    HB2  LYS  17           2HB      LYS  17   0.638  11.300   4.050
  137    HB3  LYS  17           3HB      LYS  17   1.456   9.869   4.722
  138    HG2  LYS  17           2HG      LYS  17   2.575  11.889   5.454
  139    HG3  LYS  17           3HG      LYS  17   3.635  10.969   4.360
  140    HD2  LYS  17           2HD      LYS  17   3.714  13.370   3.857
  141    HD3  LYS  17           3HD      LYS  17   3.016  12.452   2.501
  142    HE2  LYS  17           2HE      LYS  17   1.709  14.445   2.832
  143    HE3  LYS  17           3HE      LYS  17   0.744  13.041   3.338
  144    HZ1  LYS  17           3HZ      LYS  17   2.204  14.855   5.139
  145    HZ2  LYS  17           1HZ      LYS  17   0.574  14.847   4.902
  146    HZ3  LYS  17           2HZ      LYS  17   1.309  13.552   5.610
  147    H    LEU  18           HN       LEU  18   3.989  10.239   1.587
  148    HA   LEU  18           HA       LEU  18   4.636   7.436   2.337
  149    HB2  LEU  18           2HB      LEU  18   5.785   9.266   0.215
  150    HB3  LEU  18           3HB      LEU  18   6.467   7.679   0.647
  151    HG   LEU  18           HG       LEU  18   3.697   8.176  -0.481
  152   HD11  LEU  18          1HD1      LEU  18   4.582   7.077  -2.497
  153   HD12  LEU  18          2HD1      LEU  18   5.489   8.559  -2.115
  154   HD13  LEU  18          3HD1      LEU  18   6.185   6.967  -1.733
  155   HD21  LEU  18          3HD2      LEU  18   3.784   6.242   1.029
  156   HD22  LEU  18          1HD2      LEU  18   3.585   5.725  -0.662
  157   HD23  LEU  18          2HD2      LEU  18   5.175   5.594   0.125
  158    H    HIS  19           HN       HIS  19   5.866   7.216   4.066
  159    HA   HIS  19           HA       HIS  19   7.594   9.492   4.865
  160    HB2  HIS  19           2HB      HIS  19   6.884   6.982   6.423
  161    HB3  HIS  19           3HB      HIS  19   7.737   8.411   7.036
  162    HD1  HIS  19           1HD      HIS  19   6.334  10.433   7.744
  163    HD2  HIS  19           2HD      HIS  19   4.071   7.322   6.113
  164    HE1  HIS  19           1HE      HIS  19   3.913  10.972   8.260
  165    HE2  HIS  19           2HE      HIS  19   2.540   9.079   7.272
  166    H    GLY  20           HN       GLY  20   9.716   8.589   6.031
  167    HA2  GLY  20           1HA      GLY  20  11.322   6.696   5.876
  168    HA3  GLY  20           2HA      GLY  20  10.873   6.567   4.160
  169    H    THR  21           HN       THR  21  13.553   6.901   5.112
  170    HA   THR  21           HA       THR  21  14.146   9.749   4.839
  171    HB   THR  21           HB       THR  21  16.134   7.465   5.057
  172    HG1  THR  21           1HG      THR  21  16.017   7.900   7.326
  173   HG21  THR  21          3HG2      THR  21  16.283  10.402   5.826
  174   HG22  THR  21          1HG2      THR  21  17.576   9.204   6.053
  175   HG23  THR  21          2HG2      THR  21  17.062   9.653   4.412
  176    H    GLY  22           HN       GLY  22  13.270   9.895   2.635
  177    HA2  GLY  22           1HA      GLY  22  13.789  10.483   0.490
  178    HA3  GLY  22           2HA      GLY  22  15.498  10.177   0.881
  179    H    ALA  23           HN       ALA  23  16.178   7.838   0.858
  180    HA   ALA  23           HA       ALA  23  15.815   6.917  -1.782
  181    HB1  ALA  23           1HB      ALA  23  17.124   4.959  -1.063
  182    HB2  ALA  23           2HB      ALA  23  17.817   6.470  -0.430
  183    HB3  ALA  23           3HB      ALA  23  16.864   5.413   0.639
  184    H    LEU  24           HN       LEU  24  14.364   5.801   1.280
  185    HA   LEU  24           HA       LEU  24  13.050   3.515   0.275
  186    HB2  LEU  24           2HB      LEU  24  13.263   4.088   2.664
  187    HB3  LEU  24           3HB      LEU  24  12.124   5.436   2.431
  188    HG   LEU  24           HG       LEU  24  10.365   3.816   1.821
  189   HD11  LEU  24          1HD1      LEU  24  10.708   1.415   2.238
  190   HD12  LEU  24          2HD1      LEU  24  11.795   2.017   0.966
  191   HD13  LEU  24          3HD1      LEU  24  12.420   1.726   2.606
  192   HD21  LEU  24          3HD2      LEU  24  10.591   4.613   4.127
  193   HD22  LEU  24          1HD2      LEU  24  10.006   2.933   4.086
  194   HD23  LEU  24          2HD2      LEU  24  11.706   3.272   4.486
  195    H    LYS  25           HN       LYS  25  11.998   6.917   0.473
  196    HA   LYS  25           HA       LYS  25   9.394   6.602  -0.545
  197    HB2  LYS  25           2HB      LYS  25  11.362   8.900  -0.736
  198    HB3  LYS  25           3HB      LYS  25   9.655   9.013  -1.228
  199    HG2  LYS  25           2HG      LYS  25   8.954   8.483   1.055
  200    HG3  LYS  25           3HG      LYS  25  10.658   8.340   1.552
  201    HD2  LYS  25           2HD      LYS  25  11.029  10.698   0.976
  202    HD3  LYS  25           3HD      LYS  25   9.330  10.843   0.462
  203    HE2  LYS  25           2HE      LYS  25   8.576  10.339   2.724
  204    HE3  LYS  25           3HE      LYS  25  10.256  10.097   3.253
  205    HZ1  LYS  25           3HZ      LYS  25   9.121  12.620   2.253
  206    HZ2  LYS  25           1HZ      LYS  25   9.447  12.272   3.830
  207    HZ3  LYS  25           2HZ      LYS  25  10.680  12.395   2.744
  208    H    ARG  26           HN       ARG  26  12.487   7.189  -2.273
  209    HA   ARG  26           HA       ARG  26  11.334   7.485  -4.855
  210    HB2  ARG  26           2HB      ARG  26  13.730   7.998  -4.145
  211    HB3  ARG  26           3HB      ARG  26  14.043   6.250  -4.276
  212    HG2  ARG  26           2HG      ARG  26  13.206   6.407  -6.665
  213    HG3  ARG  26           3HG      ARG  26  13.252   8.176  -6.472
  214    HD2  ARG  26           2HD      ARG  26  15.657   8.037  -5.924
  215    HD3  ARG  26           3HD      ARG  26  15.601   6.278  -6.165
  216    HE   ARG  26           HE       ARG  26  14.952   8.203  -8.350
  217   HH11  ARG  26          2HH1      ARG  26  16.679   5.382  -7.131
  218   HH12  ARG  26          1HH1      ARG  26  17.384   4.990  -8.681
  219   HH21  ARG  26          2HH2      ARG  26  15.888   7.682 -10.364
  220   HH22  ARG  26          1HH2      ARG  26  16.939   6.290 -10.509
  221    H    ARG  27           HN       ARG  27  12.560   4.666  -3.079
  222    HA   ARG  27           HA       ARG  27  12.296   2.780  -5.187
  223    HB2  ARG  27           2HB      ARG  27  13.630   2.441  -3.153
  224    HB3  ARG  27           3HB      ARG  27  12.138   2.405  -2.182
  225    HG2  ARG  27           2HG      ARG  27  11.447   0.356  -3.160
  226    HG3  ARG  27           3HG      ARG  27  12.713   0.447  -4.408
  227    HD2  ARG  27           2HD      ARG  27  13.226   0.220  -1.428
  228    HD3  ARG  27           3HD      ARG  27  13.245  -1.144  -2.569
  229    HE   ARG  27           HE       ARG  27  14.998   0.745  -3.621
  230   HH11  ARG  27          2HH1      ARG  27  14.701  -1.130  -0.654
  231   HH12  ARG  27          1HH1      ARG  27  16.426  -1.189  -0.369
  232   HH21  ARG  27          2HH2      ARG  27  17.241   0.664  -3.246
  233   HH22  ARG  27          1HH2      ARG  27  17.867  -0.170  -1.841
  234    H    ILE  28           HN       ILE  28  10.066   3.875  -2.644
  235    HA   ILE  28           HA       ILE  28   7.980   2.026  -3.266
  236    HB   ILE  28           HB       ILE  28   7.901   4.762  -1.933
  237   HG12  ILE  28          2HG1      ILE  28   7.831   1.968  -0.749
  238   HG13  ILE  28          3HG1      ILE  28   9.269   3.015  -0.811
  239   HG21  ILE  28          1HG2      ILE  28   5.704   4.088  -1.059
  240   HG22  ILE  28          2HG2      ILE  28   5.701   4.162  -2.836
  241   HG23  ILE  28          3HG2      ILE  28   5.787   2.588  -2.010
  242   HD11  ILE  28          3HD1      ILE  28   6.690   3.622   0.658
  243   HD12  ILE  28          1HD1      ILE  28   8.208   3.089   1.409
  244   HD13  ILE  28          2HD1      ILE  28   8.129   4.666   0.597
  245    H    MET  29           HN       MET  29   8.556   5.436  -4.223
  246    HA   MET  29           HA       MET  29   6.182   5.641  -5.802
  247    HB2  MET  29           2HB      MET  29   8.771   7.216  -5.826
  248    HB3  MET  29           3HB      MET  29   7.343   7.637  -6.800
  249    HG2  MET  29           2HG      MET  29   6.022   7.852  -4.723
  250    HG3  MET  29           3HG      MET  29   7.479   7.500  -3.779
  251    HE1  MET  29           3HE      MET  29   9.738   9.035  -5.420
  252    HE2  MET  29           1HE      MET  29   9.758  10.602  -4.581
  253    HE3  MET  29           2HE      MET  29   9.592   9.098  -3.648
  254    H    ASP  30           HN       ASP  30   9.463   4.564  -6.481
  255    HA   ASP  30           HA       ASP  30   9.374   4.616  -9.311
  256    HB2  ASP  30           2HB      ASP  30  11.452   4.307  -8.127
  257    HB3  ASP  30           3HB      ASP  30  10.854   2.818  -7.362
  258    HD2  ASP  30           2HD      ASP  30  11.781   0.917 -10.068
  259    H    MET  31           HN       MET  31   8.184   2.232  -6.965
  260    HA   MET  31           HA       MET  31   7.701   0.198  -8.954
  261    HB2  MET  31           2HB      MET  31   6.686   0.572  -6.122
  262    HB3  MET  31           3HB      MET  31   6.348  -0.860  -7.124
  263    HG2  MET  31           2HG      MET  31   8.737  -1.352  -7.256
  264    HG3  MET  31           3HG      MET  31   9.107   0.099  -6.311
  265    HE1  MET  31           3HE      MET  31   6.735   0.076  -4.166
  266    HE2  MET  31           1HE      MET  31   7.516  -0.781  -2.819
  267    HE3  MET  31           2HE      MET  31   8.433   0.417  -3.759
  268    H    GLY  32           HN       GLY  32   5.961   3.004  -7.820
  269    HA2  GLY  32           1HA      GLY  32   4.233   3.604  -9.611
  270    HA3  GLY  32           2HA      GLY  32   3.531   2.015  -9.231
  271    H    ILE  33           HN       ILE  33   4.441   2.525  -6.340
  272    HA   ILE  33           HA       ILE  33   1.907   3.475  -5.414
  273    HB   ILE  33           HB       ILE  33   4.512   3.205  -3.862
  274   HG12  ILE  33          2HG1      ILE  33   2.295   1.178  -4.286
  275   HG13  ILE  33          3HG1      ILE  33   3.887   1.140  -5.080
  276   HG21  ILE  33          1HG2      ILE  33   3.032   2.929  -1.913
  277   HG22  ILE  33          2HG2      ILE  33   2.776   4.502  -2.703
  278   HG23  ILE  33          3HG2      ILE  33   1.612   3.179  -2.957
  279   HD11  ILE  33          3HD1      ILE  33   3.380   0.929  -2.102
  280   HD12  ILE  33          1HD1      ILE  33   3.804  -0.418  -3.179
  281   HD13  ILE  33          2HD1      ILE  33   4.971   0.891  -2.898
  282    H    THR  34           HN       THR  34   1.240   5.514  -5.534
  283    HA   THR  34           HA       THR  34   3.189   7.661  -4.914
  284    HB   THR  34           HB       THR  34   1.905   8.968  -6.797
  285    HG1  THR  34           1HG      THR  34   1.263   7.531  -8.491
  286   HG21  THR  34          3HG2      THR  34   3.922   6.800  -7.482
  287   HG22  THR  34          1HG2      THR  34   3.563   8.234  -8.471
  288   HG23  THR  34          2HG2      THR  34   4.304   8.426  -6.866
  289    H    ARG  35           HN       ARG  35   2.082   9.792  -4.545
  290    HA   ARG  35           HA       ARG  35   0.025   9.423  -2.585
  291    HB2  ARG  35           2HB      ARG  35   1.167  11.887  -3.927
  292    HB3  ARG  35           3HB      ARG  35  -0.028  11.942  -2.609
  293    HG2  ARG  35           2HG      ARG  35   1.485  11.057  -1.047
  294    HG3  ARG  35           3HG      ARG  35   2.594  10.480  -2.314
  295    HD2  ARG  35           2HD      ARG  35   1.989  13.400  -1.754
  296    HD3  ARG  35           3HD      ARG  35   3.393  12.521  -1.109
  297    HE   ARG  35           HE       ARG  35   3.219  12.270  -3.971
  298   HH11  ARG  35          2HH1      ARG  35   4.117  14.512  -1.409
  299   HH12  ARG  35          1HH1      ARG  35   5.297  15.353  -2.388
  300   HH21  ARG  35          2HH2      ARG  35   4.770  13.351  -5.234
  301   HH22  ARG  35          1HH2      ARG  35   5.668  14.694  -4.561
  302    H    GLY  36           HN       GLY  36  -2.012   8.954  -2.999
  303    HA2  GLY  36           1HA      GLY  36  -4.145   9.784  -3.704
  304    HA3  GLY  36           2HA      GLY  36  -3.368  10.504  -5.132
  305    H    CYS  37           HN       CYS  37  -1.943   7.533  -4.885
  306    HA   CYS  37           HA       CYS  37  -3.790   6.430  -6.883
  307    HB2  CYS  37           2HB      CYS  37  -2.168   4.752  -7.284
  308    HB3  CYS  37           3HB      CYS  37  -1.290   6.293  -7.109
  309    HG   CYS  37           HG       CYS  37   0.145   4.337  -6.141
  310    H    GLU  38           HN       GLU  38  -5.092   4.671  -6.620
  311    HA   GLU  38           HA       GLU  38  -5.411   3.755  -3.820
  312    HB2  GLU  38           2HB      GLU  38  -7.604   2.829  -4.735
  313    HB3  GLU  38           3HB      GLU  38  -7.451   4.597  -4.591
  314    HG2  GLU  38           2HG      GLU  38  -6.785   4.572  -7.055
  315    HG3  GLU  38           3HG      GLU  38  -7.376   2.897  -7.080
  316    HE2  GLU  38           2HE      GLU  38 -10.590   4.022  -7.444
  317    H    ILE  39           HN       ILE  39  -4.838   1.830  -3.225
  318    HA   ILE  39           HA       ILE  39  -4.097  -0.139  -5.332
  319    HB   ILE  39           HB       ILE  39  -2.755   0.314  -2.632
  320   HG12  ILE  39          2HG1      ILE  39  -1.723   1.001  -5.399
  321   HG13  ILE  39          3HG1      ILE  39  -2.365   2.174  -4.225
  322   HG21  ILE  39          1HG2      ILE  39  -1.055  -1.250  -3.479
  323   HG22  ILE  39          2HG2      ILE  39  -2.664  -2.007  -3.426
  324   HG23  ILE  39          3HG2      ILE  39  -1.990  -1.455  -4.978
  325   HD11  ILE  39          3HD1      ILE  39   0.067   0.413  -3.831
  326   HD12  ILE  39          1HD1      ILE  39   0.094   2.149  -4.206
  327   HD13  ILE  39          2HD1      ILE  39  -0.575   1.589  -2.658
  328    H    TYR  40           HN       TYR  40  -5.285  -1.974  -5.178
  329    HA   TYR  40           HA       TYR  40  -6.392  -2.629  -2.516
  330    HB2  TYR  40           2HB      TYR  40  -7.869  -4.127  -3.542
  331    HB3  TYR  40           3HB      TYR  40  -7.838  -2.709  -4.604
  332    HD1  TYR  40           1HD      TYR  40  -6.673  -2.836  -6.802
  333    HD2  TYR  40           2HD      TYR  40  -7.120  -6.268  -4.317
  334    HE1  TYR  40           1HE      TYR  40  -6.181  -4.288  -8.717
  335    HE2  TYR  40           2HE      TYR  40  -6.619  -7.723  -6.229
  336    HH   TYR  40           HH       TYR  40  -6.088  -7.836  -8.440
  337    H    ILE  41           HN       ILE  41  -5.596  -4.215  -1.275
  338    HA   ILE  41           HA       ILE  41  -3.045  -5.345  -2.108
  339    HB   ILE  41           HB       ILE  41  -4.604  -5.923   0.438
  340   HG12  ILE  41          2HG1      ILE  41  -2.572  -3.745  -0.153
  341   HG13  ILE  41          3HG1      ILE  41  -4.304  -3.510   0.177
  342   HG21  ILE  41          1HG2      ILE  41  -2.375  -6.458   1.342
  343   HG22  ILE  41          2HG2      ILE  41  -2.765  -7.479  -0.062
  344   HG23  ILE  41          3HG2      ILE  41  -1.648  -6.105  -0.243
  345   HD11  ILE  41          3HD1      ILE  41  -2.260  -4.621   2.115
  346   HD12  ILE  41          1HD1      ILE  41  -2.942  -2.981   2.156
  347   HD13  ILE  41          2HD1      ILE  41  -3.993  -4.384   2.444
  348    H    ARG  42           HN       ARG  42  -2.705  -7.285  -2.978
  349    HA   ARG  42           HA       ARG  42  -5.003  -8.909  -3.679
  350    HB2  ARG  42           2HB      ARG  42  -2.885  -8.446  -5.065
  351    HB3  ARG  42           3HB      ARG  42  -2.097  -9.661  -4.029
  352    HG2  ARG  42           2HG      ARG  42  -2.870 -10.605  -6.168
  353    HG3  ARG  42           3HG      ARG  42  -3.670 -11.359  -4.768
  354    HD2  ARG  42           2HD      ARG  42  -5.708 -10.348  -5.215
  355    HD3  ARG  42           3HD      ARG  42  -4.965  -9.009  -6.117
  356    HE   ARG  42           HE       ARG  42  -4.519 -10.684  -7.929
  357   HH11  ARG  42          2HH1      ARG  42  -6.949 -11.465  -5.505
  358   HH12  ARG  42          1HH1      ARG  42  -7.937 -12.390  -6.612
  359   HH21  ARG  42          2HH2      ARG  42  -5.864 -11.809  -9.390
  360   HH22  ARG  42          1HH2      ARG  42  -7.322 -12.585  -8.814
  361    H    LYS  43           HN       LYS  43  -2.034  -9.423  -1.709
  362    HA   LYS  43           HA       LYS  43  -3.592 -11.068   0.138
  363    HB2  LYS  43           2HB      LYS  43  -1.609 -12.230  -1.763
  364    HB3  LYS  43           3HB      LYS  43  -1.566 -12.808  -0.080
  365    HG2  LYS  43           2HG      LYS  43  -3.999 -13.344  -0.275
  366    HG3  LYS  43           3HG      LYS  43  -3.903 -12.923  -2.002
  367    HD2  LYS  43           2HD      LYS  43  -2.302 -14.678  -2.404
  368    HD3  LYS  43           3HD      LYS  43  -2.176 -15.025  -0.663
  369    HE2  LYS  43           2HE      LYS  43  -4.540 -15.709  -0.633
  370    HE3  LYS  43           3HE      LYS  43  -4.659 -15.372  -2.373
  371    HZ1  LYS  43           3HZ      LYS  43  -2.888 -17.369  -1.133
  372    HZ2  LYS  43           1HZ      LYS  43  -4.286 -17.695  -1.943
  373    HZ3  LYS  43           2HZ      LYS  43  -2.998 -17.056  -2.749
  374    H    VAL  44           HN       VAL  44  -2.881 -10.879   2.157
  375    HA   VAL  44           HA       VAL  44  -0.128  -9.818   2.559
  376    HB   VAL  44           HB       VAL  44  -2.483  -9.748   4.488
  377   HG11  VAL  44          1HG1      VAL  44  -1.066  -8.238   5.813
  378   HG12  VAL  44          2HG1      VAL  44  -0.301  -9.830   5.600
  379   HG13  VAL  44          3HG1      VAL  44   0.251  -8.440   4.634
  380   HG21  VAL  44          3HG2      VAL  44  -2.869  -8.284   2.566
  381   HG22  VAL  44          1HG2      VAL  44  -2.566  -7.336   4.040
  382   HG23  VAL  44          2HG2      VAL  44  -1.283  -7.518   2.822
  383    H    ALA  45           HN       ALA  45   1.289 -11.340   3.182
  384    HA   ALA  45           HA       ALA  45   0.422 -13.926   4.097
  385    HB1  ALA  45           1HB      ALA  45   2.823 -14.348   4.449
  386    HB2  ALA  45           2HB      ALA  45   2.524 -13.592   2.866
  387    HB3  ALA  45           3HB      ALA  45   3.162 -12.617   4.213
  388    HA   PRO  46           HA       PRO  46  -0.203 -13.148   8.391
  389    HB2  PRO  46           2HB      PRO  46   0.865 -15.911   8.887
  390    HB3  PRO  46           3HB      PRO  46  -0.756 -15.211   9.206
  391    HG2  PRO  46           2HG      PRO  46  -0.335 -16.960   7.241
  392    HG3  PRO  46           3HG      PRO  46  -1.557 -15.654   7.107
  393    HD2  PRO  46           2HD      PRO  46   1.212 -15.888   5.916
  394    HD3  PRO  46           3HD      PRO  46  -0.279 -15.194   5.211
  395    H    LEU  47           HN       LEU  47   2.835 -13.920   7.038
  396    HA   LEU  47           HA       LEU  47   4.371 -13.747   9.515
  397    HB2  LEU  47           2HB      LEU  47   5.326 -13.486   6.651
  398    HB3  LEU  47           3HB      LEU  47   6.285 -13.929   8.083
  399    HG   LEU  47           HG       LEU  47   4.049 -15.610   6.933
  400   HD11  LEU  47          1HD1      LEU  47   5.827 -17.047   6.023
  401   HD12  LEU  47          2HD1      LEU  47   5.892 -15.410   5.330
  402   HD13  LEU  47          3HD1      LEU  47   7.051 -15.889   6.592
  403   HD21  LEU  47          3HD2      LEU  47   4.489 -15.971   9.319
  404   HD22  LEU  47          1HD2      LEU  47   5.004 -17.375   8.357
  405   HD23  LEU  47          2HD2      LEU  47   6.216 -16.225   8.967
  406    H    GLY  48           HN       GLY  48   2.764 -11.554   7.509
  407    HA2  GLY  48           1HA      GLY  48   2.748  -9.218   7.797
  408    HA3  GLY  48           2HA      GLY  48   4.325  -9.311   8.615
  409    H    ASP  49           HN       ASP  49   4.963 -11.243   6.240
  410    HA   ASP  49           HA       ASP  49   5.115  -9.453   3.959
  411    HB2  ASP  49           2HB      ASP  49   7.481  -9.223   3.826
  412    HB3  ASP  49           3HB      ASP  49   7.027  -8.715   5.468
  413    HD2  ASP  49           2HD      ASP  49   9.487 -11.738   5.042
  414    HA   PRO  50           HA       PRO  50   6.170  -9.428   2.199
  415    HB2  PRO  50           2HB      PRO  50   5.873 -10.085  -0.424
  416    HB3  PRO  50           3HB      PRO  50   7.372 -10.472   0.483
  417    HG2  PRO  50           2HG      PRO  50   5.078 -12.254  -0.180
  418    HG3  PRO  50           3HG      PRO  50   6.835 -12.589  -0.313
  419    HD2  PRO  50           2HD      PRO  50   5.201 -13.388   1.790
  420    HD3  PRO  50           3HD      PRO  50   6.967 -13.129   1.929
  421    H    ILE  51           HN       ILE  51   4.698  -7.971   1.216
  422    HA   ILE  51           HA       ILE  51   1.888  -8.906   1.319
  423    HB   ILE  51           HB       ILE  51   3.023  -6.083   1.382
  424   HG12  ILE  51          2HG1      ILE  51   1.740  -7.785   3.543
  425   HG13  ILE  51          3HG1      ILE  51   3.466  -7.364   3.424
  426   HG21  ILE  51          1HG2      ILE  51   0.715  -5.382   1.875
  427   HG22  ILE  51          2HG2      ILE  51   0.826  -6.176   0.288
  428   HG23  ILE  51          3HG2      ILE  51   0.164  -7.063   1.681
  429   HD11  ILE  51          3HD1      ILE  51   1.184  -5.418   3.842
  430   HD12  ILE  51          1HD1      ILE  51   2.320  -5.967   5.092
  431   HD13  ILE  51          2HD1      ILE  51   2.910  -4.999   3.725
  432    H    GLN  52           HN       GLN  52   0.910  -9.310  -0.517
  433    HA   GLN  52           HA       GLN  52   2.166  -8.432  -3.034
  434    HB2  GLN  52           2HB      GLN  52  -0.289 -10.172  -2.670
  435    HB3  GLN  52           3HB      GLN  52   0.788 -10.068  -4.083
  436    HG2  GLN  52           2HG      GLN  52   1.590 -11.148  -1.375
  437    HG3  GLN  52           3HG      GLN  52   1.059 -12.143  -2.748
  438   HE21  GLN  52          1HE2      GLN  52   3.638 -10.148  -1.424
  439   HE22  GLN  52          2HE2      GLN  52   4.864 -10.624  -2.582
  440    H    ILE  53           HN       ILE  53   1.550  -6.511  -3.852
  441    HA   ILE  53           HA       ILE  53  -1.321  -5.780  -3.543
  442    HB   ILE  53           HB       ILE  53  -0.594  -3.389  -3.692
  443   HG12  ILE  53          2HG1      ILE  53   2.181  -4.535  -3.263
  444   HG13  ILE  53          3HG1      ILE  53   1.585  -3.829  -4.784
  445   HG21  ILE  53          1HG2      ILE  53   0.187  -3.229  -1.363
  446   HG22  ILE  53          2HG2      ILE  53  -1.114  -4.430  -1.532
  447   HG23  ILE  53          3HG2      ILE  53   0.576  -4.965  -1.376
  448   HD11  ILE  53          3HD1      ILE  53   1.878  -2.377  -2.143
  449   HD12  ILE  53          1HD1      ILE  53   2.967  -2.222  -3.538
  450   HD13  ILE  53          2HD1      ILE  53   1.283  -1.671  -3.666
  451    H    ASN  54           HN       ASN  54  -2.155  -4.348  -5.281
  452    HA   ASN  54           HA       ASN  54  -0.742  -4.852  -7.857
  453    HB2  ASN  54           2HB      ASN  54  -2.665  -6.383  -7.587
  454    HB3  ASN  54           3HB      ASN  54  -3.735  -4.983  -7.362
  455   HD21  ASN  54          1HD2      ASN  54  -1.837  -6.861  -9.640
  456   HD22  ASN  54          2HD2      ASN  54  -2.504  -6.148 -11.092
  457    H    VAL  55           HN       VAL  55  -0.110  -3.001  -8.684
  458    HA   VAL  55           HA       VAL  55  -1.922  -0.649  -8.415
  459    HB   VAL  55           HB       VAL  55   1.110  -0.505  -8.503
  460   HG11  VAL  55          1HG1      VAL  55   0.772   1.816  -7.771
  461   HG12  VAL  55          2HG1      VAL  55  -0.066   1.485  -9.304
  462   HG13  VAL  55          3HG1      VAL  55  -0.988   1.561  -7.783
  463   HG21  VAL  55          3HG2      VAL  55   0.449  -1.639  -6.442
  464   HG22  VAL  55          1HG2      VAL  55   1.073  -0.010  -6.098
  465   HG23  VAL  55          2HG2      VAL  55  -0.678  -0.314  -6.065
  466    H    ARG  56           HN       ARG  56  -2.176   0.605 -10.239
  467    HA   ARG  56           HA       ARG  56  -2.229   1.129 -12.466
  468    HB2  ARG  56           2HB      ARG  56   0.365  -0.408 -12.795
  469    HB3  ARG  56           3HB      ARG  56  -0.299   0.852 -13.862
  470    HG2  ARG  56           2HG      ARG  56   0.695   1.272 -11.032
  471    HG3  ARG  56           3HG      ARG  56   1.587   1.665 -12.522
  472    HD2  ARG  56           2HD      ARG  56  -0.261   3.218 -13.154
  473    HD3  ARG  56           3HD      ARG  56  -1.025   2.890 -11.583
  474    HE   ARG  56           HE       ARG  56   1.755   3.810 -11.470
  475   HH11  ARG  56          2HH1      ARG  56  -1.660   4.668 -11.355
  476   HH12  ARG  56          1HH1      ARG  56  -1.377   6.197 -10.555
  477   HH21  ARG  56          2HH2      ARG  56   2.114   5.812 -10.438
  478   HH22  ARG  56          1HH2      ARG  56   0.761   6.845 -10.036
  479    H    GLY  57           HN       GLY  57  -0.489  -1.961 -12.672
  480    HA2  GLY  57           1HA      GLY  57  -2.800  -3.578 -13.126
  481    HA3  GLY  57           2HA      GLY  57  -2.026  -3.154 -14.670
  482    H    TYR  58           HN       TYR  58  -0.161  -3.332 -11.737
  483    HA   TYR  58           HA       TYR  58   1.122  -5.836 -12.736
  484    HB2  TYR  58           2HB      TYR  58   2.287  -3.579 -13.257
  485    HB3  TYR  58           3HB      TYR  58   2.607  -3.494 -11.517
  486    HD1  TYR  58           1HD      TYR  58   4.029  -5.303 -10.449
  487    HD2  TYR  58           2HD      TYR  58   3.628  -4.914 -14.674
  488    HE1  TYR  58           1HE      TYR  58   6.060  -6.646 -10.766
  489    HE2  TYR  58           2HE      TYR  58   5.654  -6.267 -14.992
  490    HH   TYR  58           HH       TYR  58   7.351  -7.412 -13.999
  491    H    GLU  59           HN       GLU  59   1.831  -7.254 -11.154
  492    HA   GLU  59           HA       GLU  59   0.757  -6.754  -8.460
  493    HB2  GLU  59           2HB      GLU  59   2.178  -9.198  -9.553
  494    HB3  GLU  59           3HB      GLU  59   1.229  -9.086  -8.052
  495    HG2  GLU  59           2HG      GLU  59  -0.802  -8.717  -9.338
  496    HG3  GLU  59           3HG      GLU  59   0.128  -8.749 -10.852
  497    HE2  GLU  59           2HE      GLU  59  -0.814 -12.168  -9.121
  498    H    LEU  60           HN       LEU  60   1.989  -5.681  -7.077
  499    HA   LEU  60           HA       LEU  60   4.930  -5.860  -7.369
  500    HB2  LEU  60           2HB      LEU  60   3.178  -3.944  -5.801
  501    HB3  LEU  60           3HB      LEU  60   4.953  -3.874  -5.908
  502    HG   LEU  60           HG       LEU  60   3.061  -3.576  -8.254
  503   HD11  LEU  60          1HD1      LEU  60   3.640  -1.185  -8.172
  504   HD12  LEU  60          2HD1      LEU  60   2.834  -1.711  -6.676
  505   HD13  LEU  60          3HD1      LEU  60   4.597  -1.470  -6.699
  506   HD21  LEU  60          3HD2      LEU  60   5.277  -4.450  -8.850
  507   HD22  LEU  60          1HD2      LEU  60   5.068  -2.785  -9.443
  508   HD23  LEU  60          2HD2      LEU  60   6.048  -3.095  -7.991
  509    H    SER  61           HN       SER  61   6.150  -6.928  -5.959
  510    HA   SER  61           HA       SER  61   4.874  -7.996  -3.522
  511    HB2  SER  61           2HB      SER  61   7.619  -8.485  -4.739
  512    HB3  SER  61           3HB      SER  61   6.941  -9.330  -3.327
  513    HG   SER  61           HG       SER  61   6.663 -10.507  -5.286
  514    H    LEU  62           HN       LEU  62   4.823  -6.578  -1.885
  515    HA   LEU  62           HA       LEU  62   7.241  -4.894  -1.440
  516    HB2  LEU  62           2HB      LEU  62   5.026  -3.769  -1.841
  517    HB3  LEU  62           3HB      LEU  62   4.439  -4.527  -0.342
  518    HG   LEU  62           HG       LEU  62   6.215  -3.330   0.907
  519   HD11  LEU  62          1HD1      LEU  62   7.407  -1.479  -0.189
  520   HD12  LEU  62          2HD1      LEU  62   7.805  -3.044  -0.935
  521   HD13  LEU  62          3HD1      LEU  62   6.676  -1.933  -1.747
  522   HD21  LEU  62          3HD2      LEU  62   3.939  -2.431   0.756
  523   HD22  LEU  62          1HD2      LEU  62   5.141  -1.121   0.804
  524   HD23  LEU  62          2HD2      LEU  62   4.374  -1.567  -0.738
  525    H    ARG  63           HN       ARG  63   8.117  -4.762   0.684
  526    HA   ARG  63           HA       ARG  63   7.268  -7.049   2.373
  527    HB2  ARG  63           2HB      ARG  63   9.916  -5.629   2.085
  528    HB3  ARG  63           3HB      ARG  63   9.548  -6.697   3.460
  529    HG2  ARG  63           2HG      ARG  63   9.076  -8.534   1.886
  530    HG3  ARG  63           3HG      ARG  63   9.499  -7.463   0.529
  531    HD2  ARG  63           2HD      ARG  63  11.774  -7.286   1.301
  532    HD3  ARG  63           3HD      ARG  63  11.386  -8.176   2.789
  533    HE   ARG  63           HE       ARG  63  10.823 -10.108   1.240
  534   HH11  ARG  63          2HH1      ARG  63  13.215  -7.649   0.426
  535   HH12  ARG  63          1HH1      ARG  63  14.096  -8.694  -0.664
  536   HH21  ARG  63          2HH2      ARG  63  11.970 -11.443  -0.201
  537   HH22  ARG  63          1HH2      ARG  63  13.393 -10.837  -1.018
  538    H    LYS  64           HN       LYS  64   7.753  -6.693   4.759
  539    HA   LYS  64           HA       LYS  64   5.818  -4.842   5.633
  540    HB2  LYS  64           2HB      LYS  64   6.488  -5.478   7.876
  541    HB3  LYS  64           3HB      LYS  64   6.458  -6.909   6.818
  542    HG2  LYS  64           2HG      LYS  64   9.080  -6.023   6.637
  543    HG3  LYS  64           3HG      LYS  64   8.660  -5.741   8.343
  544    HD2  LYS  64           2HD      LYS  64   8.424  -8.349   6.814
  545    HD3  LYS  64           3HD      LYS  64   9.603  -7.959   8.089
  546    HE2  LYS  64           2HE      LYS  64   7.790  -7.746   9.720
  547    HE3  LYS  64           3HE      LYS  64   6.593  -8.088   8.451
  548    HZ1  LYS  64           3HZ      LYS  64   8.701  -9.933   9.359
  549    HZ2  LYS  64           1HZ      LYS  64   7.101 -10.039   9.743
  550    HZ3  LYS  64           2HZ      LYS  64   7.589 -10.250   8.182
  551    H    SER  65           HN       SER  65   9.282  -4.496   5.200
  552    HA   SER  65           HA       SER  65   9.860  -2.388   6.943
  553    HB2  SER  65           2HB      SER  65  10.950  -2.586   4.121
  554    HB3  SER  65           3HB      SER  65  11.776  -2.021   5.593
  555    HG   SER  65           HG       SER  65  12.383  -4.159   4.997
  556    H    ALA  66           HN       ALA  66   8.774  -2.173   3.515
  557    HA   ALA  66           HA       ALA  66   8.556   0.711   3.687
  558    HB1  ALA  66           1HB      ALA  66   7.648   0.551   1.410
  559    HB2  ALA  66           2HB      ALA  66   9.137  -0.405   1.585
  560    HB3  ALA  66           3HB      ALA  66   7.553  -1.217   1.573
  561    H    ALA  67           HN       ALA  67   6.315  -2.045   3.879
  562    HA   ALA  67           HA       ALA  67   3.926  -0.509   3.657
  563    HB1  ALA  67           1HB      ALA  67   2.804  -2.503   4.561
  564    HB2  ALA  67           2HB      ALA  67   3.999  -2.934   3.316
  565    HB3  ALA  67           3HB      ALA  67   4.382  -3.172   5.038
  566    H    GLU  68           HN       GLU  68   6.159  -0.922   6.265
  567    HA   GLU  68           HA       GLU  68   4.270  -0.089   8.333
  568    HB2  GLU  68           2HB      GLU  68   7.233  -0.640   8.210
  569    HB3  GLU  68           3HB      GLU  68   6.509   0.153   9.629
  570    HG2  GLU  68           2HG      GLU  68   5.450  -2.460   8.570
  571    HG3  GLU  68           3HG      GLU  68   6.839  -2.397   9.677
  572    HE2  GLU  68           2HE      GLU  68   3.659  -0.781  11.377
  573    H    MET  69           HN       MET  69   5.951   1.505   5.863
  574    HA   MET  69           HA       MET  69   6.090   3.987   7.510
  575    HB2  MET  69           2HB      MET  69   8.247   2.826   6.588
  576    HB3  MET  69           3HB      MET  69   7.746   3.546   5.040
  577    HG2  MET  69           2HG      MET  69   9.303   5.035   6.013
  578    HG3  MET  69           3HG      MET  69   7.705   5.776   6.198
  579    HE1  MET  69           3HE      MET  69   6.308   4.653   8.668
  580    HE2  MET  69           1HE      MET  69   6.996   5.597  10.007
  581    HE3  MET  69           2HE      MET  69   6.614   6.394   8.467
  582    H    ILE  70           HN       ILE  70   4.371   2.460   5.119
  583    HA   ILE  70           HA       ILE  70   3.889   4.909   3.548
  584    HB   ILE  70           HB       ILE  70   2.772   2.091   3.265
  585   HG12  ILE  70          2HG1      ILE  70   4.782   3.642   1.605
  586   HG13  ILE  70          3HG1      ILE  70   5.158   2.310   2.724
  587   HG21  ILE  70          1HG2      ILE  70   1.847   2.868   1.118
  588   HG22  ILE  70          2HG2      ILE  70   1.162   3.776   2.486
  589   HG23  ILE  70          3HG2      ILE  70   2.420   4.515   1.467
  590   HD11  ILE  70          3HD1      ILE  70   3.473   2.104   0.215
  591   HD12  ILE  70          1HD1      ILE  70   5.146   1.536   0.388
  592   HD13  ILE  70          2HD1      ILE  70   3.851   0.773   1.335
  593    H    GLU  71           HN       GLU  71   2.252   6.232   3.871
  594    HA   GLU  71           HA       GLU  71   0.305   5.611   6.009
  595    HB2  GLU  71           2HB      GLU  71   1.628   7.762   5.886
  596    HB3  GLU  71           3HB      GLU  71   0.713   8.157   4.411
  597    HG2  GLU  71           2HG      GLU  71  -0.545   9.287   5.910
  598    HG3  GLU  71           3HG      GLU  71  -1.343   7.705   6.034
  599    HE2  GLU  71           2HE      GLU  71  -0.646   7.702   9.381
  600    H    VAL  72           HN       VAL  72  -1.607   4.710   5.437
  601    HA   VAL  72           HA       VAL  72  -2.758   5.560   2.833
  602    HB   VAL  72           HB       VAL  72  -3.651   3.254   2.511
  603   HG11  VAL  72          1HG1      VAL  72  -1.549   2.254   1.722
  604   HG12  VAL  72          2HG1      VAL  72  -1.635   3.986   1.332
  605   HG13  VAL  72          3HG1      VAL  72  -0.629   3.428   2.690
  606   HG21  VAL  72          3HG2      VAL  72  -3.556   2.498   4.839
  607   HG22  VAL  72          1HG2      VAL  72  -2.671   1.383   3.772
  608   HG23  VAL  72          2HG2      VAL  72  -1.777   2.538   4.787
  609    H    GLU  73           HN       GLU  73  -5.087   5.101   2.622
  610    HA   GLU  73           HA       GLU  73  -6.499   4.869   5.228
  611    HB2  GLU  73           2HB      GLU  73  -8.112   6.564   4.516
  612    HB3  GLU  73           3HB      GLU  73  -6.470   7.245   4.609
  613    HG2  GLU  73           2HG      GLU  73  -6.249   7.276   2.247
  614    HG3  GLU  73           3HG      GLU  73  -7.703   6.278   2.027
  615    HE2  GLU  73           2HE      GLU  73  -8.127  10.174   2.528
  616    H    LEU  74           HN       LEU  74  -8.611   3.923   5.065
  617    HA   LEU  74           HA       LEU  74  -8.743   2.021   2.843
  618    HB2  LEU  74           2HB      LEU  74 -10.077   2.351   5.499
  619    HB3  LEU  74           3HB      LEU  74 -10.932   1.425   4.242
  620    HG   LEU  74           HG       LEU  74  -9.706  -0.033   5.759
  621   HD11  LEU  74          1HD1      LEU  74  -8.473  -1.330   4.071
  622   HD12  LEU  74          2HD1      LEU  74 -10.009  -0.709   3.424
  623   HD13  LEU  74          3HD1      LEU  74  -8.475   0.082   2.988
  624   HD21  LEU  74          3HD2      LEU  74  -7.914   1.503   6.411
  625   HD22  LEU  74          1HD2      LEU  74  -7.248  -0.036   5.824
  626   HD23  LEU  74          2HD2      LEU  74  -7.220   1.400   4.776
  627    H    GLU  75           HN       GLU  75 -10.056   2.109   1.131
  628    HA   GLU  75           HA       GLU  75 -11.917   4.329   0.826
  629    HB2  GLU  75           2HB      GLU  75 -11.116   1.953  -0.850
  630    HB3  GLU  75           3HB      GLU  75 -12.532   2.942  -1.282
  631    HG2  GLU  75           2HG      GLU  75  -9.762   4.081  -0.871
  632    HG3  GLU  75           3HG      GLU  75 -10.376   3.533  -2.446
  633    HE2  GLU  75           2HE      GLU  75 -11.640   6.990  -1.012
  634    H    HIS  76           HN       HIS  76 -14.188   4.110   0.495
  635    HA   HIS  76           HA       HIS  76 -16.288   3.332   0.933
  636    HB2  HIS  76           2HB      HIS  76 -15.525   1.371  -0.407
  637    HB3  HIS  76           3HB      HIS  76 -15.009   0.583   1.095
  638    HD1  HIS  76           1HD      HIS  76 -16.621  -1.146   1.756
  639    HD2  HIS  76           2HD      HIS  76 -18.516   2.153   0.034
  640    HE1  HIS  76           1HE      HIS  76 -19.101  -1.657   1.798
  641    HE2  HIS  76           2HE      HIS  76 -20.252   0.349   0.748
  642    H    HIS  77           HN       HIS  77 -14.207   3.973   3.089
  643    HA   HIS  77           HA       HIS  77 -15.250   2.521   5.391
  644    HB2  HIS  77           2HB      HIS  77 -13.887   3.924   6.736
  645    HB3  HIS  77           3HB      HIS  77 -12.942   3.519   5.292
  646    HD1  HIS  77           1HD      HIS  77 -14.374   6.378   7.188
  647    HD2  HIS  77           2HD      HIS  77 -12.549   5.712   3.493
  648    HE1  HIS  77           1HE      HIS  77 -13.700   8.655   6.312
  649    HE2  HIS  77           2HE      HIS  77 -12.580   8.251   4.069
  650    H    HIS  78           HN       HIS  78 -16.617   3.376   7.009
  651    HA   HIS  78           HA       HIS  78 -18.413   4.541   7.816
  652    HB2  HIS  78           2HB      HIS  78 -17.224   6.622   7.407
  653    HB3  HIS  78           3HB      HIS  78 -17.698   6.595   5.698
  654    HD1  HIS  78           1HD      HIS  78 -19.032   7.315   9.146
  655    HD2  HIS  78           2HD      HIS  78 -20.303   7.438   5.170
  656    HE1  HIS  78           1HE      HIS  78 -21.232   8.578   9.143
  657    HE2  HIS  78           2HE      HIS  78 -21.994   8.653   6.723
  658    H    HIS  79           HN       HIS  79 -20.633   4.497   7.475
  659    HA   HIS  79           HA       HIS  79 -21.471   2.825   5.299
  660    HB2  HIS  79           2HB      HIS  79 -22.482   2.834   7.576
  661    HB3  HIS  79           3HB      HIS  79 -23.158   4.439   7.241
  662    HD1  HIS  79           1HD      HIS  79 -25.430   4.492   6.222
  663    HD2  HIS  79           2HD      HIS  79 -23.554   0.790   5.728
  664    HE1  HIS  79           1HE      HIS  79 -27.157   2.958   5.176
  665    HE2  HIS  79           2HE      HIS  79 -26.011   0.713   4.880
  666    H    HIS  80           HN       HIS  80 -20.916   3.917   3.415
  667    HA   HIS  80           HA       HIS  80 -21.378   5.046   1.528
  668    HB2  HIS  80           2HB      HIS  80 -23.511   5.141   0.858
  669    HB3  HIS  80           3HB      HIS  80 -23.806   4.274   2.377
  670    HD1  HIS  80           1HD      HIS  80 -24.194   7.672   0.771
  671    HD2  HIS  80           2HD      HIS  80 -25.352   5.647   4.234
  672    HE1  HIS  80           1HE      HIS  80 -25.947   9.122   1.885
  673    HE2  HIS  80           2HE      HIS  80 -26.652   7.884   3.985
  674    H    HIS  81           HN       HIS  81 -21.063   6.994   0.575
  675    HA   HIS  81           HA       HIS  81 -20.446   9.187   2.425
  676    HB2  HIS  81           2HB      HIS  81 -20.079   8.858  -0.570
  677    HB3  HIS  81           3HB      HIS  81 -19.619  10.313   0.333
  678    HD1  HIS  81           1HD      HIS  81 -17.331  10.350   1.311
  679    HD2  HIS  81           2HD      HIS  81 -18.568   6.486   0.303
  680    HE1  HIS  81           1HE      HIS  81 -15.320   8.849   1.663
  681    HE2  HIS  81           2HE      HIS  81 -16.073   6.504   1.046
  Start of MODEL    6
    1    H1   MET   1           HN       MET   1  -3.281   6.256  12.662
    2    HA   MET   1           HA       MET   1  -1.596   6.915  10.472
    3    HB2  MET   1           2HB      MET   1   0.196   7.182  12.099
    4    HB3  MET   1           3HB      MET   1  -0.152   5.575  12.783
    5    HG2  MET   1           2HG      MET   1   0.473   4.532  10.652
    6    HG3  MET   1           3HG      MET   1   0.814   6.129   9.965
    7    HE1  MET   1           3HE      MET   1   3.204   5.216   9.235
    8    HE2  MET   1           1HE      MET   1   4.368   4.478  10.360
    9    HE3  MET   1           2HE      MET   1   2.843   3.642   9.983
   10    H    PHE   2           HN       PHE   2  -2.084   5.481   8.990
   11    HA   PHE   2           HA       PHE   2  -2.603   2.672   9.832
   12    HB2  PHE   2           2HB      PHE   2  -4.732   3.927   9.413
   13    HB3  PHE   2           3HB      PHE   2  -4.178   4.241   7.761
   14    HD1  PHE   2           1HD      PHE   2  -5.156   1.558  10.127
   15    HD2  PHE   2           2HD      PHE   2  -4.436   2.614   6.062
   16    HE1  PHE   2           1HE      PHE   2  -6.149  -0.568   9.400
   17    HE2  PHE   2           2HE      PHE   2  -5.423   0.488   5.333
   18    HZ   PHE   2           HZ       PHE   2  -6.284  -1.105   7.001
   19    H    SER   3           HN       SER   3  -0.889   1.612   9.015
   20    HA   SER   3           HA       SER   3   0.377   2.627   6.579
   21    HB2  SER   3           2HB      SER   3   2.079   0.932   7.007
   22    HB3  SER   3           3HB      SER   3   1.736   1.843   8.499
   23    HG   SER   3           HG       SER   3   1.841  -0.429   8.847
   24    H    LEU   4           HN       LEU   4   0.990   1.050   4.835
   25    HA   LEU   4           HA       LEU   4  -1.368  -0.260   3.839
   26    HB2  LEU   4           2HB      LEU   4   0.515   0.798   2.506
   27    HB3  LEU   4           3HB      LEU   4   1.477  -0.649   2.891
   28    HG   LEU   4           HG       LEU   4  -0.087  -2.058   1.702
   29   HD11  LEU   4          1HD1      LEU   4  -1.997  -1.109   0.475
   30   HD12  LEU   4          2HD1      LEU   4  -2.148  -0.832   2.226
   31   HD13  LEU   4          3HD1      LEU   4  -1.636   0.495   1.154
   32   HD21  LEU   4          3HD2      LEU   4   1.712  -0.984   0.422
   33   HD22  LEU   4          1HD2      LEU   4   0.257  -1.199  -0.579
   34   HD23  LEU   4          2HD2      LEU   4   0.649   0.403   0.085
   35    H    ARG   5           HN       ARG   5   1.176  -1.139   5.960
   36    HA   ARG   5           HA       ARG   5   0.978  -4.008   5.697
   37    HB2  ARG   5           2HB      ARG   5   2.738  -2.370   6.846
   38    HB3  ARG   5           3HB      ARG   5   1.691  -2.627   8.261
   39    HG2  ARG   5           2HG      ARG   5   2.732  -4.984   6.740
   40    HG3  ARG   5           3HG      ARG   5   3.801  -4.113   7.866
   41    HD2  ARG   5           2HD      ARG   5   2.926  -5.749   9.235
   42    HD3  ARG   5           3HD      ARG   5   1.809  -4.400   9.538
   43    HE   ARG   5           HE       ARG   5   0.339  -5.545   7.781
   44   HH11  ARG   5          2HH1      ARG   5   2.552  -7.271   9.913
   45   HH12  ARG   5          1HH1      ARG   5   1.623  -8.753   9.882
   46   HH21  ARG   5          2HH2      ARG   5  -0.859  -7.489   7.748
   47   HH22  ARG   5          1HH2      ARG   5  -0.305  -8.876   8.658
   48    H    ASP   6           HN       ASP   6  -0.606  -1.474   7.631
   49    HA   ASP   6           HA       ASP   6  -2.106  -3.258   9.305
   50    HB2  ASP   6           2HB      ASP   6  -2.473  -0.343   8.554
   51    HB3  ASP   6           3HB      ASP   6  -3.560  -1.195   9.673
   52    HD2  ASP   6           2HD      ASP   6  -0.181   0.174  11.040
   53    H    ALA   7           HN       ALA   7  -2.492  -2.146   6.047
   54    HA   ALA   7           HA       ALA   7  -5.326  -2.424   5.835
   55    HB1  ALA   7           1HB      ALA   7  -4.915  -2.455   3.409
   56    HB2  ALA   7           2HB      ALA   7  -3.974  -1.176   4.211
   57    HB3  ALA   7           3HB      ALA   7  -3.176  -2.685   3.708
   58    H    LYS   8           HN       LYS   8  -6.520  -4.080   4.702
   59    HA   LYS   8           HA       LYS   8  -5.335  -6.766   5.219
   60    HB2  LYS   8           2HB      LYS   8  -8.270  -6.013   5.064
   61    HB3  LYS   8           3HB      LYS   8  -7.576  -7.566   5.592
   62    HG2  LYS   8           2HG      LYS   8  -7.312  -4.906   7.023
   63    HG3  LYS   8           3HG      LYS   8  -8.369  -6.258   7.496
   64    HD2  LYS   8           2HD      LYS   8  -6.408  -7.681   7.856
   65    HD3  LYS   8           3HD      LYS   8  -5.339  -6.354   7.346
   66    HE2  LYS   8           2HE      LYS   8  -6.159  -4.980   9.223
   67    HE3  LYS   8           3HE      LYS   8  -7.212  -6.316   9.737
   68    HZ1  LYS   8           3HZ      LYS   8  -4.272  -6.403   9.610
   69    HZ2  LYS   8           1HZ      LYS   8  -5.170  -6.263  10.985
   70    HZ3  LYS   8           2HZ      LYS   8  -5.248  -7.643  10.087
   71    H    CYS   9           HN       CYS   9  -6.064  -8.510   3.747
   72    HA   CYS   9           HA       CYS   9  -5.821  -7.623   1.007
   73    HB2  CYS   9           2HB      CYS   9  -6.099 -10.057   0.501
   74    HB3  CYS   9           3HB      CYS   9  -4.763  -9.660   1.610
   75    HG   CYS   9           HG       CYS   9  -5.822 -11.954   2.274
   76    H    GLY  10           HN       GLY  10  -7.316  -7.620  -0.628
   77    HA2  GLY  10           1HA      GLY  10  -9.455  -7.886  -1.570
   78    HA3  GLY  10           2HA      GLY  10 -10.093  -8.356   0.022
   79    H    GLN  11           HN       GLN  11  -8.147  -5.742   0.498
   80    HA   GLN  11           HA       GLN  11 -10.490  -3.918   0.485
   81    HB2  GLN  11           2HB      GLN  11  -7.877  -3.860   2.031
   82    HB3  GLN  11           3HB      GLN  11  -9.100  -2.567   2.075
   83    HG2  GLN  11           2HG      GLN  11  -9.679  -5.429   2.850
   84    HG3  GLN  11           3HG      GLN  11  -9.118  -4.197   4.002
   85   HE21  GLN  11          1HE2      GLN  11 -10.979  -4.264   5.246
   86   HE22  GLN  11          2HE2      GLN  11 -12.506  -3.616   4.686
   87    H    THR  12           HN       THR  12 -10.293  -1.808  -0.290
   88    HA   THR  12           HA       THR  12  -7.906  -1.325  -2.002
   89    HB   THR  12           HB       THR  12 -10.664  -0.042  -2.184
   90    HG1  THR  12           1HG      THR  12 -10.844  -1.388  -4.058
   91   HG21  THR  12          3HG2      THR  12  -8.281   0.035  -4.071
   92   HG22  THR  12          1HG2      THR  12  -9.866   0.784  -4.369
   93   HG23  THR  12          2HG2      THR  12  -8.843   1.375  -3.041
   94    H    VAL  13           HN       VAL  13  -6.587   0.319  -1.440
   95    HA   VAL  13           HA       VAL  13  -7.671   2.325   0.467
   96    HB   VAL  13           HB       VAL  13  -5.468   2.416   1.583
   97   HG11  VAL  13          1HG1      VAL  13  -5.642   0.308   2.835
   98   HG12  VAL  13          2HG1      VAL  13  -7.243   1.022   2.534
   99   HG13  VAL  13          3HG1      VAL  13  -6.687  -0.362   1.561
  100   HG21  VAL  13          3HG2      VAL  13  -4.089   1.618  -0.276
  101   HG22  VAL  13          1HG2      VAL  13  -3.799   0.656   1.192
  102   HG23  VAL  13          2HG2      VAL  13  -4.803  -0.004  -0.119
  103    H    LYS  14           HN       LYS  14  -6.087   4.259   0.598
  104    HA   LYS  14           HA       LYS  14  -4.947   4.789  -2.099
  105    HB2  LYS  14           2HB      LYS  14  -7.101   6.184  -0.669
  106    HB3  LYS  14           3HB      LYS  14  -5.790   7.256  -1.218
  107    HG2  LYS  14           2HG      LYS  14  -6.273   6.952  -3.418
  108    HG3  LYS  14           3HG      LYS  14  -6.826   5.277  -3.181
  109    HD2  LYS  14           2HD      LYS  14  -8.618   6.930  -3.831
  110    HD3  LYS  14           3HD      LYS  14  -8.937   5.997  -2.349
  111    HE2  LYS  14           2HE      LYS  14  -8.043   7.954  -1.037
  112    HE3  LYS  14           3HE      LYS  14  -8.003   8.871  -2.559
  113    HZ1  LYS  14           3HZ      LYS  14 -10.400   7.657  -1.354
  114    HZ2  LYS  14           1HZ      LYS  14 -10.026   9.262  -1.338
  115    HZ3  LYS  14           2HZ      LYS  14 -10.362   8.508  -2.766
  116    H    VAL  15           HN       VAL  15  -2.956   5.620  -2.097
  117    HA   VAL  15           HA       VAL  15  -1.586   5.901   0.434
  118    HB   VAL  15           HB       VAL  15  -0.634   6.617  -2.365
  119   HG11  VAL  15          1HG1      VAL  15   1.627   6.417  -1.412
  120   HG12  VAL  15          2HG1      VAL  15   0.685   7.684  -0.594
  121   HG13  VAL  15          3HG1      VAL  15   0.921   6.104   0.190
  122   HG21  VAL  15          3HG2      VAL  15  -1.298   4.267  -2.201
  123   HG22  VAL  15          1HG2      VAL  15   0.467   4.421  -2.351
  124   HG23  VAL  15          2HG2      VAL  15  -0.263   4.067  -0.767
  125    H    VAL  16           HN       VAL  16  -1.700   7.639   1.689
  126    HA   VAL  16           HA       VAL  16  -2.241  10.228   0.351
  127    HB   VAL  16           HB       VAL  16  -2.952  10.992   2.668
  128   HG11  VAL  16          1HG1      VAL  16  -5.184   9.972   2.477
  129   HG12  VAL  16          2HG1      VAL  16  -4.549  10.452   0.887
  130   HG13  VAL  16          3HG1      VAL  16  -4.523   8.741   1.375
  131   HG21  VAL  16          3HG2      VAL  16  -1.876   9.214   3.971
  132   HG22  VAL  16          1HG2      VAL  16  -3.627   9.252   4.276
  133   HG23  VAL  16          2HG2      VAL  16  -2.939   8.006   3.210
  134    H    LYS  17           HN       LYS  17  -0.201   8.615   2.763
  135    HA   LYS  17           HA       LYS  17   1.711  10.865   2.420
  136    HB2  LYS  17           2HB      LYS  17   0.985   9.484   5.023
  137    HB3  LYS  17           3HB      LYS  17   2.349  10.607   4.810
  138    HG2  LYS  17           2HG      LYS  17   0.797  12.408   4.265
  139    HG3  LYS  17           3HG      LYS  17  -0.577  11.290   4.430
  140    HD2  LYS  17           2HD      LYS  17  -0.275  12.669   6.446
  141    HD3  LYS  17           3HD      LYS  17  -0.034  10.939   6.786
  142    HE2  LYS  17           2HE      LYS  17   2.399  11.249   6.679
  143    HE3  LYS  17           3HE      LYS  17   2.169  12.973   6.314
  144    HZ1  LYS  17           3HZ      LYS  17   1.334  11.620   8.792
  145    HZ2  LYS  17           1HZ      LYS  17   2.642  12.611   8.632
  146    HZ3  LYS  17           2HZ      LYS  17   1.121  13.221   8.453
  147    H    LEU  18           HN       LEU  18   3.919  10.287   2.776
  148    HA   LEU  18           HA       LEU  18   4.414   7.353   2.753
  149    HB2  LEU  18           2HB      LEU  18   5.676   9.502   1.034
  150    HB3  LEU  18           3HB      LEU  18   6.371   7.877   1.248
  151    HG   LEU  18           HG       LEU  18   3.641   8.480   0.069
  152   HD11  LEU  18          1HD1      LEU  18   4.662   7.808  -2.071
  153   HD12  LEU  18          2HD1      LEU  18   5.476   9.233  -1.384
  154   HD13  LEU  18          3HD1      LEU  18   6.238   7.628  -1.263
  155   HD21  LEU  18          3HD2      LEU  18   3.766   6.303   1.209
  156   HD22  LEU  18          1HD2      LEU  18   3.661   6.094  -0.555
  157   HD23  LEU  18          2HD2      LEU  18   5.223   5.891   0.273
  158    H    HIS  19           HN       HIS  19   5.491   6.824   4.522
  159    HA   HIS  19           HA       HIS  19   7.045   8.867   5.943
  160    HB2  HIS  19           2HB      HIS  19   6.482   5.951   6.587
  161    HB3  HIS  19           3HB      HIS  19   7.362   7.076   7.638
  162    HD1  HIS  19           1HD      HIS  19   6.004   8.733   9.026
  163    HD2  HIS  19           2HD      HIS  19   3.678   6.423   6.435
  164    HE1  HIS  19           1HE      HIS  19   3.594   9.113   9.712
  165    HE2  HIS  19           2HE      HIS  19   2.185   7.704   8.136
  166    H    GLY  20           HN       GLY  20   9.258   8.539   6.564
  167    HA2  GLY  20           1HA      GLY  20  11.195   6.947   6.215
  168    HA3  GLY  20           2HA      GLY  20  10.707   6.952   4.504
  169    H    THR  21           HN       THR  21  13.208   7.610   4.830
  170    HA   THR  21           HA       THR  21  13.555  10.423   5.454
  171    HB   THR  21           HB       THR  21  15.917   9.983   4.708
  172    HG1  THR  21           1HG      THR  21  16.420   7.763   4.292
  173   HG21  THR  21          3HG2      THR  21  14.734   7.994   6.680
  174   HG22  THR  21          1HG2      THR  21  16.446   8.471   6.584
  175   HG23  THR  21          2HG2      THR  21  15.214   9.668   7.048
  176    H    GLY  22           HN       GLY  22  14.267   8.522   2.462
  177    HA2  GLY  22           1HA      GLY  22  12.849  10.387   0.808
  178    HA3  GLY  22           2HA      GLY  22  14.595  10.719   0.774
  179    H    ALA  23           HN       ALA  23  15.853   8.409   0.684
  180    HA   ALA  23           HA       ALA  23  15.465   7.535  -1.979
  181    HB1  ALA  23           1HB      ALA  23  17.137   5.806  -1.447
  182    HB2  ALA  23           2HB      ALA  23  17.616   7.394  -0.803
  183    HB3  ALA  23           3HB      ALA  23  16.944   6.157   0.286
  184    H    LEU  24           HN       LEU  24  14.620   5.971   1.124
  185    HA   LEU  24           HA       LEU  24  13.481   3.612   0.093
  186    HB2  LEU  24           2HB      LEU  24  14.003   4.240   2.495
  187    HB3  LEU  24           3HB      LEU  24  12.491   5.177   2.491
  188    HG   LEU  24           HG       LEU  24  12.463   2.861   3.559
  189   HD11  LEU  24          1HD1      LEU  24  10.193   2.376   2.753
  190   HD12  LEU  24          2HD1      LEU  24  10.430   4.115   3.031
  191   HD13  LEU  24          3HD1      LEU  24  10.452   3.467   1.374
  192   HD21  LEU  24          3HD2      LEU  24  13.723   1.687   1.816
  193   HD22  LEU  24          1HD2      LEU  24  12.117   0.957   2.039
  194   HD23  LEU  24          2HD2      LEU  24  12.425   2.017   0.645
  195    H    LYS  25           HN       LYS  25  12.079   6.858   0.549
  196    HA   LYS  25           HA       LYS  25   9.390   6.104  -0.056
  197    HB2  LYS  25           2HB      LYS  25  10.781   8.789  -0.333
  198    HB3  LYS  25           3HB      LYS  25   9.021   8.518  -0.321
  199    HG2  LYS  25           2HG      LYS  25   9.093   7.755   1.959
  200    HG3  LYS  25           3HG      LYS  25  10.873   7.798   1.965
  201    HD2  LYS  25           2HD      LYS  25   9.962   9.736   3.130
  202    HD3  LYS  25           3HD      LYS  25  10.810  10.236   1.646
  203    HE2  LYS  25           2HE      LYS  25   8.681  10.463   0.477
  204    HE3  LYS  25           3HE      LYS  25   7.807   9.889   1.913
  205    HZ1  LYS  25           3HZ      LYS  25   9.426  12.342   1.760
  206    HZ2  LYS  25           1HZ      LYS  25   7.779  12.274   1.751
  207    HZ3  LYS  25           2HZ      LYS  25   8.615  11.808   3.094
  208    H    ARG  26           HN       ARG  26  11.977   7.594  -2.068
  209    HA   ARG  26           HA       ARG  26  10.413   7.707  -4.449
  210    HB2  ARG  26           2HB      ARG  26  12.712   8.801  -3.832
  211    HB3  ARG  26           3HB      ARG  26  13.397   7.293  -4.484
  212    HG2  ARG  26           2HG      ARG  26  11.463   9.004  -6.057
  213    HG3  ARG  26           3HG      ARG  26  13.219   9.289  -6.072
  214    HD2  ARG  26           2HD      ARG  26  13.657   7.186  -7.065
  215    HD3  ARG  26           3HD      ARG  26  12.018   6.593  -6.723
  216    HE   ARG  26           HE       ARG  26  11.942   8.906  -8.418
  217   HH11  ARG  26          2HH1      ARG  26  12.839   5.507  -8.473
  218   HH12  ARG  26          1HH1      ARG  26  12.361   5.280 -10.140
  219   HH21  ARG  26          2HH2      ARG  26  11.258   8.588 -10.561
  220   HH22  ARG  26          1HH2      ARG  26  11.464   7.026 -11.323
  221    H    ARG  27           HN       ARG  27  12.346   5.173  -2.938
  222    HA   ARG  27           HA       ARG  27  12.489   3.335  -5.080
  223    HB2  ARG  27           2HB      ARG  27  13.694   3.146  -2.939
  224    HB3  ARG  27           3HB      ARG  27  12.153   2.818  -2.109
  225    HG2  ARG  27           2HG      ARG  27  11.908   0.734  -3.347
  226    HG3  ARG  27           3HG      ARG  27  13.410   1.069  -4.240
  227    HD2  ARG  27           2HD      ARG  27  14.646   1.108  -2.094
  228    HD3  ARG  27           3HD      ARG  27  13.142   0.703  -1.239
  229    HE   ARG  27           HE       ARG  27  13.333  -1.337  -2.999
  230   HH11  ARG  27          2HH1      ARG  27  15.733   0.148  -0.885
  231   HH12  ARG  27          1HH1      ARG  27  16.598  -1.345  -0.606
  232   HH21  ARG  27          2HH2      ARG  27  14.449  -3.287  -2.601
  233   HH22  ARG  27          1HH2      ARG  27  15.869  -3.293  -1.579
  234    H    ILE  28           HN       ILE  28   9.946   3.889  -2.633
  235    HA   ILE  28           HA       ILE  28   8.197   1.838  -3.634
  236    HB   ILE  28           HB       ILE  28   7.523   4.330  -2.014
  237   HG12  ILE  28          2HG1      ILE  28   8.187   1.518  -1.081
  238   HG13  ILE  28          3HG1      ILE  28   9.274   2.925  -0.975
  239   HG21  ILE  28          1HG2      ILE  28   5.558   3.044  -1.283
  240   HG22  ILE  28          2HG2      ILE  28   5.565   3.271  -3.047
  241   HG23  ILE  28          3HG2      ILE  28   6.039   1.704  -2.349
  242   HD11  ILE  28          3HD1      ILE  28   6.597   2.635   0.415
  243   HD12  ILE  28          1HD1      ILE  28   8.188   2.471   1.188
  244   HD13  ILE  28          2HD1      ILE  28   7.686   4.039   0.523
  245    H    MET  29           HN       MET  29   8.535   5.341  -4.182
  246    HA   MET  29           HA       MET  29   6.208   5.675  -5.789
  247    HB2  MET  29           2HB      MET  29   8.831   7.205  -5.802
  248    HB3  MET  29           3HB      MET  29   7.325   7.737  -6.584
  249    HG2  MET  29           2HG      MET  29   6.219   7.909  -4.446
  250    HG3  MET  29           3HG      MET  29   7.626   7.224  -3.617
  251    HE1  MET  29           3HE      MET  29   6.196  10.300  -5.607
  252    HE2  MET  29           1HE      MET  29   7.611  11.372  -5.698
  253    HE3  MET  29           2HE      MET  29   7.605   9.834  -6.589
  254    H    ASP  30           HN       ASP  30   9.458   4.549  -6.492
  255    HA   ASP  30           HA       ASP  30   9.498   4.818  -9.299
  256    HB2  ASP  30           2HB      ASP  30  11.471   4.233  -8.001
  257    HB3  ASP  30           3HB      ASP  30  10.722   2.707  -7.487
  258    HD2  ASP  30           2HD      ASP  30  12.358   2.905 -11.089
  259    H    MET  31           HN       MET  31   7.936   2.462  -7.217
  260    HA   MET  31           HA       MET  31   7.380   0.637  -9.436
  261    HB2  MET  31           2HB      MET  31   6.574   0.671  -6.514
  262    HB3  MET  31           3HB      MET  31   6.122  -0.611  -7.663
  263    HG2  MET  31           2HG      MET  31   8.448  -1.187  -8.003
  264    HG3  MET  31           3HG      MET  31   8.972   0.169  -6.992
  265    HE1  MET  31           3HE      MET  31   6.848   0.097  -4.638
  266    HE2  MET  31           1HE      MET  31   7.708  -0.902  -3.444
  267    HE3  MET  31           2HE      MET  31   8.598   0.312  -4.391
  268    H    GLY  32           HN       GLY  32   6.129   3.561  -8.551
  269    HA2  GLY  32           1HA      GLY  32   4.284   4.449  -9.789
  270    HA3  GLY  32           2HA      GLY  32   3.536   2.835  -9.794
  271    H    ILE  33           HN       ILE  33   4.720   3.163  -6.767
  272    HA   ILE  33           HA       ILE  33   2.039   3.803  -5.755
  273    HB   ILE  33           HB       ILE  33   4.520   2.973  -4.200
  274   HG12  ILE  33          2HG1      ILE  33   2.274   1.238  -5.277
  275   HG13  ILE  33          3HG1      ILE  33   3.914   1.335  -5.964
  276   HG21  ILE  33          1HG2      ILE  33   2.891   2.277  -2.490
  277   HG22  ILE  33          2HG2      ILE  33   2.747   4.013  -2.855
  278   HG23  ILE  33          3HG2      ILE  33   1.562   2.862  -3.519
  279   HD11  ILE  33          3HD1      ILE  33   3.204   0.376  -3.182
  280   HD12  ILE  33          1HD1      ILE  33   3.656  -0.661  -4.551
  281   HD13  ILE  33          2HD1      ILE  33   4.843   0.471  -3.870
  282    H    THR  34           HN       THR  34   1.593   5.905  -5.561
  283    HA   THR  34           HA       THR  34   3.397   7.545  -3.918
  284    HB   THR  34           HB       THR  34   4.179   7.975  -6.216
  285    HG1  THR  34           1HG      THR  34   3.839  10.257  -6.173
  286   HG21  THR  34          3HG2      THR  34   1.323   8.851  -6.764
  287   HG22  THR  34          1HG2      THR  34   2.694   9.023  -7.883
  288   HG23  THR  34          2HG2      THR  34   2.119   7.403  -7.427
  289    H    ARG  35           HN       ARG  35   2.221   9.887  -3.804
  290    HA   ARG  35           HA       ARG  35  -0.168   9.364  -2.376
  291    HB2  ARG  35           2HB      ARG  35   0.957  11.950  -3.479
  292    HB3  ARG  35           3HB      ARG  35  -0.480  11.860  -2.432
  293    HG2  ARG  35           2HG      ARG  35   1.274  12.423  -0.993
  294    HG3  ARG  35           3HG      ARG  35   1.028  10.679  -0.744
  295    HD2  ARG  35           2HD      ARG  35   3.424  11.320  -0.891
  296    HD3  ARG  35           3HD      ARG  35   2.931  10.158  -2.142
  297    HE   ARG  35           HE       ARG  35   2.905  12.000  -3.748
  298   HH11  ARG  35          2HH1      ARG  35   4.410  12.680  -0.639
  299   HH12  ARG  35          1HH1      ARG  35   5.429  13.953  -1.272
  300   HH21  ARG  35          2HH2      ARG  35   4.262  13.627  -4.572
  301   HH22  ARG  35          1HH2      ARG  35   5.345  14.490  -3.503
  302    H    GLY  36           HN       GLY  36  -2.242   9.229  -2.941
  303    HA2  GLY  36           1HA      GLY  36  -4.147   9.832  -4.198
  304    HA3  GLY  36           2HA      GLY  36  -3.093  10.423  -5.503
  305    H    CYS  37           HN       CYS  37  -1.707   7.585  -4.728
  306    HA   CYS  37           HA       CYS  37  -3.025   6.228  -6.955
  307    HB2  CYS  37           2HB      CYS  37  -0.579   6.145  -6.671
  308    HB3  CYS  37           3HB      CYS  37  -0.799   5.299  -5.118
  309    HG   CYS  37           HG       CYS  37   0.097   3.632  -6.921
  310    H    GLU  38           HN       GLU  38  -4.308   4.479  -6.873
  311    HA   GLU  38           HA       GLU  38  -5.407   3.758  -4.232
  312    HB2  GLU  38           2HB      GLU  38  -6.251   2.969  -7.038
  313    HB3  GLU  38           3HB      GLU  38  -7.118   2.573  -5.536
  314    HG2  GLU  38           2HG      GLU  38  -7.555   4.914  -5.120
  315    HG3  GLU  38           3HG      GLU  38  -6.580   5.380  -6.531
  316    HE2  GLU  38           2HE      GLU  38 -10.326   4.464  -7.085
  317    H    ILE  39           HN       ILE  39  -4.894   1.950  -3.201
  318    HA   ILE  39           HA       ILE  39  -3.168   0.022  -4.664
  319    HB   ILE  39           HB       ILE  39  -3.265   0.536  -1.666
  320   HG12  ILE  39          2HG1      ILE  39  -2.426   2.512  -2.829
  321   HG13  ILE  39          3HG1      ILE  39  -1.133   1.694  -1.921
  322   HG21  ILE  39          1HG2      ILE  39  -1.182  -0.776  -1.629
  323   HG22  ILE  39          2HG2      ILE  39  -2.532  -1.718  -2.304
  324   HG23  ILE  39          3HG2      ILE  39  -1.305  -1.018  -3.387
  325   HD11  ILE  39          3HD1      ILE  39  -1.599   1.511  -4.907
  326   HD12  ILE  39          1HD1      ILE  39  -0.329   2.467  -4.114
  327   HD13  ILE  39          2HD1      ILE  39  -0.305   0.694  -3.998
  328    H    TYR  40           HN       TYR  40  -4.177  -1.800  -5.134
  329    HA   TYR  40           HA       TYR  40  -6.320  -2.762  -3.341
  330    HB2  TYR  40           2HB      TYR  40  -6.777  -2.774  -5.742
  331    HB3  TYR  40           3HB      TYR  40  -5.332  -3.758  -6.035
  332    HD1  TYR  40           2HD      TYR  40  -8.563  -3.828  -4.137
  333    HD2  TYR  40           1HD      TYR  40  -5.545  -6.087  -6.125
  334    HE1  TYR  40           2HE      TYR  40  -9.896  -5.869  -3.843
  335    HE2  TYR  40           1HE      TYR  40  -6.880  -8.127  -5.838
  336    HH   TYR  40           HH       TYR  40 -10.051  -8.106  -4.214
  337    H    ILE  41           HN       ILE  41  -5.521  -3.754  -1.576
  338    HA   ILE  41           HA       ILE  41  -3.076  -5.305  -1.685
  339    HB   ILE  41           HB       ILE  41  -5.184  -5.287   0.511
  340   HG12  ILE  41          2HG1      ILE  41  -3.378  -3.763   1.620
  341   HG13  ILE  41          3HG1      ILE  41  -2.878  -3.439  -0.058
  342   HG21  ILE  41          1HG2      ILE  41  -3.333  -6.055   1.942
  343   HG22  ILE  41          2HG2      ILE  41  -3.620  -7.180   0.594
  344   HG23  ILE  41          3HG2      ILE  41  -2.245  -6.052   0.535
  345   HD11  ILE  41          3HD1      ILE  41  -5.634  -2.957   1.100
  346   HD12  ILE  41          1HD1      ILE  41  -4.419  -1.706   0.761
  347   HD13  ILE  41          2HD1      ILE  41  -5.131  -2.632  -0.576
  348    H    ARG  42           HN       ARG  42  -3.022  -7.196  -2.737
  349    HA   ARG  42           HA       ARG  42  -5.555  -8.604  -3.168
  350    HB2  ARG  42           2HB      ARG  42  -3.717  -8.105  -4.926
  351    HB3  ARG  42           3HB      ARG  42  -2.864  -9.487  -4.198
  352    HG2  ARG  42           2HG      ARG  42  -5.718  -9.858  -4.989
  353    HG3  ARG  42           3HG      ARG  42  -4.494  -9.761  -6.279
  354    HD2  ARG  42           2HD      ARG  42  -4.125 -11.595  -3.913
  355    HD3  ARG  42           3HD      ARG  42  -5.108 -12.085  -5.310
  356    HE   ARG  42           HE       ARG  42  -2.549 -11.073  -6.135
  357   HH11  ARG  42          2HH1      ARG  42  -4.069 -13.879  -4.648
  358   HH12  ARG  42          1HH1      ARG  42  -2.911 -15.011  -5.309
  359   HH21  ARG  42          2HH2      ARG  42  -1.082 -12.558  -7.036
  360   HH22  ARG  42          1HH2      ARG  42  -1.218 -14.262  -6.662
  361    H    LYS  43           HN       LYS  43  -2.406  -9.156  -1.571
  362    HA   LYS  43           HA       LYS  43  -3.682 -11.167   0.122
  363    HB2  LYS  43           2HB      LYS  43  -2.629 -12.110  -2.217
  364    HB3  LYS  43           3HB      LYS  43  -1.210 -12.203  -1.146
  365    HG2  LYS  43           2HG      LYS  43  -3.909 -13.507  -0.690
  366    HG3  LYS  43           3HG      LYS  43  -2.399 -14.319  -1.168
  367    HD2  LYS  43           2HD      LYS  43  -1.361 -13.681   0.941
  368    HD3  LYS  43           3HD      LYS  43  -2.831 -12.798   1.417
  369    HE2  LYS  43           2HE      LYS  43  -4.087 -14.963   1.256
  370    HE3  LYS  43           3HE      LYS  43  -2.533 -15.783   0.994
  371    HZ1  LYS  43           3HZ      LYS  43  -3.252 -14.190   3.364
  372    HZ2  LYS  43           1HZ      LYS  43  -3.189 -15.836   3.295
  373    HZ3  LYS  43           2HZ      LYS  43  -1.809 -14.951   3.121
  374    H    VAL  44           HN       VAL  44  -2.750 -11.215   2.098
  375    HA   VAL  44           HA       VAL  44  -0.048  -9.981   2.366
  376    HB   VAL  44           HB       VAL  44  -2.185 -10.293   4.513
  377   HG11  VAL  44          1HG1      VAL  44  -0.737  -8.816   5.844
  378   HG12  VAL  44          2HG1      VAL  44   0.108 -10.311   5.378
  379   HG13  VAL  44          3HG1      VAL  44   0.449  -8.789   4.521
  380   HG21  VAL  44          3HG2      VAL  44  -2.884  -8.670   2.821
  381   HG22  VAL  44          1HG2      VAL  44  -2.484  -7.859   4.352
  382   HG23  VAL  44          2HG2      VAL  44  -1.336  -7.810   2.995
  383    H    ALA  45           HN       ALA  45   1.579 -11.304   3.076
  384    HA   ALA  45           HA       ALA  45   1.070 -14.101   3.390
  385    HB1  ALA  45           1HB      ALA  45   3.442 -14.245   4.029
  386    HB2  ALA  45           2HB      ALA  45   3.218 -13.222   2.590
  387    HB3  ALA  45           3HB      ALA  45   3.507 -12.474   4.179
  388    HA   PRO  46           HA       PRO  46  -0.313 -14.441   7.528
  389    HB2  PRO  46           2HB      PRO  46   1.428 -16.891   7.730
  390    HB3  PRO  46           3HB      PRO  46  -0.344 -16.697   7.937
  391    HG2  PRO  46           2HG      PRO  46   0.701 -17.843   5.775
  392    HG3  PRO  46           3HG      PRO  46  -0.804 -16.869   5.701
  393    HD2  PRO  46           2HD      PRO  46   2.007 -16.211   4.843
  394    HD3  PRO  46           3HD      PRO  46   0.445 -15.705   4.132
  395    H    LEU  47           HN       LEU  47   3.122 -14.701   6.806
  396    HA   LEU  47           HA       LEU  47   3.878 -14.415   9.624
  397    HB2  LEU  47           2HB      LEU  47   5.047 -15.812   7.785
  398    HB3  LEU  47           3HB      LEU  47   5.726 -14.256   7.250
  399    HG   LEU  47           HG       LEU  47   6.679 -13.962   9.536
  400   HD11  LEU  47          1HD1      LEU  47   6.835 -15.933  11.004
  401   HD12  LEU  47          2HD1      LEU  47   5.144 -15.444  10.749
  402   HD13  LEU  47          3HD1      LEU  47   5.805 -16.850   9.879
  403   HD21  LEU  47          3HD2      LEU  47   8.023 -14.805   7.668
  404   HD22  LEU  47          1HD2      LEU  47   8.520 -15.558   9.201
  405   HD23  LEU  47          2HD2      LEU  47   7.517 -16.469   8.048
  406    H    GLY  48           HN       GLY  48   2.841 -12.337   7.212
  407    HA2  GLY  48           1HA      GLY  48   2.616 -10.008   7.664
  408    HA3  GLY  48           2HA      GLY  48   4.098 -10.068   8.645
  409    H    ASP  49           HN       ASP  49   5.396 -11.727   6.472
  410    HA   ASP  49           HA       ASP  49   5.771  -9.592   4.433
  411    HB2  ASP  49           2HB      ASP  49   7.561  -9.295   6.053
  412    HB3  ASP  49           3HB      ASP  49   7.940 -11.031   6.007
  413    HD2  ASP  49           2HD      ASP  49   9.739 -10.692   3.050
  414    HA   PRO  50           HA       PRO  50   6.244  -9.252   2.775
  415    HB2  PRO  50           2HB      PRO  50   6.084  -9.338   0.064
  416    HB3  PRO  50           3HB      PRO  50   7.570  -9.857   0.927
  417    HG2  PRO  50           2HG      PRO  50   5.454 -11.514  -0.320
  418    HG3  PRO  50           3HG      PRO  50   7.224 -11.800  -0.249
  419    HD2  PRO  50           2HD      PRO  50   5.199 -12.902   1.438
  420    HD3  PRO  50           3HD      PRO  50   6.969 -12.979   1.695
  421    H    ILE  51           HN       ILE  51   4.777  -7.919   1.067
  422    HA   ILE  51           HA       ILE  51   1.995  -8.919   1.438
  423    HB   ILE  51           HB       ILE  51   2.944  -6.026   1.289
  424   HG12  ILE  51          2HG1      ILE  51   1.825  -6.059   3.657
  425   HG13  ILE  51          3HG1      ILE  51   2.151  -7.807   3.578
  426   HG21  ILE  51          1HG2      ILE  51   0.601  -5.449   1.790
  427   HG22  ILE  51          2HG2      ILE  51   0.734  -6.362   0.269
  428   HG23  ILE  51          3HG2      ILE  51   0.170  -7.174   1.749
  429   HD11  ILE  51          3HD1      ILE  51   4.211  -5.601   3.335
  430   HD12  ILE  51          1HD1      ILE  51   3.947  -6.619   4.766
  431   HD13  ILE  51          2HD1      ILE  51   4.536  -7.349   3.259
  432    H    GLN  52           HN       GLN  52   0.832  -9.265  -0.363
  433    HA   GLN  52           HA       GLN  52   1.989  -8.416  -2.941
  434    HB2  GLN  52           2HB      GLN  52  -0.141 -10.404  -2.157
  435    HB3  GLN  52           3HB      GLN  52   0.044  -9.850  -3.838
  436    HG2  GLN  52           2HG      GLN  52   1.222 -11.890  -3.663
  437    HG3  GLN  52           3HG      GLN  52   2.442 -10.599  -3.712
  438   HE21  GLN  52          1HE2      GLN  52   4.059 -11.785  -2.732
  439   HE22  GLN  52          2HE2      GLN  52   4.004 -12.241  -1.042
  440    H    ILE  53           HN       ILE  53   1.437  -6.478  -3.617
  441    HA   ILE  53           HA       ILE  53  -1.409  -5.660  -3.314
  442    HB   ILE  53           HB       ILE  53  -0.548  -3.293  -3.402
  443   HG12  ILE  53          2HG1      ILE  53   2.133  -4.635  -2.931
  444   HG13  ILE  53          3HG1      ILE  53   1.631  -3.822  -4.434
  445   HG21  ILE  53          1HG2      ILE  53   0.164  -3.232  -1.047
  446   HG22  ILE  53          2HG2      ILE  53  -1.201  -4.348  -1.284
  447   HG23  ILE  53          3HG2      ILE  53   0.449  -4.988  -1.088
  448   HD11  ILE  53          3HD1      ILE  53   1.952  -2.511  -1.724
  449   HD12  ILE  53          1HD1      ILE  53   3.088  -2.375  -3.082
  450   HD13  ILE  53          2HD1      ILE  53   1.451  -1.700  -3.227
  451    H    ASN  54           HN       ASN  54  -2.408  -4.730  -5.105
  452    HA   ASN  54           HA       ASN  54  -0.863  -5.023  -7.627
  453    HB2  ASN  54           2HB      ASN  54  -3.021  -6.311  -7.310
  454    HB3  ASN  54           3HB      ASN  54  -3.866  -4.747  -7.315
  455   HD21  ASN  54          1HD2      ASN  54  -2.072  -7.095  -9.222
  456   HD22  ASN  54          2HD2      ASN  54  -2.467  -6.422 -10.790
  457    H    VAL  55           HN       VAL  55  -0.010  -3.223  -8.366
  458    HA   VAL  55           HA       VAL  55  -1.516  -0.682  -7.980
  459    HB   VAL  55           HB       VAL  55   1.507  -1.051  -7.961
  460   HG11  VAL  55          1HG1      VAL  55   1.591   1.332  -7.350
  461   HG12  VAL  55          2HG1      VAL  55   0.813   1.091  -8.930
  462   HG13  VAL  55          3HG1      VAL  55  -0.178   1.429  -7.491
  463   HG21  VAL  55          3HG2      VAL  55   0.474  -1.907  -5.912
  464   HG22  VAL  55          1HG2      VAL  55   1.393  -0.419  -5.588
  465   HG23  VAL  55          2HG2      VAL  55  -0.382  -0.362  -5.690
  466    H    ARG  56           HN       ARG  56  -2.171   0.115  -9.859
  467    HA   ARG  56           HA       ARG  56  -2.204   0.771 -12.042
  468    HB2  ARG  56           2HB      ARG  56   0.803   0.355 -11.940
  469    HB3  ARG  56           3HB      ARG  56  -0.094   1.270 -13.175
  470    HG2  ARG  56           2HG      ARG  56  -0.843   2.843 -11.400
  471    HG3  ARG  56           3HG      ARG  56   0.181   1.965 -10.238
  472    HD2  ARG  56           2HD      ARG  56   2.157   2.455 -11.637
  473    HD3  ARG  56           3HD      ARG  56   1.124   3.369 -12.757
  474    HE   ARG  56           HE       ARG  56   1.140   4.217  -9.932
  475   HH11  ARG  56          2HH1      ARG  56   2.117   4.754 -13.267
  476   HH12  ARG  56          1HH1      ARG  56   2.653   6.394 -12.981
  477   HH21  ARG  56          2HH2      ARG  56   1.892   6.345  -9.557
  478   HH22  ARG  56          1HH2      ARG  56   2.526   7.295 -10.882
  479    H    GLY  57           HN       GLY  57  -2.406  -2.104 -11.288
  480    HA2  GLY  57           1HA      GLY  57  -3.016  -3.873 -12.723
  481    HA3  GLY  57           2HA      GLY  57  -2.026  -3.161 -14.017
  482    H    TYR  58           HN       TYR  58   0.113  -2.829 -11.767
  483    HA   TYR  58           HA       TYR  58   1.339  -5.450 -12.326
  484    HB2  TYR  58           2HB      TYR  58   2.271  -2.773 -12.029
  485    HB3  TYR  58           3HB      TYR  58   2.974  -3.721 -10.707
  486    HD1  TYR  58           2HD      TYR  58   4.514  -5.573 -11.189
  487    HD2  TYR  58           1HD      TYR  58   2.873  -3.224 -14.343
  488    HE1  TYR  58           2HE      TYR  58   6.190  -6.479 -12.735
  489    HE2  TYR  58           1HE      TYR  58   4.543  -4.135 -15.890
  490    HH   TYR  58           HH       TYR  58   6.995  -6.492 -14.860
  491    H    GLU  59           HN       GLU  59   1.515  -7.043 -10.864
  492    HA   GLU  59           HA       GLU  59   0.589  -6.443  -8.120
  493    HB2  GLU  59           2HB      GLU  59  -0.437  -8.311  -9.373
  494    HB3  GLU  59           3HB      GLU  59   1.155  -9.103  -9.443
  495    HG2  GLU  59           2HG      GLU  59   1.192  -9.454  -7.104
  496    HG3  GLU  59           3HG      GLU  59  -0.183  -8.360  -6.843
  497    HE2  GLU  59           2HE      GLU  59  -0.928 -12.058  -8.096
  498    H    LEU  60           HN       LEU  60   1.966  -6.078  -6.594
  499    HA   LEU  60           HA       LEU  60   4.803  -6.863  -7.055
  500    HB2  LEU  60           2HB      LEU  60   3.723  -4.469  -5.536
  501    HB3  LEU  60           3HB      LEU  60   5.431  -4.840  -5.869
  502    HG   LEU  60           HG       LEU  60   3.342  -4.175  -7.960
  503   HD11  LEU  60          1HD1      LEU  60   4.529  -2.029  -8.159
  504   HD12  LEU  60          2HD1      LEU  60   3.858  -2.253  -6.526
  505   HD13  LEU  60          3HD1      LEU  60   5.597  -2.497  -6.815
  506   HD21  LEU  60          3HD2      LEU  60   5.130  -5.642  -8.783
  507   HD22  LEU  60          1HD2      LEU  60   5.272  -4.011  -9.479
  508   HD23  LEU  60          2HD2      LEU  60   6.354  -4.510  -8.158
  509    H    SER  61           HN       SER  61   5.998  -7.651  -5.357
  510    HA   SER  61           HA       SER  61   4.501  -8.107  -2.820
  511    HB2  SER  61           2HB      SER  61   6.848  -9.648  -3.989
  512    HB3  SER  61           3HB      SER  61   6.052  -9.985  -2.433
  513    HG   SER  61           HG       SER  61   5.257 -11.302  -4.144
  514    H    LEU  62           HN       LEU  62   5.027  -6.595  -1.380
  515    HA   LEU  62           HA       LEU  62   7.790  -5.512  -1.467
  516    HB2  LEU  62           2HB      LEU  62   5.126  -4.383  -0.741
  517    HB3  LEU  62           3HB      LEU  62   6.548  -3.787   0.148
  518    HG   LEU  62           HG       LEU  62   6.157  -3.705  -2.854
  519   HD11  LEU  62          1HD1      LEU  62   6.004  -1.268  -2.525
  520   HD12  LEU  62          2HD1      LEU  62   4.716  -2.123  -1.647
  521   HD13  LEU  62          3HD1      LEU  62   6.130  -1.498  -0.766
  522   HD21  LEU  62          3HD2      LEU  62   8.507  -3.993  -2.204
  523   HD22  LEU  62          1HD2      LEU  62   8.219  -2.361  -2.850
  524   HD23  LEU  62          2HD2      LEU  62   8.375  -2.608  -1.094
  525    H    ARG  63           HN       ARG  63   8.934  -5.115   0.430
  526    HA   ARG  63           HA       ARG  63   8.767  -7.163   2.411
  527    HB2  ARG  63           2HB      ARG  63  10.491  -4.949   1.704
  528    HB3  ARG  63           3HB      ARG  63  10.218  -4.980   3.462
  529    HG2  ARG  63           2HG      ARG  63  12.237  -6.215   2.806
  530    HG3  ARG  63           3HG      ARG  63  11.027  -7.264   3.582
  531    HD2  ARG  63           2HD      ARG  63  10.888  -7.075   0.624
  532    HD3  ARG  63           3HD      ARG  63  12.323  -7.887   1.287
  533    HE   ARG  63           HE       ARG  63   9.861  -8.826   2.481
  534   HH11  ARG  63          2HH1      ARG  63  11.946  -9.087  -0.347
  535   HH12  ARG  63          1HH1      ARG  63  11.471 -10.732  -0.705
  536   HH21  ARG  63          2HH2      ARG  63   9.281 -10.991   2.031
  537   HH22  ARG  63          1HH2      ARG  63   9.959 -11.809   0.643
  538    H    LYS  64           HN       LYS  64   8.141  -7.091   4.549
  539    HA   LYS  64           HA       LYS  64   5.816  -5.673   5.226
  540    HB2  LYS  64           2HB      LYS  64   6.723  -7.752   6.304
  541    HB3  LYS  64           3HB      LYS  64   7.923  -6.736   7.138
  542    HG2  LYS  64           2HG      LYS  64   4.978  -6.196   7.431
  543    HG3  LYS  64           3HG      LYS  64   5.776  -7.465   8.391
  544    HD2  LYS  64           2HD      LYS  64   6.538  -4.528   8.320
  545    HD3  LYS  64           3HD      LYS  64   5.664  -5.357   9.631
  546    HE2  LYS  64           2HE      LYS  64   7.624  -6.844   9.957
  547    HE3  LYS  64           3HE      LYS  64   8.495  -5.936   8.702
  548    HZ1  LYS  64           3HZ      LYS  64   7.476  -4.822  11.226
  549    HZ2  LYS  64           1HZ      LYS  64   9.052  -5.175  10.899
  550    HZ3  LYS  64           2HZ      LYS  64   8.286  -3.979  10.062
  551    H    SER  65           HN       SER  65   9.243  -4.916   5.865
  552    HA   SER  65           HA       SER  65   8.793  -2.696   7.568
  553    HB2  SER  65           2HB      SER  65  11.101  -3.208   5.658
  554    HB3  SER  65           3HB      SER  65  11.113  -2.100   7.052
  555    HG   SER  65           HG       SER  65  12.029  -4.153   7.540
  556    H    ALA  66           HN       ALA  66   8.777  -2.977   4.034
  557    HA   ALA  66           HA       ALA  66   8.903  -0.113   3.619
  558    HB1  ALA  66           1HB      ALA  66   8.400  -0.661   1.270
  559    HB2  ALA  66           2HB      ALA  66   9.697  -1.694   1.915
  560    HB3  ALA  66           3HB      ALA  66   8.047  -2.340   1.740
  561    H    ALA  67           HN       ALA  67   6.357  -2.547   3.945
  562    HA   ALA  67           HA       ALA  67   4.231  -0.843   3.036
  563    HB1  ALA  67           1HB      ALA  67   2.748  -2.556   4.001
  564    HB2  ALA  67           2HB      ALA  67   4.052  -3.292   3.041
  565    HB3  ALA  67           3HB      ALA  67   4.142  -3.300   4.818
  566    H    GLU  68           HN       GLU  68   5.973  -1.139   6.028
  567    HA   GLU  68           HA       GLU  68   4.014   0.012   7.772
  568    HB2  GLU  68           2HB      GLU  68   7.049   0.059   7.885
  569    HB3  GLU  68           3HB      GLU  68   5.964   0.534   9.214
  570    HG2  GLU  68           2HG      GLU  68   5.087  -1.743   9.323
  571    HG3  GLU  68           3HG      GLU  68   6.143  -2.223   7.977
  572    HE2  GLU  68           2HE      GLU  68   8.816  -2.653  10.094
  573    H    MET  69           HN       MET  69   6.283   1.326   5.441
  574    HA   MET  69           HA       MET  69   6.210   4.002   6.607
  575    HB2  MET  69           2HB      MET  69   7.389   3.008   3.993
  576    HB3  MET  69           3HB      MET  69   7.664   4.605   4.731
  577    HG2  MET  69           2HG      MET  69   8.486   1.926   5.880
  578    HG3  MET  69           3HG      MET  69   9.555   3.114   5.117
  579    HE1  MET  69           3HE      MET  69  11.075   2.848   7.338
  580    HE2  MET  69           1HE      MET  69  10.472   3.165   8.980
  581    HE3  MET  69           2HE      MET  69   9.868   1.763   8.068
  582    H    ILE  70           HN       ILE  70   4.385   2.192   4.302
  583    HA   ILE  70           HA       ILE  70   3.524   4.549   2.818
  584    HB   ILE  70           HB       ILE  70   2.394   1.723   2.760
  585   HG12  ILE  70          2HG1      ILE  70   4.481   3.025   0.980
  586   HG13  ILE  70          3HG1      ILE  70   4.812   1.809   2.237
  587   HG21  ILE  70          1HG2      ILE  70   1.529   2.392   0.552
  588   HG22  ILE  70          2HG2      ILE  70   0.891   3.439   1.841
  589   HG23  ILE  70          3HG2      ILE  70   2.198   4.025   0.785
  590   HD11  ILE  70          3HD1      ILE  70   3.122   1.391  -0.240
  591   HD12  ILE  70          1HD1      ILE  70   4.776   0.790  -0.001
  592   HD13  ILE  70          2HD1      ILE  70   3.456   0.176   1.017
  593    H    GLU  71           HN       GLU  71   2.251   5.972   3.784
  594    HA   GLU  71           HA       GLU  71   0.255   5.109   5.772
  595    HB2  GLU  71           2HB      GLU  71   1.613   7.109   6.185
  596    HB3  GLU  71           3HB      GLU  71   1.017   7.837   4.675
  597    HG2  GLU  71           2HG      GLU  71  -0.288   8.890   6.241
  598    HG3  GLU  71           3HG      GLU  71  -1.328   7.529   5.771
  599    HE2  GLU  71           2HE      GLU  71   0.446   7.202   9.324
  600    H    VAL  72           HN       VAL  72  -1.661   4.408   5.068
  601    HA   VAL  72           HA       VAL  72  -2.723   5.647   2.584
  602    HB   VAL  72           HB       VAL  72  -3.847   3.467   2.113
  603   HG11  VAL  72          1HG1      VAL  72  -1.849   2.315   1.263
  604   HG12  VAL  72          2HG1      VAL  72  -1.759   4.069   0.984
  605   HG13  VAL  72          3HG1      VAL  72  -0.823   3.327   2.304
  606   HG21  VAL  72          3HG2      VAL  72  -3.842   2.556   4.389
  607   HG22  VAL  72          1HG2      VAL  72  -3.065   1.429   3.252
  608   HG23  VAL  72          2HG2      VAL  72  -2.067   2.423   4.339
  609    H    GLU  73           HN       GLU  73  -5.062   5.541   2.347
  610    HA   GLU  73           HA       GLU  73  -6.435   5.613   4.991
  611    HB2  GLU  73           2HB      GLU  73  -8.088   7.055   3.985
  612    HB3  GLU  73           3HB      GLU  73  -6.473   7.736   3.678
  613    HG2  GLU  73           2HG      GLU  73  -6.510   7.017   1.408
  614    HG3  GLU  73           3HG      GLU  73  -7.972   6.043   1.675
  615    HE2  GLU  73           2HE      GLU  73 -10.032   8.851   1.433
  616    H    LEU  74           HN       LEU  74  -8.303   4.368   5.274
  617    HA   LEU  74           HA       LEU  74  -8.678   2.166   3.427
  618    HB2  LEU  74           2HB      LEU  74  -9.187   2.483   6.049
  619    HB3  LEU  74           3HB      LEU  74 -10.795   2.879   5.394
  620    HG   LEU  74           HG       LEU  74 -10.691   0.550   6.046
  621   HD11  LEU  74          1HD1      LEU  74 -11.389  -0.512   3.941
  622   HD12  LEU  74          2HD1      LEU  74 -12.068   1.123   4.105
  623   HD13  LEU  74          3HD1      LEU  74 -10.679   0.839   3.028
  624   HD21  LEU  74          3HD2      LEU  74  -8.273   0.211   5.823
  625   HD22  LEU  74          1HD2      LEU  74  -9.174  -1.042   4.940
  626   HD23  LEU  74          2HD2      LEU  74  -8.419   0.299   4.051
  627    H    GLU  75           HN       GLU  75  -9.588   2.439   1.498
  628    HA   GLU  75           HA       GLU  75 -10.826   4.851   0.710
  629    HB2  GLU  75           2HB      GLU  75  -9.985   2.429  -0.504
  630    HB3  GLU  75           3HB      GLU  75 -11.683   2.685  -0.972
  631    HG2  GLU  75           2HG      GLU  75  -9.425   4.674  -1.317
  632    HG3  GLU  75           3HG      GLU  75 -10.118   3.650  -2.594
  633    HE2  GLU  75           2HE      GLU  75 -12.117   6.873  -1.448
  634    H    HIS  76           HN       HIS  76 -12.960   5.227  -0.081
  635    HA   HIS  76           HA       HIS  76 -14.986   4.550   1.787
  636    HB2  HIS  76           2HB      HIS  76 -15.301   5.554  -1.065
  637    HB3  HIS  76           3HB      HIS  76 -16.512   5.648   0.227
  638    HD1  HIS  76           1HD      HIS  76 -13.674   7.454  -1.249
  639    HD2  HIS  76           2HD      HIS  76 -15.709   7.441   2.399
  640    HE1  HIS  76           1HE      HIS  76 -13.007   9.588  -0.058
  641    HE2  HIS  76           2HE      HIS  76 -14.239   9.577   2.163
  642    H    HIS  77           HN       HIS  77 -15.803   2.581   2.092
  643    HA   HIS  77           HA       HIS  77 -15.600   0.598  -0.047
  644    HB2  HIS  77           2HB      HIS  77 -16.373  -1.008   1.629
  645    HB3  HIS  77           3HB      HIS  77 -15.003  -0.049   2.220
  646    HD1  HIS  77           1HD      HIS  77 -18.668  -0.681   2.796
  647    HD2  HIS  77           2HD      HIS  77 -15.555   1.582   4.425
  648    HE1  HIS  77           1HE      HIS  77 -19.505   0.165   5.035
  649    HE2  HIS  77           2HE      HIS  77 -17.612   1.538   6.015
  650    H    HIS  78           HN       HIS  78 -17.568   2.965   0.040
  651    HA   HIS  78           HA       HIS  78 -19.552   3.360  -0.988
  652    HB2  HIS  78           2HB      HIS  78 -19.547   0.371  -1.497
  653    HB3  HIS  78           3HB      HIS  78 -20.785   1.483  -2.113
  654    HD1  HIS  78           1HD      HIS  78 -20.348   2.437  -4.355
  655    HD2  HIS  78           2HD      HIS  78 -16.834   1.154  -2.493
  656    HE1  HIS  78           1HE      HIS  78 -18.493   2.746  -6.054
  657    HE2  HIS  78           2HE      HIS  78 -16.362   1.969  -4.915
  658    H    HIS  79           HN       HIS  79 -21.800   3.360  -0.612
  659    HA   HIS  79           HA       HIS  79 -23.624   3.384   0.741
  660    HB2  HIS  79           2HB      HIS  79 -23.555   0.924   0.314
  661    HB3  HIS  79           3HB      HIS  79 -22.626   0.730   1.812
  662    HD1  HIS  79           1HD      HIS  79 -23.982   0.252   3.836
  663    HD2  HIS  79           2HD      HIS  79 -26.198   2.212   0.889
  664    HE1  HIS  79           1HE      HIS  79 -26.356   0.388   4.710
  665    HE2  HIS  79           2HE      HIS  79 -27.697   1.579   2.915
  666    H    HIS  80           HN       HIS  80 -22.277   5.177   1.669
  667    HA   HIS  80           HA       HIS  80 -21.502   4.671   4.482
  668    HB2  HIS  80           2HB      HIS  80 -20.069   6.067   2.966
  669    HB3  HIS  80           3HB      HIS  80 -21.400   7.235   2.856
  670    HD1  HIS  80           1HD      HIS  80 -18.807   5.897   5.260
  671    HD2  HIS  80           2HD      HIS  80 -21.673   8.931   5.050
  672    HE1  HIS  80           1HE      HIS  80 -18.361   7.432   7.228
  673    HE2  HIS  80           2HE      HIS  80 -20.103   9.271   7.094
  674    H    HIS  81           HN       HIS  81 -24.074   5.725   2.498
  675    HA   HIS  81           HA       HIS  81 -25.607   6.582   4.905
  676    HB2  HIS  81           2HB      HIS  81 -25.221   8.528   3.510
  677    HB3  HIS  81           3HB      HIS  81 -25.739   7.645   2.062
  678    HD1  HIS  81           1HD      HIS  81 -27.042   9.469   5.061
  679    HD2  HIS  81           2HD      HIS  81 -28.539   7.345   1.790
  680    HE1  HIS  81           1HE      HIS  81 -29.522   9.965   4.971
  681    HE2  HIS  81           2HE      HIS  81 -30.427   8.675   2.983
  Start of MODEL    7
    1    H1   MET   1           HN       MET   1  -2.665   6.261  12.416
    2    HA   MET   1           HA       MET   1  -1.819   7.168   9.862
    3    HB2  MET   1           2HB      MET   1   0.389   7.427  10.934
    4    HB3  MET   1           3HB      MET   1   0.353   5.712  11.411
    5    HG2  MET   1           2HG      MET   1   0.324   5.049   9.056
    6    HG3  MET   1           3HG      MET   1   0.320   6.749   8.563
    7    HE1  MET   1           3HE      MET   1   2.376   3.761   9.979
    8    HE2  MET   1           1HE      MET   1   3.875   4.535  10.539
    9    HE3  MET   1           2HE      MET   1   2.348   4.837  11.396
   10    H    PHE   2           HN       PHE   2  -3.097   5.849   8.717
   11    HA   PHE   2           HA       PHE   2  -3.369   3.032   9.495
   12    HB2  PHE   2           2HB      PHE   2  -5.250   4.469   8.557
   13    HB3  PHE   2           3HB      PHE   2  -4.414   4.391   6.996
   14    HD1  PHE   2           1HD      PHE   2  -4.248   2.250   5.785
   15    HD2  PHE   2           2HD      PHE   2  -6.428   2.571   9.430
   16    HE1  PHE   2           1HE      PHE   2  -5.362   0.116   5.305
   17    HE2  PHE   2           2HE      PHE   2  -7.544   0.437   8.953
   18    HZ   PHE   2           HZ       PHE   2  -7.011  -0.797   6.891
   19    H    SER   3           HN       SER   3  -1.700   1.752   9.065
   20    HA   SER   3           HA       SER   3   0.244   2.492   7.041
   21    HB2  SER   3           2HB      SER   3   0.957   1.536   9.173
   22    HB3  SER   3           3HB      SER   3   0.007   0.064   8.857
   23    HG   SER   3           HG       SER   3   2.229  -0.182   8.335
   24    H    LEU   4           HN       LEU   4   0.855   1.309   5.214
   25    HA   LEU   4           HA       LEU   4  -1.248   0.021   3.756
   26    HB2  LEU   4           2HB      LEU   4   0.684   1.241   2.761
   27    HB3  LEU   4           3HB      LEU   4   1.749  -0.081   3.297
   28    HG   LEU   4           HG       LEU   4   0.480  -1.640   1.845
   29   HD11  LEU   4          1HD1      LEU   4  -1.037  -0.726   0.138
   30   HD12  LEU   4          2HD1      LEU   4  -1.646  -0.418   1.780
   31   HD13  LEU   4          3HD1      LEU   4  -0.869   0.891   0.858
   32   HD21  LEU   4          3HD2      LEU   4   2.554  -0.585   1.062
   33   HD22  LEU   4          1HD2      LEU   4   1.414  -0.824  -0.282
   34   HD23  LEU   4          2HD2      LEU   4   1.621   0.792   0.430
   35    H    ARG   5           HN       ARG   5   1.237  -1.057   5.963
   36    HA   ARG   5           HA       ARG   5   0.909  -3.894   5.319
   37    HB2  ARG   5           2HB      ARG   5   2.986  -2.573   6.203
   38    HB3  ARG   5           3HB      ARG   5   2.199  -2.748   7.790
   39    HG2  ARG   5           2HG      ARG   5   2.654  -5.159   6.081
   40    HG3  ARG   5           3HG      ARG   5   4.003  -4.453   7.002
   41    HD2  ARG   5           2HD      ARG   5   1.350  -5.342   8.170
   42    HD3  ARG   5           3HD      ARG   5   2.862  -6.272   8.223
   43    HE   ARG   5           HE       ARG   5   3.798  -4.300   9.517
   44   HH11  ARG   5          2HH1      ARG   5   0.352  -5.005   9.450
   45   HH12  ARG   5          1HH1      ARG   5   0.049  -4.315  11.029
   46   HH21  ARG   5          2HH2      ARG   5   3.411  -3.428  11.584
   47   HH22  ARG   5          1HH2      ARG   5   1.788  -3.419  12.242
   48    H    ASP   6           HN       ASP   6  -0.757  -1.522   7.076
   49    HA   ASP   6           HA       ASP   6  -1.839  -3.398   9.085
   50    HB2  ASP   6           2HB      ASP   6  -1.200  -1.063   9.701
   51    HB3  ASP   6           3HB      ASP   6  -2.449  -0.459   8.591
   52    HD2  ASP   6           2HD      ASP   6  -4.929  -0.966  10.927
   53    H    ALA   7           HN       ALA   7  -2.551  -2.075   5.974
   54    HA   ALA   7           HA       ALA   7  -5.395  -2.312   6.001
   55    HB1  ALA   7           1HB      ALA   7  -5.192  -2.280   3.546
   56    HB2  ALA   7           2HB      ALA   7  -4.160  -1.042   4.297
   57    HB3  ALA   7           3HB      ALA   7  -3.439  -2.552   3.688
   58    H    LYS   8           HN       LYS   8  -6.756  -3.947   5.153
   59    HA   LYS   8           HA       LYS   8  -5.621  -6.630   5.634
   60    HB2  LYS   8           2HB      LYS   8  -8.517  -5.889   5.155
   61    HB3  LYS   8           3HB      LYS   8  -7.871  -7.373   5.893
   62    HG2  LYS   8           2HG      LYS   8  -7.806  -4.585   7.074
   63    HG3  LYS   8           3HG      LYS   8  -8.837  -5.940   7.591
   64    HD2  LYS   8           2HD      LYS   8  -6.859  -7.217   8.249
   65    HD3  LYS   8           3HD      LYS   8  -5.806  -5.897   7.688
   66    HE2  LYS   8           2HE      LYS   8  -6.067  -5.793  10.106
   67    HE3  LYS   8           3HE      LYS   8  -6.839  -4.385   9.342
   68    HZ1  LYS   8           3HZ      LYS   8  -8.233  -6.799  10.291
   69    HZ2  LYS   8           1HZ      LYS   8  -8.219  -5.337  11.051
   70    HZ3  LYS   8           2HZ      LYS   8  -8.949  -5.494   9.582
   71    H    CYS   9           HN       CYS   9  -5.610  -8.266   4.139
   72    HA   CYS   9           HA       CYS   9  -5.563  -7.564   1.381
   73    HB2  CYS   9           2HB      CYS   9  -5.684 -10.133   1.122
   74    HB3  CYS   9           3HB      CYS   9  -4.273  -9.403   1.927
   75    HG   CYS   9           HG       CYS   9  -4.874 -11.675   3.070
   76    H    GLY  10           HN       GLY  10  -7.096  -7.415  -0.114
   77    HA2  GLY  10           1HA      GLY  10  -9.173  -8.248  -1.070
   78    HA3  GLY  10           2HA      GLY  10  -9.778  -8.504   0.582
   79    H    GLN  11           HN       GLN  11  -8.229  -5.751   1.050
   80    HA   GLN  11           HA       GLN  11 -10.601  -4.137   0.272
   81    HB2  GLN  11           2HB      GLN  11  -8.504  -3.597   2.398
   82    HB3  GLN  11           3HB      GLN  11  -9.917  -2.576   2.036
   83    HG2  GLN  11           2HG      GLN  11 -11.347  -4.599   2.603
   84    HG3  GLN  11           3HG      GLN  11  -9.866  -5.343   3.244
   85   HE21  GLN  11          1HE2      GLN  11 -12.292  -2.851   3.669
   86   HE22  GLN  11          2HE2      GLN  11 -11.848  -2.410   5.303
   87    H    THR  12           HN       THR  12 -10.276  -1.951  -0.435
   88    HA   THR  12           HA       THR  12  -7.671  -1.591  -1.824
   89    HB   THR  12           HB       THR  12 -10.349  -0.285  -2.452
   90    HG1  THR  12           1HG      THR  12 -10.332  -1.773  -4.223
   91   HG21  THR  12          3HG2      THR  12  -7.745  -0.409  -4.016
   92   HG22  THR  12          1HG2      THR  12  -9.256   0.346  -4.575
   93   HG23  THR  12          2HG2      THR  12  -8.390   1.020  -3.175
   94    H    VAL  13           HN       VAL  13  -6.394   0.038  -1.235
   95    HA   VAL  13           HA       VAL  13  -7.579   2.168   0.478
   96    HB   VAL  13           HB       VAL  13  -5.384   2.369   1.589
   97   HG11  VAL  13          1HG1      VAL  13  -5.464   0.294   2.905
   98   HG12  VAL  13          2HG1      VAL  13  -7.095   0.927   2.585
   99   HG13  VAL  13          3HG1      VAL  13  -6.479  -0.458   1.653
  100   HG21  VAL  13          3HG2      VAL  13  -3.970   1.564  -0.245
  101   HG22  VAL  13          1HG2      VAL  13  -3.641   0.665   1.255
  102   HG23  VAL  13          2HG2      VAL  13  -4.618  -0.080  -0.031
  103    H    LYS  14           HN       LYS  14  -5.898   4.114   0.516
  104    HA   LYS  14           HA       LYS  14  -4.722   4.449  -2.197
  105    HB2  LYS  14           2HB      LYS  14  -6.579   6.256  -0.693
  106    HB3  LYS  14           3HB      LYS  14  -5.293   6.982  -1.685
  107    HG2  LYS  14           2HG      LYS  14  -6.134   5.758  -3.646
  108    HG3  LYS  14           3HG      LYS  14  -7.440   5.077  -2.646
  109    HD2  LYS  14           2HD      LYS  14  -8.136   7.055  -3.998
  110    HD3  LYS  14           3HD      LYS  14  -8.358   7.269  -2.245
  111    HE2  LYS  14           2HE      LYS  14  -6.290   8.565  -2.120
  112    HE3  LYS  14           3HE      LYS  14  -6.006   8.310  -3.856
  113    HZ1  LYS  14           3HZ      LYS  14  -8.288   9.757  -2.686
  114    HZ2  LYS  14           1HZ      LYS  14  -6.984  10.451  -3.419
  115    HZ3  LYS  14           2HZ      LYS  14  -8.025   9.522  -4.297
  116    H    VAL  15           HN       VAL  15  -2.662   5.229  -2.209
  117    HA   VAL  15           HA       VAL  15  -1.310   5.558   0.327
  118    HB   VAL  15           HB       VAL  15  -0.374   6.159  -2.507
  119   HG11  VAL  15          1HG1      VAL  15   1.896   6.189  -1.561
  120   HG12  VAL  15          2HG1      VAL  15   0.879   7.465  -0.853
  121   HG13  VAL  15          3HG1      VAL  15   1.218   5.981   0.070
  122   HG21  VAL  15          3HG2      VAL  15  -0.882   3.794  -2.113
  123   HG22  VAL  15          1HG2      VAL  15   0.869   4.048  -2.294
  124   HG23  VAL  15          2HG2      VAL  15   0.169   3.802  -0.677
  125    H    VAL  16           HN       VAL  16  -1.349   7.346   1.552
  126    HA   VAL  16           HA       VAL  16  -2.037   9.870   0.147
  127    HB   VAL  16           HB       VAL  16  -2.832  10.658   2.414
  128   HG11  VAL  16          1HG1      VAL  16  -4.988   9.483   2.248
  129   HG12  VAL  16          2HG1      VAL  16  -4.369   9.940   0.644
  130   HG13  VAL  16          3HG1      VAL  16  -4.236   8.255   1.205
  131   HG21  VAL  16          3HG2      VAL  16  -1.656   9.013   3.796
  132   HG22  VAL  16          1HG2      VAL  16  -3.410   8.948   4.084
  133   HG23  VAL  16          2HG2      VAL  16  -2.628   7.707   3.079
  134    H    LYS  17           HN       LYS  17   0.106   8.389   2.556
  135    HA   LYS  17           HA       LYS  17   1.895  10.718   2.171
  136    HB2  LYS  17           2HB      LYS  17   0.506  11.004   4.269
  137    HB3  LYS  17           3HB      LYS  17   1.320   9.557   4.909
  138    HG2  LYS  17           2HG      LYS  17   2.378  11.585   5.749
  139    HG3  LYS  17           3HG      LYS  17   3.493  10.688   4.689
  140    HD2  LYS  17           2HD      LYS  17   3.667  13.019   4.138
  141    HD3  LYS  17           3HD      LYS  17   2.806  12.205   2.810
  142    HE2  LYS  17           2HE      LYS  17   0.657  12.967   3.754
  143    HE3  LYS  17           3HE      LYS  17   1.535  13.805   5.053
  144    HZ1  LYS  17           3HZ      LYS  17   1.772  14.383   2.175
  145    HZ2  LYS  17           1HZ      LYS  17   0.947  15.295   3.273
  146    HZ3  LYS  17           2HZ      LYS  17   2.587  15.161   3.380
  147    H    LEU  18           HN       LEU  18   3.994  10.184   1.974
  148    HA   LEU  18           HA       LEU  18   4.677   7.324   2.415
  149    HB2  LEU  18           2HB      LEU  18   5.979   9.452   0.693
  150    HB3  LEU  18           3HB      LEU  18   6.576   7.787   0.891
  151    HG   LEU  18           HG       LEU  18   3.864   8.489  -0.258
  152   HD11  LEU  18          1HD1      LEU  18   4.861   8.009  -2.458
  153   HD12  LEU  18          2HD1      LEU  18   5.655   9.394  -1.674
  154   HD13  LEU  18          3HD1      LEU  18   6.453   7.803  -1.690
  155   HD21  LEU  18          3HD2      LEU  18   4.053   6.236   0.701
  156   HD22  LEU  18          1HD2      LEU  18   3.923   6.167  -1.072
  157   HD23  LEU  18          2HD2      LEU  18   5.503   5.932  -0.287
  158    H    HIS  19           HN       HIS  19   5.520   7.059   4.408
  159    HA   HIS  19           HA       HIS  19   7.206   9.177   5.557
  160    HB2  HIS  19           2HB      HIS  19   6.306   6.482   6.633
  161    HB3  HIS  19           3HB      HIS  19   7.287   7.654   7.532
  162    HD1  HIS  19           1HD      HIS  19   6.018   9.184   8.987
  163    HD2  HIS  19           2HD      HIS  19   3.675   7.722   5.854
  164    HE1  HIS  19           1HE      HIS  19   3.683  10.088   9.369
  165    HE2  HIS  19           2HE      HIS  19   2.262   9.200   7.465
  166    H    GLY  20           HN       GLY  20   9.368   8.684   6.416
  167    HA2  GLY  20           1HA      GLY  20  11.020   6.714   6.402
  168    HA3  GLY  20           2HA      GLY  20  10.730   6.719   4.648
  169    H    THR  21           HN       THR  21  13.105   6.961   4.663
  170    HA   THR  21           HA       THR  21  14.156   9.554   5.527
  171    HB   THR  21           HB       THR  21  16.303   8.596   4.524
  172    HG1  THR  21           1HG      THR  21  16.190   6.332   4.059
  173   HG21  THR  21          3HG2      THR  21  14.876   6.916   6.616
  174   HG22  THR  21          1HG2      THR  21  16.633   6.959   6.339
  175   HG23  THR  21          2HG2      THR  21  15.792   8.412   6.923
  176    H    GLY  22           HN       GLY  22  12.347   8.691   2.941
  177    HA2  GLY  22           1HA      GLY  22  11.984  10.121   1.081
  178    HA3  GLY  22           2HA      GLY  22  13.643  10.738   1.241
  179    H    ALA  23           HN       ALA  23  15.156   8.459   1.297
  180    HA   ALA  23           HA       ALA  23  15.265   7.712  -1.445
  181    HB1  ALA  23           1HB      ALA  23  16.954   6.075  -0.718
  182    HB2  ALA  23           2HB      ALA  23  17.217   7.661   0.044
  183    HB3  ALA  23           3HB      ALA  23  16.478   6.337   0.975
  184    H    LEU  24           HN       LEU  24  13.899   6.120   1.429
  185    HA   LEU  24           HA       LEU  24  13.069   3.714   0.166
  186    HB2  LEU  24           2HB      LEU  24  13.092   4.043   2.594
  187    HB3  LEU  24           3HB      LEU  24  11.805   5.263   2.448
  188    HG   LEU  24           HG       LEU  24  10.297   3.491   1.566
  189   HD11  LEU  24          1HD1      LEU  24  10.927   1.131   1.865
  190   HD12  LEU  24          2HD1      LEU  24  12.007   1.954   0.715
  191   HD13  LEU  24          3HD1      LEU  24  12.555   1.633   2.378
  192   HD21  LEU  24          3HD2      LEU  24  10.259   4.154   3.925
  193   HD22  LEU  24          1HD2      LEU  24   9.905   2.420   3.744
  194   HD23  LEU  24          2HD2      LEU  24  11.514   2.945   4.291
  195    H    LYS  25           HN       LYS  25  11.534   6.902   0.516
  196    HA   LYS  25           HA       LYS  25   9.014   6.228  -0.619
  197    HB2  LYS  25           2HB      LYS  25  10.499   8.879  -0.653
  198    HB3  LYS  25           3HB      LYS  25   8.753   8.646  -0.911
  199    HG2  LYS  25           2HG      LYS  25   8.401   8.017   1.342
  200    HG3  LYS  25           3HG      LYS  25  10.145   7.815   1.639
  201    HD2  LYS  25           2HD      LYS  25   9.291   9.884   2.648
  202    HD3  LYS  25           3HD      LYS  25  10.486  10.222   1.373
  203    HE2  LYS  25           2HE      LYS  25   8.712  10.768  -0.198
  204    HE3  LYS  25           3HE      LYS  25   7.476  10.324   1.000
  205    HZ1  LYS  25           3HZ      LYS  25   9.420  12.518   1.275
  206    HZ2  LYS  25           1HZ      LYS  25   7.820  12.690   0.914
  207    HZ3  LYS  25           2HZ      LYS  25   8.273  12.107   2.387
  208    H    ARG  26           HN       ARG  26  11.997   7.586  -2.045
  209    HA   ARG  26           HA       ARG  26  11.072   7.868  -4.696
  210    HB2  ARG  26           2HB      ARG  26  13.136   8.862  -3.874
  211    HB3  ARG  26           3HB      ARG  26  13.840   7.249  -3.610
  212    HG2  ARG  26           2HG      ARG  26  12.981   8.103  -6.362
  213    HG3  ARG  26           3HG      ARG  26  14.542   8.636  -5.690
  214    HD2  ARG  26           2HD      ARG  26  15.085   6.226  -5.243
  215    HD3  ARG  26           3HD      ARG  26  13.599   5.784  -6.110
  216    HE   ARG  26           HE       ARG  26  15.975   7.112  -7.319
  217   HH11  ARG  26          2HH1      ARG  26  12.909   5.442  -7.650
  218   HH12  ARG  26          1HH1      ARG  26  13.202   4.954  -9.305
  219   HH21  ARG  26          2HH2      ARG  26  16.413   6.377  -9.447
  220   HH22  ARG  26          1HH2      ARG  26  15.190   5.485 -10.324
  221    H    ARG  27           HN       ARG  27  12.435   5.054  -2.989
  222    HA   ARG  27           HA       ARG  27  12.639   3.406  -5.323
  223    HB2  ARG  27           2HB      ARG  27  13.879   2.964  -3.255
  224    HB3  ARG  27           3HB      ARG  27  12.350   2.649  -2.399
  225    HG2  ARG  27           2HG      ARG  27  11.934   0.700  -3.771
  226    HG3  ARG  27           3HG      ARG  27  13.374   1.046  -4.759
  227    HD2  ARG  27           2HD      ARG  27  14.808   0.732  -2.804
  228    HD3  ARG  27           3HD      ARG  27  13.382   0.433  -1.788
  229    HE   ARG  27           HE       ARG  27  13.067  -1.483  -3.630
  230   HH11  ARG  27          2HH1      ARG  27  16.048  -0.386  -2.119
  231   HH12  ARG  27          1HH1      ARG  27  16.763  -1.981  -2.065
  232   HH21  ARG  27          2HH2      ARG  27  13.977  -3.586  -3.486
  233   HH22  ARG  27          1HH2      ARG  27  15.589  -3.794  -2.840
  234    H    ILE  28           HN       ILE  28  10.091   3.847  -2.843
  235    HA   ILE  28           HA       ILE  28   8.421   1.770  -3.909
  236    HB   ILE  28           HB       ILE  28   7.717   4.136  -2.126
  237   HG12  ILE  28          2HG1      ILE  28   8.355   1.234  -1.488
  238   HG13  ILE  28          3HG1      ILE  28   9.463   2.608  -1.258
  239   HG21  ILE  28          1HG2      ILE  28   5.735   2.815  -1.500
  240   HG22  ILE  28          2HG2      ILE  28   5.731   3.204  -3.236
  241   HG23  ILE  28          3HG2      ILE  28   6.186   1.572  -2.691
  242   HD11  ILE  28          3HD1      ILE  28   6.812   2.206   0.141
  243   HD12  ILE  28          1HD1      ILE  28   8.414   1.943   0.861
  244   HD13  ILE  28          2HD1      ILE  28   7.922   3.579   0.372
  245    H    MET  29           HN       MET  29   8.601   5.295  -4.413
  246    HA   MET  29           HA       MET  29   6.323   5.486  -6.118
  247    HB2  MET  29           2HB      MET  29   8.850   7.149  -5.938
  248    HB3  MET  29           3HB      MET  29   7.472   7.555  -6.989
  249    HG2  MET  29           2HG      MET  29   6.016   7.631  -4.981
  250    HG3  MET  29           3HG      MET  29   7.439   7.335  -3.968
  251    HE1  MET  29           3HE      MET  29   9.679   9.036  -5.501
  252    HE2  MET  29           1HE      MET  29   9.586  10.577  -4.618
  253    HE3  MET  29           2HE      MET  29   9.474   9.039  -3.733
  254    H    ASP  30           HN       ASP  30   9.600   4.388  -6.607
  255    HA   ASP  30           HA       ASP  30   9.777   4.632  -9.430
  256    HB2  ASP  30           2HB      ASP  30  11.661   4.170  -7.851
  257    HB3  ASP  30           3HB      ASP  30  11.031   2.523  -7.637
  258    HD2  ASP  30           2HD      ASP  30  12.889   3.409 -11.039
  259    H    MET  31           HN       MET  31   8.204   2.222  -7.367
  260    HA   MET  31           HA       MET  31   7.776   0.380  -9.591
  261    HB2  MET  31           2HB      MET  31   6.970   0.468  -6.703
  262    HB3  MET  31           3HB      MET  31   6.084  -0.596  -7.822
  263    HG2  MET  31           2HG      MET  31   7.681  -2.029  -7.012
  264    HG3  MET  31           3HG      MET  31   8.469  -1.429  -8.481
  265    HE1  MET  31           3HE      MET  31   8.325  -1.346  -4.584
  266    HE2  MET  31           1HE      MET  31   9.473  -0.049  -4.180
  267    HE3  MET  31           2HE      MET  31   7.938   0.344  -4.986
  268    H    GLY  32           HN       GLY  32   6.411   3.323  -8.733
  269    HA2  GLY  32           1HA      GLY  32   4.681   4.234 -10.138
  270    HA3  GLY  32           2HA      GLY  32   3.971   2.609 -10.278
  271    H    ILE  33           HN       ILE  33   4.924   2.960  -7.139
  272    HA   ILE  33           HA       ILE  33   2.171   3.490  -6.275
  273    HB   ILE  33           HB       ILE  33   4.623   2.874  -4.580
  274   HG12  ILE  33          2HG1      ILE  33   2.514   0.970  -5.644
  275   HG13  ILE  33          3HG1      ILE  33   4.173   1.118  -6.276
  276   HG21  ILE  33          1HG2      ILE  33   2.960   2.179  -2.903
  277   HG22  ILE  33          2HG2      ILE  33   2.743   3.884  -3.363
  278   HG23  ILE  33          3HG2      ILE  33   1.649   2.640  -4.013
  279   HD11  ILE  33          3HD1      ILE  33   3.407   0.269  -3.470
  280   HD12  ILE  33          1HD1      ILE  33   3.964  -0.814  -4.764
  281   HD13  ILE  33          2HD1      ILE  33   5.064   0.416  -4.104
  282    H    THR  34           HN       THR  34   1.713   5.624  -6.422
  283    HA   THR  34           HA       THR  34   3.591   7.475  -5.043
  284    HB   THR  34           HB       THR  34   2.578   9.231  -6.624
  285    HG1  THR  34           1HG      THR  34   1.741   8.327  -8.581
  286   HG21  THR  34          3HG2      THR  34   4.253   6.999  -7.827
  287   HG22  THR  34          1HG2      THR  34   4.122   8.657  -8.460
  288   HG23  THR  34          2HG2      THR  34   4.869   8.370  -6.872
  289    H    ARG  35           HN       ARG  35   2.643   9.286  -3.945
  290    HA   ARG  35           HA       ARG  35   0.286   8.737  -2.491
  291    HB2  ARG  35           2HB      ARG  35   0.358  11.366  -2.213
  292    HB3  ARG  35           3HB      ARG  35   1.566  10.313  -1.438
  293    HG2  ARG  35           2HG      ARG  35   3.156  10.771  -3.202
  294    HG3  ARG  35           3HG      ARG  35   1.945  11.733  -4.083
  295    HD2  ARG  35           2HD      ARG  35   1.977  13.455  -2.482
  296    HD3  ARG  35           3HD      ARG  35   2.759  12.427  -1.261
  297    HE   ARG  35           HE       ARG  35   4.810  12.979  -2.132
  298   HH11  ARG  35          2HH1      ARG  35   2.326  13.807  -4.503
  299   HH12  ARG  35          1HH1      ARG  35   3.446  14.618  -5.571
  300   HH21  ARG  35          2HH2      ARG  35   6.246  14.038  -3.546
  301   HH22  ARG  35          1HH2      ARG  35   5.657  14.748  -5.032
  302    H    GLY  36           HN       GLY  36  -1.697   8.566  -3.183
  303    HA2  GLY  36           1HA      GLY  36  -3.566   9.956  -4.124
  304    HA3  GLY  36           2HA      GLY  36  -2.506  10.220  -5.527
  305    H    CYS  37           HN       CYS  37  -1.459   7.442  -5.471
  306    HA   CYS  37           HA       CYS  37  -3.534   6.307  -7.134
  307    HB2  CYS  37           2HB      CYS  37  -2.025   4.465  -7.490
  308    HB3  CYS  37           3HB      CYS  37  -1.119   5.995  -7.585
  309    HG   CYS  37           HG       CYS  37   0.390   4.129  -6.553
  310    H    GLU  38           HN       GLU  38  -4.751   4.420  -6.805
  311    HA   GLU  38           HA       GLU  38  -5.171   3.781  -3.966
  312    HB2  GLU  38           2HB      GLU  38  -7.054   2.372  -4.838
  313    HB3  GLU  38           3HB      GLU  38  -7.191   4.119  -5.155
  314    HG2  GLU  38           2HG      GLU  38  -6.011   2.329  -7.245
  315    HG3  GLU  38           3HG      GLU  38  -7.771   2.356  -7.007
  316    HE2  GLU  38           2HE      GLU  38  -8.035   5.543  -8.356
  317    H    ILE  39           HN       ILE  39  -4.815   1.841  -3.040
  318    HA   ILE  39           HA       ILE  39  -3.157  -0.041  -4.639
  319    HB   ILE  39           HB       ILE  39  -3.108   0.373  -1.623
  320   HG12  ILE  39          2HG1      ILE  39  -2.356   2.414  -2.738
  321   HG13  ILE  39          3HG1      ILE  39  -1.012   1.580  -1.921
  322   HG21  ILE  39          1HG2      ILE  39  -1.007  -0.899  -1.744
  323   HG22  ILE  39          2HG2      ILE  39  -2.371  -1.834  -2.397
  324   HG23  ILE  39          3HG2      ILE  39  -1.209  -1.063  -3.504
  325   HD11  ILE  39          3HD1      ILE  39  -1.607   1.513  -4.888
  326   HD12  ILE  39          1HD1      ILE  39  -0.318   2.456  -4.110
  327   HD13  ILE  39          2HD1      ILE  39  -0.263   0.681  -4.070
  328    H    TYR  40           HN       TYR  40  -4.343  -1.796  -5.137
  329    HA   TYR  40           HA       TYR  40  -6.388  -2.755  -3.283
  330    HB2  TYR  40           2HB      TYR  40  -6.868  -3.035  -5.608
  331    HB3  TYR  40           3HB      TYR  40  -5.299  -3.801  -5.908
  332    HD1  TYR  40           2HD      TYR  40  -8.301  -4.332  -3.694
  333    HD2  TYR  40           1HD      TYR  40  -5.299  -6.108  -6.145
  334    HE1  TYR  40           2HE      TYR  40  -9.276  -6.550  -3.284
  335    HE2  TYR  40           1HE      TYR  40  -6.267  -8.324  -5.727
  336    HH   TYR  40           HH       TYR  40  -9.143  -8.785  -3.678
  337    H    ILE  41           HN       ILE  41  -5.814  -3.791  -1.486
  338    HA   ILE  41           HA       ILE  41  -3.227  -5.068  -1.256
  339    HB   ILE  41           HB       ILE  41  -5.588  -5.358   0.633
  340   HG12  ILE  41          2HG1      ILE  41  -5.173  -2.982   0.234
  341   HG13  ILE  41          3HG1      ILE  41  -4.671  -3.455   1.874
  342   HG21  ILE  41          1HG2      ILE  41  -3.825  -5.747   2.311
  343   HG22  ILE  41          2HG2      ILE  41  -3.722  -6.923   0.981
  344   HG23  ILE  41          3HG2      ILE  41  -2.585  -5.556   1.051
  345   HD11  ILE  41          3HD1      ILE  41  -2.836  -3.045  -0.498
  346   HD12  ILE  41          1HD1      ILE  41  -3.047  -1.915   0.855
  347   HD13  ILE  41          2HD1      ILE  41  -2.335  -3.516   1.143
  348    H    ARG  42           HN       ARG  42  -2.908  -6.808  -2.493
  349    HA   ARG  42           HA       ARG  42  -5.134  -8.513  -3.245
  350    HB2  ARG  42           2HB      ARG  42  -3.297  -7.821  -4.776
  351    HB3  ARG  42           3HB      ARG  42  -2.168  -8.797  -3.806
  352    HG2  ARG  42           2HG      ARG  42  -4.585 -10.155  -4.889
  353    HG3  ARG  42           3HG      ARG  42  -3.304  -9.699  -6.038
  354    HD2  ARG  42           2HD      ARG  42  -1.663 -10.872  -4.532
  355    HD3  ARG  42           3HD      ARG  42  -3.048 -11.469  -3.592
  356    HE   ARG  42           HE       ARG  42  -3.703 -12.824  -5.416
  357   HH11  ARG  42          2HH1      ARG  42  -0.704 -11.073  -5.958
  358   HH12  ARG  42          1HH1      ARG  42  -0.249 -12.027  -7.351
  359   HH21  ARG  42          2HH2      ARG  42  -3.128 -14.034  -7.259
  360   HH22  ARG  42          1HH2      ARG  42  -1.623 -13.706  -8.089
  361    H    LYS  43           HN       LYS  43  -2.143  -8.896  -1.293
  362    HA   LYS  43           HA       LYS  43  -3.458 -10.944   0.293
  363    HB2  LYS  43           2HB      LYS  43  -2.818 -12.313  -1.610
  364    HB3  LYS  43           3HB      LYS  43  -1.151 -11.693  -1.534
  365    HG2  LYS  43           2HG      LYS  43  -0.897 -12.734   0.697
  366    HG3  LYS  43           3HG      LYS  43  -2.539 -13.407   0.546
  367    HD2  LYS  43           2HD      LYS  43  -1.852 -14.651  -1.453
  368    HD3  LYS  43           3HD      LYS  43  -0.214 -13.966  -1.322
  369    HE2  LYS  43           2HE      LYS  43   0.072 -15.041   0.861
  370    HE3  LYS  43           3HE      LYS  43  -1.575 -15.700   0.764
  371    HZ1  LYS  43           3HZ      LYS  43   0.630 -16.322  -1.083
  372    HZ2  LYS  43           1HZ      LYS  43   0.066 -17.312   0.108
  373    HZ3  LYS  43           2HZ      LYS  43  -0.899 -16.933  -1.173
  374    H    VAL  44           HN       VAL  44  -2.837 -10.533   2.299
  375    HA   VAL  44           HA       VAL  44  -0.025  -9.680   2.753
  376    HB   VAL  44           HB       VAL  44  -2.393  -9.648   4.666
  377   HG11  VAL  44          1HG1      VAL  44  -0.916  -8.343   6.142
  378   HG12  VAL  44          2HG1      VAL  44  -0.245  -9.956   5.812
  379   HG13  VAL  44          3HG1      VAL  44   0.413  -8.530   4.975
  380   HG21  VAL  44          3HG2      VAL  44  -2.640  -8.005   2.864
  381   HG22  VAL  44          1HG2      VAL  44  -2.315  -7.202   4.418
  382   HG23  VAL  44          2HG2      VAL  44  -1.015  -7.367   3.216
  383    H    ALA  45           HN       ALA  45   1.324 -11.325   3.149
  384    HA   ALA  45           HA       ALA  45   0.442 -13.972   3.604
  385    HB1  ALA  45           1HB      ALA  45   2.809 -14.467   4.064
  386    HB2  ALA  45           2HB      ALA  45   2.633 -13.406   2.649
  387    HB3  ALA  45           3HB      ALA  45   3.144 -12.727   4.212
  388    HA   PRO  46           HA       PRO  46  -0.510 -14.067   7.895
  389    HB2  PRO  46           2HB      PRO  46  -0.029 -16.751   8.420
  390    HB3  PRO  46           3HB      PRO  46  -1.445 -16.142   7.502
  391    HG2  PRO  46           2HG      PRO  46   1.127 -17.226   6.453
  392    HG3  PRO  46           3HG      PRO  46  -0.547 -17.632   5.950
  393    HD2  PRO  46           2HD      PRO  46   1.012 -15.921   4.548
  394    HD3  PRO  46           3HD      PRO  46  -0.742 -15.628   4.744
  395    H    LEU  47           HN       LEU  47   2.601 -14.705   6.637
  396    HA   LEU  47           HA       LEU  47   3.902 -15.034   9.239
  397    HB2  LEU  47           2HB      LEU  47   5.112 -14.412   6.527
  398    HB3  LEU  47           3HB      LEU  47   5.957 -15.026   7.968
  399    HG   LEU  47           HG       LEU  47   3.842 -16.532   6.413
  400   HD11  LEU  47          1HD1      LEU  47   5.708 -17.905   5.585
  401   HD12  LEU  47          2HD1      LEU  47   5.880 -16.205   5.090
  402   HD13  LEU  47          3HD1      LEU  47   6.860 -16.845   6.432
  403   HD21  LEU  47          3HD2      LEU  47   3.967 -17.162   8.780
  404   HD22  LEU  47          1HD2      LEU  47   4.588 -18.465   7.741
  405   HD23  LEU  47          2HD2      LEU  47   5.721 -17.418   8.625
  406    H    GLY  48           HN       GLY  48   2.747 -12.497   7.228
  407    HA2  GLY  48           1HA      GLY  48   2.646 -10.253   8.043
  408    HA3  GLY  48           2HA      GLY  48   4.155 -10.531   8.944
  409    H    ASP  49           HN       ASP  49   4.907 -12.005   6.226
  410    HA   ASP  49           HA       ASP  49   5.415  -9.696   4.501
  411    HB2  ASP  49           2HB      ASP  49   7.191  -9.474   6.199
  412    HB3  ASP  49           3HB      ASP  49   7.694 -11.151   5.896
  413    HD2  ASP  49           2HD      ASP  49   9.606 -10.194   3.211
  414    HA   PRO  50           HA       PRO  50   6.158  -9.255   2.844
  415    HB2  PRO  50           2HB      PRO  50   5.984  -9.159   0.151
  416    HB3  PRO  50           3HB      PRO  50   7.417  -9.896   0.941
  417    HG2  PRO  50           2HG      PRO  50   5.045 -11.251  -0.257
  418    HG3  PRO  50           3HG      PRO  50   6.781 -11.663  -0.439
  419    HD2  PRO  50           2HD      PRO  50   4.964 -12.847   1.358
  420    HD3  PRO  50           3HD      PRO  50   6.746 -12.879   1.519
  421    H    ILE  51           HN       ILE  51   4.763  -7.714   1.333
  422    HA   ILE  51           HA       ILE  51   1.928  -8.565   1.608
  423    HB   ILE  51           HB       ILE  51   3.135  -5.771   1.602
  424   HG12  ILE  51          2HG1      ILE  51   1.844  -5.701   3.831
  425   HG13  ILE  51          3HG1      ILE  51   1.796  -7.476   3.703
  426   HG21  ILE  51          1HG2      ILE  51   0.830  -4.943   1.868
  427   HG22  ILE  51          2HG2      ILE  51   1.033  -5.812   0.329
  428   HG23  ILE  51          3HG2      ILE  51   0.215  -6.604   1.699
  429   HD11  ILE  51          3HD1      ILE  51   4.292  -5.765   3.784
  430   HD12  ILE  51          1HD1      ILE  51   3.658  -6.735   5.130
  431   HD13  ILE  51          2HD1      ILE  51   4.243  -7.540   3.659
  432    H    GLN  52           HN       GLN  52   1.087  -9.188  -0.246
  433    HA   GLN  52           HA       GLN  52   2.271  -8.254  -2.775
  434    HB2  GLN  52           2HB      GLN  52   1.664 -10.683  -2.212
  435    HB3  GLN  52           3HB      GLN  52  -0.034 -10.181  -2.400
  436    HG2  GLN  52           2HG      GLN  52   0.613 -11.154  -4.452
  437    HG3  GLN  52           3HG      GLN  52   0.570  -9.398  -4.718
  438   HE21  GLN  52          1HE2      GLN  52   2.019 -11.542  -6.175
  439   HE22  GLN  52          2HE2      GLN  52   3.711 -11.093  -6.117
  440    H    ILE  53           HN       ILE  53   1.520  -6.431  -3.648
  441    HA   ILE  53           HA       ILE  53  -1.367  -5.802  -3.249
  442    HB   ILE  53           HB       ILE  53  -0.693  -3.383  -3.455
  443   HG12  ILE  53          2HG1      ILE  53   2.100  -4.507  -3.084
  444   HG13  ILE  53          3HG1      ILE  53   1.467  -3.767  -4.573
  445   HG21  ILE  53          1HG2      ILE  53   0.116  -3.190  -1.140
  446   HG22  ILE  53          2HG2      ILE  53  -1.169  -4.414  -1.280
  447   HG23  ILE  53          3HG2      ILE  53   0.532  -4.920  -1.142
  448   HD11  ILE  53          3HD1      ILE  53   1.822  -2.377  -1.908
  449   HD12  ILE  53          1HD1      ILE  53   2.877  -2.187  -3.324
  450   HD13  ILE  53          2HD1      ILE  53   1.190  -1.637  -3.398
  451    H    ASN  54           HN       ASN  54  -2.378  -4.557  -4.985
  452    HA   ASN  54           HA       ASN  54  -1.002  -5.031  -7.592
  453    HB2  ASN  54           2HB      ASN  54  -3.111  -6.331  -7.202
  454    HB3  ASN  54           3HB      ASN  54  -3.985  -4.789  -7.083
  455   HD21  ASN  54          1HD2      ASN  54  -2.304  -7.029  -9.209
  456   HD22  ASN  54          2HD2      ASN  54  -2.856  -6.326 -10.715
  457    H    VAL  55           HN       VAL  55  -0.139  -3.227  -8.321
  458    HA   VAL  55           HA       VAL  55  -1.677  -0.700  -7.978
  459    HB   VAL  55           HB       VAL  55   1.351  -1.002  -8.028
  460   HG11  VAL  55          1HG1      VAL  55   1.379   1.387  -7.442
  461   HG12  VAL  55          2HG1      VAL  55   0.563   1.108  -8.996
  462   HG13  VAL  55          3HG1      VAL  55  -0.396   1.428  -7.531
  463   HG21  VAL  55          3HG2      VAL  55   0.400  -1.862  -5.944
  464   HG22  VAL  55          1HG2      VAL  55   1.284  -0.344  -5.663
  465   HG23  VAL  55          2HG2      VAL  55  -0.494  -0.340  -5.716
  466    H    ARG  56           HN       ARG  56  -2.091   0.412  -9.793
  467    HA   ARG  56           HA       ARG  56  -2.144   0.999 -12.004
  468    HB2  ARG  56           2HB      ARG  56   0.651  -0.177 -12.188
  469    HB3  ARG  56           3HB      ARG  56  -0.103   0.987 -13.304
  470    HG2  ARG  56           2HG      ARG  56   0.643   1.496 -10.413
  471    HG3  ARG  56           3HG      ARG  56   1.511   2.087 -11.849
  472    HD2  ARG  56           2HD      ARG  56  -0.481   3.360 -12.523
  473    HD3  ARG  56           3HD      ARG  56  -1.341   2.775 -11.083
  474    HE   ARG  56           HE       ARG  56   0.993   3.958 -10.135
  475   HH11  ARG  56          2HH1      ARG  56  -1.876   4.924 -11.944
  476   HH12  ARG  56          1HH1      ARG  56  -1.804   6.589 -11.414
  477   HH21  ARG  56          2HH2      ARG  56   1.098   6.136  -9.475
  478   HH22  ARG  56          1HH2      ARG  56  -0.117   7.275 -10.012
  479    H    GLY  57           HN       GLY  57  -2.648  -1.889 -10.961
  480    HA2  GLY  57           1HA      GLY  57  -3.803  -3.562 -12.184
  481    HA3  GLY  57           2HA      GLY  57  -2.964  -3.048 -13.666
  482    H    TYR  58           HN       TYR  58  -0.453  -2.989 -11.773
  483    HA   TYR  58           HA       TYR  58   0.235  -5.818 -12.382
  484    HB2  TYR  58           2HB      TYR  58   1.519  -3.809 -13.340
  485    HB3  TYR  58           3HB      TYR  58   2.120  -3.548 -11.693
  486    HD1  TYR  58           1HD      TYR  58   2.142  -5.901 -14.560
  487    HD2  TYR  58           2HD      TYR  58   3.868  -4.922 -10.789
  488    HE1  TYR  58           1HE      TYR  58   3.975  -7.479 -14.990
  489    HE2  TYR  58           2HE      TYR  58   5.693  -6.511 -11.209
  490    HH   TYR  58           HH       TYR  58   6.608  -8.015 -12.652
  491    H    GLU  59           HN       GLU  59   0.834  -7.233 -10.795
  492    HA   GLU  59           HA       GLU  59   0.407  -6.314  -8.051
  493    HB2  GLU  59           2HB      GLU  59   0.779  -8.723  -7.483
  494    HB3  GLU  59           3HB      GLU  59  -0.581  -8.399  -8.585
  495    HG2  GLU  59           2HG      GLU  59   0.800  -9.089 -10.487
  496    HG3  GLU  59           3HG      GLU  59   2.153  -9.422  -9.383
  497    HE2  GLU  59           2HE      GLU  59   0.688 -12.383  -8.280
  498    H    LEU  60           HN       LEU  60   1.888  -5.722  -6.675
  499    HA   LEU  60           HA       LEU  60   4.744  -6.185  -7.392
  500    HB2  LEU  60           2HB      LEU  60   3.477  -3.908  -5.833
  501    HB3  LEU  60           3HB      LEU  60   5.204  -4.084  -6.223
  502    HG   LEU  60           HG       LEU  60   3.005  -3.751  -8.278
  503   HD11  LEU  60          1HD1      LEU  60   3.814  -1.436  -8.503
  504   HD12  LEU  60          2HD1      LEU  60   3.196  -1.752  -6.865
  505   HD13  LEU  60          3HD1      LEU  60   4.950  -1.705  -7.160
  506   HD21  LEU  60          3HD2      LEU  60   5.014  -4.902  -9.097
  507   HD22  LEU  60          1HD2      LEU  60   4.876  -3.277  -9.809
  508   HD23  LEU  60          2HD2      LEU  60   6.030  -3.574  -8.487
  509    H    SER  61           HN       SER  61   6.091  -7.005  -5.867
  510    HA   SER  61           HA       SER  61   4.839  -7.878  -3.336
  511    HB2  SER  61           2HB      SER  61   7.587  -8.511  -4.475
  512    HB3  SER  61           3HB      SER  61   6.779  -9.320  -3.110
  513    HG   SER  61           HG       SER  61   6.567 -10.481  -5.084
  514    H    LEU  62           HN       LEU  62   4.859  -6.332  -1.813
  515    HA   LEU  62           HA       LEU  62   7.348  -4.721  -1.534
  516    HB2  LEU  62           2HB      LEU  62   5.127  -3.571  -1.935
  517    HB3  LEU  62           3HB      LEU  62   4.627  -4.164  -0.333
  518    HG   LEU  62           HG       LEU  62   6.452  -2.898   0.704
  519   HD11  LEU  62          1HD1      LEU  62   7.743  -1.272  -0.620
  520   HD12  LEU  62          2HD1      LEU  62   8.034  -2.937  -1.174
  521   HD13  LEU  62          3HD1      LEU  62   6.963  -1.862  -2.105
  522   HD21  LEU  62          3HD2      LEU  62   4.239  -1.869   0.453
  523   HD22  LEU  62          1HD2      LEU  62   5.527  -0.648   0.332
  524   HD23  LEU  62          2HD2      LEU  62   4.713  -1.228  -1.139
  525    H    ARG  63           HN       ARG  63   8.428  -4.653   0.429
  526    HA   ARG  63           HA       ARG  63   7.963  -6.999   2.081
  527    HB2  ARG  63           2HB      ARG  63  10.021  -4.785   2.169
  528    HB3  ARG  63           3HB      ARG  63   9.963  -6.120   3.346
  529    HG2  ARG  63           2HG      ARG  63  10.307  -6.404   0.349
  530    HG3  ARG  63           3HG      ARG  63  11.594  -6.548   1.569
  531    HD2  ARG  63           2HD      ARG  63  10.505  -8.477   2.557
  532    HD3  ARG  63           3HD      ARG  63   9.111  -8.290   1.473
  533    HE   ARG  63           HE       ARG  63  11.442  -8.567  -0.107
  534   HH11  ARG  63          2HH1      ARG  63   9.518 -10.453   2.166
  535   HH12  ARG  63          1HH1      ARG  63   9.865 -11.980   1.387
  536   HH21  ARG  63          2HH2      ARG  63  11.858 -10.563  -1.133
  537   HH22  ARG  63          1HH2      ARG  63  11.188 -12.041  -0.480
  538    H    LYS  64           HN       LYS  64   7.736  -7.039   4.298
  539    HA   LYS  64           HA       LYS  64   5.638  -5.680   5.422
  540    HB2  LYS  64           2HB      LYS  64   6.504  -7.664   6.398
  541    HB3  LYS  64           3HB      LYS  64   8.108  -6.930   6.638
  542    HG2  LYS  64           2HG      LYS  64   7.134  -5.422   8.333
  543    HG3  LYS  64           3HG      LYS  64   5.562  -6.231   8.122
  544    HD2  LYS  64           2HD      LYS  64   6.888  -7.082  10.068
  545    HD3  LYS  64           3HD      LYS  64   6.475  -8.334   8.872
  546    HE2  LYS  64           2HE      LYS  64   8.745  -8.009   7.853
  547    HE3  LYS  64           3HE      LYS  64   9.138  -6.912   9.194
  548    HZ1  LYS  64           3HZ      LYS  64   8.400  -9.747   9.461
  549    HZ2  LYS  64           1HZ      LYS  64   9.922  -9.133   9.605
  550    HZ3  LYS  64           2HZ      LYS  64   8.763  -8.729  10.706
  551    H    SER  65           HN       SER  65   9.114  -4.831   5.896
  552    HA   SER  65           HA       SER  65   8.547  -2.666   7.655
  553    HB2  SER  65           2HB      SER  65  10.925  -1.966   7.013
  554    HB3  SER  65           3HB      SER  65  10.720  -3.584   7.728
  555    HG   SER  65           HG       SER  65  12.066  -3.601   5.861
  556    H    ALA  66           HN       ALA  66   9.020  -2.796   4.117
  557    HA   ALA  66           HA       ALA  66   9.027   0.054   3.784
  558    HB1  ALA  66           1HB      ALA  66   8.727  -0.447   1.393
  559    HB2  ALA  66           2HB      ALA  66   9.981  -1.477   2.119
  560    HB3  ALA  66           3HB      ALA  66   8.362  -2.141   1.794
  561    H    ALA  67           HN       ALA  67   6.499  -2.453   3.544
  562    HA   ALA  67           HA       ALA  67   4.425  -0.671   2.708
  563    HB1  ALA  67           1HB      ALA  67   2.902  -2.494   3.366
  564    HB2  ALA  67           2HB      ALA  67   4.288  -3.114   2.440
  565    HB3  ALA  67           3HB      ALA  67   4.241  -3.306   4.209
  566    H    GLU  68           HN       GLU  68   5.683  -1.673   5.839
  567    HA   GLU  68           HA       GLU  68   3.438  -0.751   7.360
  568    HB2  GLU  68           2HB      GLU  68   5.236  -2.454   7.997
  569    HB3  GLU  68           3HB      GLU  68   6.273  -1.054   8.357
  570    HG2  GLU  68           2HG      GLU  68   4.591  -0.250   9.962
  571    HG3  GLU  68           3HG      GLU  68   3.607  -1.692   9.630
  572    HE2  GLU  68           2HE      GLU  68   6.824  -2.070  11.913
  573    H    MET  69           HN       MET  69   6.252   0.801   6.012
  574    HA   MET  69           HA       MET  69   6.089   3.114   7.796
  575    HB2  MET  69           2HB      MET  69   8.190   2.112   6.685
  576    HB3  MET  69           3HB      MET  69   7.631   2.926   5.204
  577    HG2  MET  69           2HG      MET  69   9.279   4.294   6.314
  578    HG3  MET  69           3HG      MET  69   7.697   5.086   6.392
  579    HE1  MET  69           3HE      MET  69   8.792   6.688   8.276
  580    HE2  MET  69           1HE      MET  69   9.529   6.078   9.775
  581    HE3  MET  69           2HE      MET  69  10.314   5.767   8.211
  582    H    ILE  70           HN       ILE  70   4.317   2.041   5.153
  583    HA   ILE  70           HA       ILE  70   4.039   4.712   3.956
  584    HB   ILE  70           HB       ILE  70   2.827   2.041   3.154
  585   HG12  ILE  70          2HG1      ILE  70   5.197   2.027   2.817
  586   HG13  ILE  70          3HG1      ILE  70   4.418   2.268   1.234
  587   HG21  ILE  70          1HG2      ILE  70   2.179   3.174   1.065
  588   HG22  ILE  70          2HG2      ILE  70   1.398   3.921   2.477
  589   HG23  ILE  70          3HG2      ILE  70   2.796   4.713   1.709
  590   HD11  ILE  70          3HD1      ILE  70   5.675   4.428   2.949
  591   HD12  ILE  70          1HD1      ILE  70   6.392   3.716   1.488
  592   HD13  ILE  70          2HD1      ILE  70   4.898   4.668   1.365
  593    H    GLU  71           HN       GLU  71   2.455   6.061   4.310
  594    HA   GLU  71           HA       GLU  71   0.239   5.236   6.076
  595    HB2  GLU  71           2HB      GLU  71   1.400   7.264   6.678
  596    HB3  GLU  71           3HB      GLU  71   1.197   7.919   5.035
  597    HG2  GLU  71           2HG      GLU  71  -0.870   8.667   5.458
  598    HG3  GLU  71           3HG      GLU  71  -1.325   7.201   6.352
  599    HE2  GLU  71           2HE      GLU  71  -1.169   9.089   9.206
  600    H    VAL  72           HN       VAL  72  -1.566   4.508   5.174
  601    HA   VAL  72           HA       VAL  72  -2.382   5.715   2.584
  602    HB   VAL  72           HB       VAL  72  -3.438   3.558   1.982
  603   HG11  VAL  72          1HG1      VAL  72  -1.375   2.350   1.410
  604   HG12  VAL  72          2HG1      VAL  72  -1.201   4.101   1.144
  605   HG13  VAL  72          3HG1      VAL  72  -0.472   3.340   2.579
  606   HG21  VAL  72          3HG2      VAL  72  -3.763   2.658   4.238
  607   HG22  VAL  72          1HG2      VAL  72  -2.871   1.507   3.216
  608   HG23  VAL  72          2HG2      VAL  72  -2.002   2.478   4.427
  609    H    GLU  73           HN       GLU  73  -4.790   5.284   2.171
  610    HA   GLU  73           HA       GLU  73  -6.283   5.568   4.736
  611    HB2  GLU  73           2HB      GLU  73  -6.042   7.709   3.497
  612    HB3  GLU  73           3HB      GLU  73  -6.853   6.958   2.102
  613    HG2  GLU  73           2HG      GLU  73  -8.899   6.748   3.303
  614    HG3  GLU  73           3HG      GLU  73  -8.121   7.202   4.834
  615    HE2  GLU  73           2HE      GLU  73  -9.312  10.054   2.390
  616    H    LEU  74           HN       LEU  74  -7.953   4.218   5.000
  617    HA   LEU  74           HA       LEU  74  -8.401   2.128   3.041
  618    HB2  LEU  74           2HB      LEU  74  -8.547   2.107   5.653
  619    HB3  LEU  74           3HB      LEU  74 -10.195   2.722   5.388
  620    HG   LEU  74           HG       LEU  74 -10.184   0.323   5.789
  621   HD11  LEU  74          1HD1      LEU  74 -11.485  -0.411   3.839
  622   HD12  LEU  74          2HD1      LEU  74 -11.917   1.241   4.332
  623   HD13  LEU  74          3HD1      LEU  74 -10.875   0.978   2.913
  624   HD21  LEU  74          3HD2      LEU  74  -7.949  -0.189   4.938
  625   HD22  LEU  74          1HD2      LEU  74  -9.171  -1.242   4.190
  626   HD23  LEU  74          2HD2      LEU  74  -8.501   0.129   3.276
  627    H    GLU  75           HN       GLU  75  -9.557   2.458   1.223
  628    HA   GLU  75           HA       GLU  75 -11.260   4.722   0.887
  629    HB2  GLU  75           2HB      GLU  75 -10.185   3.650  -1.019
  630    HB3  GLU  75           3HB      GLU  75 -11.099   2.153  -0.722
  631    HG2  GLU  75           2HG      GLU  75 -13.196   3.339  -1.171
  632    HG3  GLU  75           3HG      GLU  75 -12.291   4.842  -1.452
  633    HE2  GLU  75           2HE      GLU  75 -11.575   3.944  -4.686
  634    H    HIS  76           HN       HIS  76 -13.063   5.029   1.973
  635    HA   HIS  76           HA       HIS  76 -14.677   2.803   2.912
  636    HB2  HIS  76           2HB      HIS  76 -15.291   5.779   2.913
  637    HB3  HIS  76           3HB      HIS  76 -16.125   4.525   3.848
  638    HD1  HIS  76           1HD      HIS  76 -13.862   7.112   4.427
  639    HD2  HIS  76           2HD      HIS  76 -13.847   3.060   5.437
  640    HE1  HIS  76           1HE      HIS  76 -12.241   6.871   6.356
  641    HE2  HIS  76           2HE      HIS  76 -12.231   4.406   6.968
  642    H    HIS  77           HN       HIS  77 -15.403   1.679   1.148
  643    HA   HIS  77           HA       HIS  77 -16.640   3.169  -1.056
  644    HB2  HIS  77           2HB      HIS  77 -16.809   0.935  -2.146
  645    HB3  HIS  77           3HB      HIS  77 -15.158   1.427  -1.727
  646    HD1  HIS  77           1HD      HIS  77 -17.558  -1.307  -1.359
  647    HD2  HIS  77           2HD      HIS  77 -14.125   0.013   0.623
  648    HE1  HIS  77           1HE      HIS  77 -16.745  -3.267   0.025
  649    HE2  HIS  77           2HE      HIS  77 -14.660  -2.458   1.227
  650    H    HIS  78           HN       HIS  78 -18.007   3.509   1.279
  651    HA   HIS  78           HA       HIS  78 -20.641   2.683   0.334
  652    HB2  HIS  78           2HB      HIS  78 -21.429   1.656   2.315
  653    HB3  HIS  78           3HB      HIS  78 -19.912   0.833   1.908
  654    HD1  HIS  78           1HD      HIS  78 -21.618   2.680   4.591
  655    HD2  HIS  78           2HD      HIS  78 -17.700   1.588   3.644
  656    HE1  HIS  78           1HE      HIS  78 -20.274   2.963   6.717
  657    HE2  HIS  78           2HE      HIS  78 -17.895   2.296   6.138
  658    H    HIS  79           HN       HIS  79 -22.264   4.144   1.098
  659    HA   HIS  79           HA       HIS  79 -21.075   6.489   2.492
  660    HB2  HIS  79           2HB      HIS  79 -22.297   7.978   0.976
  661    HB3  HIS  79           3HB      HIS  79 -21.142   6.957   0.102
  662    HD1  HIS  79           1HD      HIS  79 -22.121   5.086  -1.442
  663    HD2  HIS  79           2HD      HIS  79 -24.969   7.615   0.273
  664    HE1  HIS  79           1HE      HIS  79 -24.274   4.699  -2.720
  665    HE2  HIS  79           2HE      HIS  79 -25.998   6.238  -1.675
  666    H    HIS  80           HN       HIS  80 -22.294   7.523   3.970
  667    HA   HIS  80           HA       HIS  80 -24.936   6.357   4.587
  668    HB2  HIS  80           2HB      HIS  80 -23.169   6.874   6.345
  669    HB3  HIS  80           3HB      HIS  80 -23.485   8.590   6.031
  670    HD1  HIS  80           1HD      HIS  80 -25.302   9.635   7.381
  671    HD2  HIS  80           2HD      HIS  80 -25.597   5.473   7.269
  672    HE1  HIS  80           1HE      HIS  80 -27.173   9.018   8.972
  673    HE2  HIS  80           2HE      HIS  80 -27.349   6.484   8.906
  674    H    HIS  81           HN       HIS  81 -23.433   9.013   3.021
  675    HA   HIS  81           HA       HIS  81 -26.004   9.913   2.004
  676    HB2  HIS  81           2HB      HIS  81 -25.882  11.254   4.057
  677    HB3  HIS  81           3HB      HIS  81 -24.256  11.808   3.615
  678    HD1  HIS  81           1HD      HIS  81 -24.062  13.715   1.916
  679    HD2  HIS  81           2HD      HIS  81 -27.978  12.380   2.494
  680    HE1  HIS  81           1HE      HIS  81 -25.563  15.400   0.760
  681    HE2  HIS  81           2HE      HIS  81 -27.935  14.580   1.111
  Start of MODEL    8
    1    H1   MET   1           HN       MET   1  -3.230   5.946  13.138
    2    HA   MET   1           HA       MET   1  -1.796   6.744  10.817
    3    HB2  MET   1           2HB      MET   1   0.218   6.659  12.152
    4    HB3  MET   1           3HB      MET   1  -0.207   5.043  12.767
    5    HG2  MET   1           2HG      MET   1   0.007   4.151  10.464
    6    HG3  MET   1           3HG      MET   1   0.514   5.756   9.911
    7    HE1  MET   1           3HE      MET   1   2.653   4.473   8.860
    8    HE2  MET   1           1HE      MET   1   3.785   3.502   9.829
    9    HE3  MET   1           2HE      MET   1   2.118   2.934   9.576
   10    H    PHE   2           HN       PHE   2  -2.278   5.397   9.180
   11    HA   PHE   2           HA       PHE   2  -3.144   2.638   9.862
   12    HB2  PHE   2           2HB      PHE   2  -5.078   4.251   9.457
   13    HB3  PHE   2           3HB      PHE   2  -4.501   4.379   7.787
   14    HD1  PHE   2           1HD      PHE   2  -6.093   2.201  10.270
   15    HD2  PHE   2           2HD      PHE   2  -4.711   2.496   6.252
   16    HE1  PHE   2           1HE      PHE   2  -7.366   0.181   9.686
   17    HE2  PHE   2           2HE      PHE   2  -5.981   0.479   5.666
   18    HZ   PHE   2           HZ       PHE   2  -7.304  -0.688   7.382
   19    H    SER   3           HN       SER   3  -1.444   1.522   9.057
   20    HA   SER   3           HA       SER   3  -0.343   2.366   6.441
   21    HB2  SER   3           2HB      SER   3   1.525   0.855   6.996
   22    HB3  SER   3           3HB      SER   3   1.249   2.046   8.290
   23    HG   SER   3           HG       SER   3   1.543  -0.090   9.094
   24    H    LEU   4           HN       LEU   4   0.521   0.343   5.136
   25    HA   LEU   4           HA       LEU   4  -1.757  -1.261   4.401
   26    HB2  LEU   4           2HB      LEU   4   1.178  -1.360   3.682
   27    HB3  LEU   4           3HB      LEU   4  -0.024  -2.494   3.022
   28    HG   LEU   4           HG       LEU   4  -0.043   0.516   2.687
   29   HD11  LEU   4          1HD1      LEU   4   0.486   0.037   0.334
   30   HD12  LEU   4          2HD1      LEU   4   1.754  -0.569   1.425
   31   HD13  LEU   4          3HD1      LEU   4   0.578  -1.699   0.710
   32   HD21  LEU   4          3HD2      LEU   4  -2.301  -0.442   2.742
   33   HD22  LEU   4          1HD2      LEU   4  -1.885   0.113   1.104
   34   HD23  LEU   4          2HD2      LEU   4  -1.837  -1.622   1.493
   35    H    ARG   5           HN       ARG   5   0.442  -1.420   6.936
   36    HA   ARG   5           HA       ARG   5   0.330  -4.329   7.271
   37    HB2  ARG   5           2HB      ARG   5   1.386  -2.037   8.947
   38    HB3  ARG   5           3HB      ARG   5   1.400  -3.731   9.493
   39    HG2  ARG   5           2HG      ARG   5   2.735  -2.668   6.995
   40    HG3  ARG   5           3HG      ARG   5   3.550  -3.062   8.528
   41    HD2  ARG   5           2HD      ARG   5   1.906  -5.031   6.915
   42    HD3  ARG   5           3HD      ARG   5   3.671  -4.865   6.785
   43    HE   ARG   5           HE       ARG   5   3.502  -5.290   9.383
   44   HH11  ARG   5          2HH1      ARG   5   1.653  -6.838   6.812
   45   HH12  ARG   5          1HH1      ARG   5   1.442  -8.331   7.697
   46   HH21  ARG   5          2HH2      ARG   5   3.214  -7.239  10.524
   47   HH22  ARG   5          1HH2      ARG   5   2.326  -8.558   9.797
   48    H    ASP   6           HN       ASP   6  -1.271  -1.428   8.377
   49    HA   ASP   6           HA       ASP   6  -2.842  -2.841  10.398
   50    HB2  ASP   6           2HB      ASP   6  -3.144  -0.042   9.247
   51    HB3  ASP   6           3HB      ASP   6  -4.011  -0.688  10.657
   52    HD2  ASP   6           2HD      ASP   6  -0.434   0.788  11.174
   53    H    ALA   7           HN       ALA   7  -3.074  -1.888   7.046
   54    HA   ALA   7           HA       ALA   7  -5.910  -2.188   6.771
   55    HB1  ALA   7           1HB      ALA   7  -5.438  -2.205   4.354
   56    HB2  ALA   7           2HB      ALA   7  -4.540  -0.912   5.181
   57    HB3  ALA   7           3HB      ALA   7  -3.704  -2.406   4.696
   58    H    LYS   8           HN       LYS   8  -7.053  -3.838   5.640
   59    HA   LYS   8           HA       LYS   8  -5.886  -6.535   6.130
   60    HB2  LYS   8           2HB      LYS   8  -7.971  -5.859   7.360
   61    HB3  LYS   8           3HB      LYS   8  -8.791  -5.717   5.786
   62    HG2  LYS   8           2HG      LYS   8  -9.380  -7.820   6.767
   63    HG3  LYS   8           3HG      LYS   8  -8.302  -8.128   5.384
   64    HD2  LYS   8           2HD      LYS   8  -6.410  -8.429   6.887
   65    HD3  LYS   8           3HD      LYS   8  -7.430  -8.027   8.288
   66    HE2  LYS   8           2HE      LYS   8  -8.850  -9.991   7.791
   67    HE3  LYS   8           3HE      LYS   8  -7.781 -10.403   6.433
   68    HZ1  LYS   8           3HZ      LYS   8  -6.981 -10.271   9.262
   69    HZ2  LYS   8           1HZ      LYS   8  -7.238 -11.652   8.400
   70    HZ3  LYS   8           2HZ      LYS   8  -5.989 -10.654   8.001
   71    H    CYS   9           HN       CYS   9  -6.235  -8.187   4.536
   72    HA   CYS   9           HA       CYS   9  -5.833  -7.368   1.864
   73    HB2  CYS   9           2HB      CYS   9  -6.380  -9.755   1.320
   74    HB3  CYS   9           3HB      CYS   9  -5.121  -9.530   2.561
   75    HG   CYS   9           HG       CYS   9  -6.545 -11.650   3.114
   76    H    GLY  10           HN       GLY  10  -7.161  -7.143   0.088
   77    HA2  GLY  10           1HA      GLY  10  -9.228  -7.253  -1.054
   78    HA3  GLY  10           2HA      GLY  10 -10.055  -7.578   0.486
   79    H    GLN  11           HN       GLN  11  -8.450  -5.274   1.716
   80    HA   GLN  11           HA       GLN  11 -10.456  -3.269   1.261
   81    HB2  GLN  11           2HB      GLN  11  -7.887  -3.405   2.815
   82    HB3  GLN  11           3HB      GLN  11  -8.679  -1.832   2.554
   83    HG2  GLN  11           2HG      GLN  11 -10.703  -2.648   3.624
   84    HG3  GLN  11           3HG      GLN  11  -9.971  -4.255   3.828
   85   HE21  GLN  11          1HE2      GLN  11 -10.267  -4.148   6.095
   86   HE22  GLN  11          2HE2      GLN  11  -9.245  -3.144   7.102
   87    H    THR  12           HN       THR  12 -10.541  -1.620  -0.095
   88    HA   THR  12           HA       THR  12  -8.226  -1.149  -1.861
   89    HB   THR  12           HB       THR  12 -10.994   0.107  -1.985
   90    HG1  THR  12           1HG      THR  12 -11.366  -1.491  -3.615
   91   HG21  THR  12          3HG2      THR  12  -8.787  -0.168  -4.057
   92   HG22  THR  12          1HG2      THR  12 -10.379   0.574  -4.330
   93   HG23  THR  12          2HG2      THR  12  -9.232   1.326  -3.199
   94    H    VAL  13           HN       VAL  13  -6.756   0.132  -0.902
   95    HA   VAL  13           HA       VAL  13  -7.774   2.550   0.506
   96    HB   VAL  13           HB       VAL  13  -5.701   2.574   1.785
   97   HG11  VAL  13          1HG1      VAL  13  -5.999   0.539   3.132
   98   HG12  VAL  13          2HG1      VAL  13  -7.562   1.254   2.675
   99   HG13  VAL  13          3HG1      VAL  13  -6.958  -0.186   1.821
  100   HG21  VAL  13          3HG2      VAL  13  -4.193   1.655   0.089
  101   HG22  VAL  13          1HG2      VAL  13  -4.033   0.773   1.626
  102   HG23  VAL  13          2HG2      VAL  13  -4.944   0.053   0.279
  103    H    LYS  14           HN       LYS  14  -5.973   4.335   0.464
  104    HA   LYS  14           HA       LYS  14  -4.617   4.335  -2.177
  105    HB2  LYS  14           2HB      LYS  14  -6.521   6.393  -1.069
  106    HB3  LYS  14           3HB      LYS  14  -5.265   6.829  -2.254
  107    HG2  LYS  14           2HG      LYS  14  -6.277   5.703  -3.953
  108    HG3  LYS  14           3HG      LYS  14  -6.982   4.478  -2.872
  109    HD2  LYS  14           2HD      LYS  14  -8.733   5.852  -3.814
  110    HD3  LYS  14           3HD      LYS  14  -8.599   6.155  -2.066
  111    HE2  LYS  14           2HE      LYS  14  -7.339   8.200  -2.499
  112    HE3  LYS  14           3HE      LYS  14  -7.405   7.888  -4.247
  113    HZ1  LYS  14           3HZ      LYS  14  -9.729   8.348  -2.500
  114    HZ2  LYS  14           1HZ      LYS  14  -9.091   9.440  -3.558
  115    HZ3  LYS  14           2HZ      LYS  14  -9.790   8.059  -4.123
  116    H    VAL  15           HN       VAL  15  -2.729   5.502  -2.282
  117    HA   VAL  15           HA       VAL  15  -1.391   5.711   0.290
  118    HB   VAL  15           HB       VAL  15  -0.369   6.392  -2.494
  119   HG11  VAL  15          1HG1      VAL  15   1.868   6.180  -1.490
  120   HG12  VAL  15          2HG1      VAL  15   0.923   7.468  -0.707
  121   HG13  VAL  15          3HG1      VAL  15   1.125   5.894   0.101
  122   HG21  VAL  15          3HG2      VAL  15  -1.057   4.049  -2.314
  123   HG22  VAL  15          1HG2      VAL  15   0.712   4.187  -2.428
  124   HG23  VAL  15          2HG2      VAL  15  -0.054   3.860  -0.856
  125    H    VAL  16           HN       VAL  16  -1.202   7.478   1.516
  126    HA   VAL  16           HA       VAL  16  -1.704  10.077   0.168
  127    HB   VAL  16           HB       VAL  16  -2.427  10.890   2.476
  128   HG11  VAL  16          1HG1      VAL  16  -4.721  10.046   2.187
  129   HG12  VAL  16          2HG1      VAL  16  -3.990  10.494   0.629
  130   HG13  VAL  16          3HG1      VAL  16  -4.115   8.780   1.094
  131   HG21  VAL  16          3HG2      VAL  16  -1.536   9.027   3.795
  132   HG22  VAL  16          1HG2      VAL  16  -3.290   9.193   4.036
  133   HG23  VAL  16          2HG2      VAL  16  -2.657   7.907   2.984
  134    H    LYS  17           HN       LYS  17   0.197   8.406   2.693
  135    HA   LYS  17           HA       LYS  17   2.203  10.561   2.338
  136    HB2  LYS  17           2HB      LYS  17   0.702  10.903   4.407
  137    HB3  LYS  17           3HB      LYS  17   1.544   9.487   5.083
  138    HG2  LYS  17           2HG      LYS  17   3.693  10.653   4.826
  139    HG3  LYS  17           3HG      LYS  17   2.840  12.072   4.173
  140    HD2  LYS  17           2HD      LYS  17   1.533  12.156   6.329
  141    HD3  LYS  17           3HD      LYS  17   2.625  10.901   6.960
  142    HE2  LYS  17           2HE      LYS  17   3.412  13.665   5.982
  143    HE3  LYS  17           3HE      LYS  17   3.378  13.108   7.670
  144    HZ1  LYS  17           3HZ      LYS  17   5.126  12.047   5.552
  145    HZ2  LYS  17           1HZ      LYS  17   5.594  13.061   6.764
  146    HZ3  LYS  17           2HZ      LYS  17   5.093  11.531   7.118
  147    H    LEU  18           HN       LEU  18   4.338   9.943   2.741
  148    HA   LEU  18           HA       LEU  18   4.723   6.999   3.015
  149    HB2  LEU  18           2HB      LEU  18   6.276   9.008   1.358
  150    HB3  LEU  18           3HB      LEU  18   6.714   7.296   1.574
  151    HG   LEU  18           HG       LEU  18   4.105   8.222   0.343
  152   HD11  LEU  18          1HD1      LEU  18   5.117   7.688  -1.836
  153   HD12  LEU  18          2HD1      LEU  18   5.991   9.004  -1.020
  154   HD13  LEU  18          3HD1      LEU  18   6.670   7.358  -1.033
  155   HD21  LEU  18          3HD2      LEU  18   4.102   5.959   1.286
  156   HD22  LEU  18          1HD2      LEU  18   4.014   5.911  -0.491
  157   HD23  LEU  18          2HD2      LEU  18   5.550   5.555   0.333
  158    H    HIS  19           HN       HIS  19   5.602   6.534   4.909
  159    HA   HIS  19           HA       HIS  19   6.784   8.574   6.570
  160    HB2  HIS  19           2HB      HIS  19   6.481   5.573   6.849
  161    HB3  HIS  19           3HB      HIS  19   7.256   6.581   8.085
  162    HD1  HIS  19           1HD      HIS  19   5.723   7.093   9.923
  163    HD2  HIS  19           2HD      HIS  19   3.704   6.848   6.275
  164    HE1  HIS  19           1HE      HIS  19   3.285   7.542  10.435
  165    HE2  HIS  19           2HE      HIS  19   2.063   7.385   8.220
  166    H    GLY  20           HN       GLY  20   8.058   6.660   4.069
  167    HA2  GLY  20           1HA      GLY  20  10.667   6.134   5.059
  168    HA3  GLY  20           2HA      GLY  20  10.215   6.340   3.351
  169    H    THR  21           HN       THR  21  12.631   7.226   4.764
  170    HA   THR  21           HA       THR  21  12.570   9.948   5.461
  171    HB   THR  21           HB       THR  21  15.053   9.854   4.771
  172    HG1  THR  21           1HG      THR  21  15.781   7.697   4.362
  173   HG21  THR  21          3HG2      THR  21  13.981   7.748   6.679
  174   HG22  THR  21          1HG2      THR  21  15.641   8.386   6.662
  175   HG23  THR  21          2HG2      THR  21  14.281   9.457   7.072
  176    H    GLY  22           HN       GLY  22  14.310   8.913   2.523
  177    HA2  GLY  22           1HA      GLY  22  12.694  10.799   0.921
  178    HA3  GLY  22           2HA      GLY  22  14.445  11.088   1.033
  179    H    ALA  23           HN       ALA  23  15.701   8.847   0.776
  180    HA   ALA  23           HA       ALA  23  15.348   7.994  -1.903
  181    HB1  ALA  23           1HB      ALA  23  16.984   6.241  -1.345
  182    HB2  ALA  23           2HB      ALA  23  17.478   7.820  -0.690
  183    HB3  ALA  23           3HB      ALA  23  16.768   6.591   0.386
  184    H    LEU  24           HN       LEU  24  14.207   6.676   1.186
  185    HA   LEU  24           HA       LEU  24  13.139   4.237   0.263
  186    HB2  LEU  24           2HB      LEU  24  12.479   6.123   2.506
  187    HB3  LEU  24           3HB      LEU  24  11.391   4.758   2.162
  188    HG   LEU  24           HG       LEU  24  12.941   4.248   3.972
  189   HD11  LEU  24          1HD1      LEU  24  13.795   2.112   3.102
  190   HD12  LEU  24          2HD1      LEU  24  12.145   2.440   2.524
  191   HD13  LEU  24          3HD1      LEU  24  13.534   2.687   1.440
  192   HD21  LEU  24          3HD2      LEU  24  14.810   5.680   3.302
  193   HD22  LEU  24          1HD2      LEU  24  15.353   4.007   3.561
  194   HD23  LEU  24          2HD2      LEU  24  15.130   4.621   1.907
  195    H    LYS  25           HN       LYS  25  11.660   7.501   0.415
  196    HA   LYS  25           HA       LYS  25   9.093   6.741  -0.498
  197    HB2  LYS  25           2HB      LYS  25  10.628   9.336  -0.823
  198    HB3  LYS  25           3HB      LYS  25   8.909   9.131  -1.241
  199    HG2  LYS  25           2HG      LYS  25   8.655   8.351   1.219
  200    HG3  LYS  25           3HG      LYS  25  10.225   9.155   1.458
  201    HD2  LYS  25           2HD      LYS  25   7.744  10.447   0.274
  202    HD3  LYS  25           3HD      LYS  25   8.312  10.648   1.950
  203    HE2  LYS  25           2HE      LYS  25  10.183  11.265  -0.311
  204    HE3  LYS  25           3HE      LYS  25   8.896  12.425   0.087
  205    HZ1  LYS  25           3HZ      LYS  25  10.928  11.411   1.956
  206    HZ2  LYS  25           1HZ      LYS  25  10.921  12.906   1.261
  207    HZ3  LYS  25           2HZ      LYS  25   9.735  12.488   2.325
  208    H    ARG  26           HN       ARG  26  11.878   8.082  -2.305
  209    HA   ARG  26           HA       ARG  26  10.666   8.022  -4.848
  210    HB2  ARG  26           2HB      ARG  26  12.692   9.275  -4.433
  211    HB3  ARG  26           3HB      ARG  26  13.584   7.780  -4.060
  212    HG2  ARG  26           2HG      ARG  26  13.330   7.026  -6.363
  213    HG3  ARG  26           3HG      ARG  26  12.369   8.472  -6.750
  214    HD2  ARG  26           2HD      ARG  26  14.260   9.910  -6.343
  215    HD3  ARG  26           3HD      ARG  26  15.227   8.543  -5.747
  216    HE   ARG  26           HE       ARG  26  14.521   7.786  -8.294
  217   HH11  ARG  26          2HH1      ARG  26  15.998  10.681  -6.943
  218   HH12  ARG  26          1HH1      ARG  26  16.998  10.977  -8.346
  219   HH21  ARG  26          2HH2      ARG  26  15.860   8.157 -10.101
  220   HH22  ARG  26          1HH2      ARG  26  16.921   9.548 -10.134
  221    H    ARG  27           HN       ARG  27  12.507   5.502  -3.103
  222    HA   ARG  27           HA       ARG  27  12.784   3.740  -5.302
  223    HB2  ARG  27           2HB      ARG  27  14.018   3.517  -3.177
  224    HB3  ARG  27           3HB      ARG  27  12.507   3.047  -2.362
  225    HG2  ARG  27           2HG      ARG  27  13.963   1.121  -2.938
  226    HG3  ARG  27           3HG      ARG  27  12.352   1.039  -3.691
  227    HD2  ARG  27           2HD      ARG  27  13.311   1.962  -5.780
  228    HD3  ARG  27           3HD      ARG  27  14.918   1.965  -5.023
  229    HE   ARG  27           HE       ARG  27  14.562  -0.548  -4.788
  230   HH11  ARG  27          2HH1      ARG  27  13.051   1.363  -7.330
  231   HH12  ARG  27          1HH1      ARG  27  12.984   0.034  -8.465
  232   HH21  ARG  27          2HH2      ARG  27  14.492  -2.273  -6.282
  233   HH22  ARG  27          1HH2      ARG  27  13.801  -2.027  -7.870
  234    H    ILE  28           HN       ILE  28  10.246   3.924  -2.776
  235    HA   ILE  28           HA       ILE  28   8.674   1.781  -3.753
  236    HB   ILE  28           HB       ILE  28   7.764   4.291  -2.287
  237   HG12  ILE  28          2HG1      ILE  28   8.583   1.582  -1.189
  238   HG13  ILE  28          3HG1      ILE  28   9.624   3.026  -1.200
  239   HG21  ILE  28          1HG2      ILE  28   5.892   2.890  -1.518
  240   HG22  ILE  28          2HG2      ILE  28   5.908   3.032  -3.291
  241   HG23  ILE  28          3HG2      ILE  28   6.493   1.541  -2.511
  242   HD11  ILE  28          3HD1      ILE  28   6.978   2.753   0.245
  243   HD12  ILE  28          1HD1      ILE  28   8.583   2.695   1.003
  244   HD13  ILE  28          2HD1      ILE  28   8.021   4.195   0.235
  245    H    MET  29           HN       MET  29   8.580   5.293  -4.464
  246    HA   MET  29           HA       MET  29   6.314   5.132  -6.208
  247    HB2  MET  29           2HB      MET  29   8.551   7.178  -6.067
  248    HB3  MET  29           3HB      MET  29   7.046   7.367  -6.997
  249    HG2  MET  29           2HG      MET  29   5.772   7.165  -4.862
  250    HG3  MET  29           3HG      MET  29   7.313   7.140  -3.989
  251    HE1  MET  29           3HE      MET  29   9.022   9.203  -5.798
  252    HE2  MET  29           1HE      MET  29   8.770  10.711  -4.888
  253    HE3  MET  29           2HE      MET  29   9.054   9.187  -4.018
  254    H    ASP  30           HN       ASP  30   9.756   4.653  -6.640
  255    HA   ASP  30           HA       ASP  30   9.875   4.862  -9.477
  256    HB2  ASP  30           2HB      ASP  30  11.836   4.875  -7.955
  257    HB3  ASP  30           3HB      ASP  30  11.543   3.162  -7.587
  258    HD2  ASP  30           2HD      ASP  30  13.174   2.167 -10.440
  259    H    MET  31           HN       MET  31   9.033   2.223  -7.276
  260    HA   MET  31           HA       MET  31   8.946   0.229  -9.382
  261    HB2  MET  31           2HB      MET  31   7.990   0.261  -6.510
  262    HB3  MET  31           3HB      MET  31   7.806  -1.143  -7.589
  263    HG2  MET  31           2HG      MET  31  10.215  -1.303  -7.847
  264    HG3  MET  31           3HG      MET  31  10.447   0.162  -6.878
  265    HE1  MET  31           3HE      MET  31   8.352  -0.171  -4.544
  266    HE2  MET  31           1HE      MET  31   9.338  -0.987  -3.309
  267    HE3  MET  31           2HE      MET  31  10.045   0.317  -4.289
  268    H    GLY  32           HN       GLY  32   6.805   2.693  -8.230
  269    HA2  GLY  32           1HA      GLY  32   5.075   3.064 -10.049
  270    HA3  GLY  32           2HA      GLY  32   4.597   1.380  -9.739
  271    H    ILE  33           HN       ILE  33   5.408   2.366  -6.755
  272    HA   ILE  33           HA       ILE  33   2.569   2.979  -6.193
  273    HB   ILE  33           HB       ILE  33   4.769   2.184  -4.246
  274   HG12  ILE  33          2HG1      ILE  33   2.592   0.494  -5.518
  275   HG13  ILE  33          3HG1      ILE  33   4.324   0.433  -5.926
  276   HG21  ILE  33          1HG2      ILE  33   2.893   1.704  -2.722
  277   HG22  ILE  33          2HG2      ILE  33   2.898   3.411  -3.223
  278   HG23  ILE  33          3HG2      ILE  33   1.744   2.271  -3.956
  279   HD11  ILE  33          3HD1      ILE  33   3.104  -0.245  -3.239
  280   HD12  ILE  33          1HD1      ILE  33   3.693  -1.418  -4.435
  281   HD13  ILE  33          2HD1      ILE  33   4.835  -0.309  -3.650
  282    H    THR  34           HN       THR  34   2.218   5.129  -6.325
  283    HA   THR  34           HA       THR  34   3.899   6.794  -4.527
  284    HB   THR  34           HB       THR  34   4.473   7.298  -6.890
  285    HG1  THR  34           1HG      THR  34   4.080   9.568  -6.703
  286   HG21  THR  34          3HG2      THR  34   1.560   8.121  -7.125
  287   HG22  THR  34          1HG2      THR  34   2.814   8.380  -8.358
  288   HG23  THR  34          2HG2      THR  34   2.322   6.727  -7.928
  289    H    ARG  35           HN       ARG  35   2.677   8.977  -4.125
  290    HA   ARG  35           HA       ARG  35   0.257   8.229  -2.779
  291    HB2  ARG  35           2HB      ARG  35   0.120  10.628  -2.204
  292    HB3  ARG  35           3HB      ARG  35   1.713   9.915  -1.852
  293    HG2  ARG  35           2HG      ARG  35   2.564  10.903  -3.973
  294    HG3  ARG  35           3HG      ARG  35   0.992  11.711  -4.183
  295    HD2  ARG  35           2HD      ARG  35   2.912  12.073  -1.860
  296    HD3  ARG  35           3HD      ARG  35   2.612  13.234  -3.171
  297    HE   ARG  35           HE       ARG  35   0.142  13.007  -2.221
  298   HH11  ARG  35          2HH1      ARG  35   3.196  13.316  -0.492
  299   HH12  ARG  35          1HH1      ARG  35   2.471  14.074   0.907
  300   HH21  ARG  35          2HH2      ARG  35  -0.799  13.965  -0.382
  301   HH22  ARG  35          1HH2      ARG  35   0.205  14.442   0.970
  302    H    GLY  36           HN       GLY  36  -1.868   8.736  -3.197
  303    HA2  GLY  36           1HA      GLY  36  -3.611   9.702  -4.483
  304    HA3  GLY  36           2HA      GLY  36  -2.452  10.033  -5.790
  305    H    CYS  37           HN       CYS  37  -1.373   7.192  -5.381
  306    HA   CYS  37           HA       CYS  37  -3.170   5.960  -7.304
  307    HB2  CYS  37           2HB      CYS  37  -0.678   4.974  -5.894
  308    HB3  CYS  37           3HB      CYS  37  -1.579   4.034  -7.111
  309    HG   CYS  37           HG       CYS  37   0.632   4.952  -8.153
  310    H    GLU  38           HN       GLU  38  -4.337   4.069  -7.064
  311    HA   GLU  38           HA       GLU  38  -5.345   3.619  -4.341
  312    HB2  GLU  38           2HB      GLU  38  -6.987   2.151  -5.525
  313    HB3  GLU  38           3HB      GLU  38  -6.985   3.839  -6.092
  314    HG2  GLU  38           2HG      GLU  38  -5.575   3.172  -7.997
  315    HG3  GLU  38           3HG      GLU  38  -5.643   1.486  -7.441
  316    HE2  GLU  38           2HE      GLU  38  -8.736   2.982  -9.379
  317    H    ILE  39           HN       ILE  39  -5.021   1.830  -3.142
  318    HA   ILE  39           HA       ILE  39  -3.358  -0.335  -4.336
  319    HB   ILE  39           HB       ILE  39  -3.139   0.703  -1.478
  320   HG12  ILE  39          2HG1      ILE  39  -2.360   2.394  -3.125
  321   HG13  ILE  39          3HG1      ILE  39  -1.079   1.786  -2.049
  322   HG21  ILE  39          1HG2      ILE  39  -1.104  -0.681  -1.399
  323   HG22  ILE  39          2HG2      ILE  39  -2.539  -1.655  -1.790
  324   HG23  ILE  39          3HG2      ILE  39  -1.394  -1.200  -3.075
  325   HD11  ILE  39          3HD1      ILE  39  -1.548   0.936  -4.914
  326   HD12  ILE  39          1HD1      ILE  39  -0.265   2.030  -4.354
  327   HD13  ILE  39          2HD1      ILE  39  -0.266   0.330  -3.837
  328    H    TYR  40           HN       TYR  40  -4.664  -2.162  -4.335
  329    HA   TYR  40           HA       TYR  40  -6.159  -2.546  -1.792
  330    HB2  TYR  40           2HB      TYR  40  -7.829  -3.717  -2.826
  331    HB3  TYR  40           3HB      TYR  40  -7.450  -2.473  -4.029
  332    HD1  TYR  40           2HD      TYR  40  -7.156  -6.062  -3.217
  333    HD2  TYR  40           1HD      TYR  40  -6.620  -3.076  -6.209
  334    HE1  TYR  40           2HE      TYR  40  -6.908  -7.814  -4.912
  335    HE2  TYR  40           1HE      TYR  40  -6.400  -4.832  -7.916
  336    HH   TYR  40           HH       TYR  40  -6.589  -8.302  -7.100
  337    H    ILE  41           HN       ILE  41  -5.673  -4.194  -0.512
  338    HA   ILE  41           HA       ILE  41  -3.136  -5.464  -1.008
  339    HB   ILE  41           HB       ILE  41  -5.128  -5.986   1.232
  340   HG12  ILE  41          2HG1      ILE  41  -3.329  -4.572   2.496
  341   HG13  ILE  41          3HG1      ILE  41  -2.926  -3.962   0.873
  342   HG21  ILE  41          1HG2      ILE  41  -3.177  -6.886   2.434
  343   HG22  ILE  41          2HG2      ILE  41  -3.483  -7.785   0.930
  344   HG23  ILE  41          3HG2      ILE  41  -2.161  -6.595   1.002
  345   HD11  ILE  41          3HD1      ILE  41  -5.635  -3.789   2.217
  346   HD12  ILE  41          1HD1      ILE  41  -4.484  -2.450   2.032
  347   HD13  ILE  41          2HD1      ILE  41  -5.229  -3.178   0.595
  348    H    ARG  42           HN       ARG  42  -2.836  -7.164  -2.240
  349    HA   ARG  42           HA       ARG  42  -5.182  -8.694  -3.119
  350    HB2  ARG  42           2HB      ARG  42  -3.375  -7.679  -4.613
  351    HB3  ARG  42           3HB      ARG  42  -2.302  -8.968  -4.019
  352    HG2  ARG  42           2HG      ARG  42  -4.944  -9.631  -5.297
  353    HG3  ARG  42           3HG      ARG  42  -3.511  -9.266  -6.288
  354    HD2  ARG  42           2HD      ARG  42  -2.461 -11.058  -4.536
  355    HD3  ARG  42           3HD      ARG  42  -4.136 -11.641  -4.630
  356    HE   ARG  42           HE       ARG  42  -2.835 -11.085  -7.195
  357   HH11  ARG  42          2HH1      ARG  42  -3.778 -13.499  -4.804
  358   HH12  ARG  42          1HH1      ARG  42  -3.515 -14.845  -5.890
  359   HH21  ARG  42          2HH2      ARG  42  -2.444 -12.826  -8.565
  360   HH22  ARG  42          1HH2      ARG  42  -2.758 -14.461  -8.025
  361    H    LYS  43           HN       LYS  43  -1.892  -9.472  -1.847
  362    HA   LYS  43           HA       LYS  43  -3.058 -11.889  -0.610
  363    HB2  LYS  43           2HB      LYS  43  -2.253 -12.470  -2.922
  364    HB3  LYS  43           3HB      LYS  43  -0.617 -11.998  -2.405
  365    HG2  LYS  43           2HG      LYS  43  -0.658 -13.728  -0.678
  366    HG3  LYS  43           3HG      LYS  43  -2.300 -14.197  -1.181
  367    HD2  LYS  43           2HD      LYS  43  -1.424 -14.735  -3.435
  368    HD3  LYS  43           3HD      LYS  43   0.216 -14.337  -2.869
  369    HE2  LYS  43           2HE      LYS  43  -1.592 -16.549  -1.862
  370    HE3  LYS  43           3HE      LYS  43  -0.080 -16.727  -2.778
  371    HZ1  LYS  43           3HZ      LYS  43  -0.320 -15.606  -0.068
  372    HZ2  LYS  43           1HZ      LYS  43   0.248 -17.108  -0.440
  373    HZ3  LYS  43           2HZ      LYS  43   1.084 -15.770  -0.919
  374    H    VAL  44           HN       VAL  44  -2.397 -11.985   1.432
  375    HA   VAL  44           HA       VAL  44   0.228 -10.744   2.095
  376    HB   VAL  44           HB       VAL  44  -2.072 -11.429   3.968
  377   HG11  VAL  44          1HG1      VAL  44  -0.856 -10.058   5.605
  378   HG12  VAL  44          2HG1      VAL  44   0.121 -11.437   5.053
  379   HG13  VAL  44          3HG1      VAL  44   0.447  -9.805   4.422
  380   HG21  VAL  44          3HG2      VAL  44  -2.714  -9.651   2.414
  381   HG22  VAL  44          1HG2      VAL  44  -2.513  -9.014   4.062
  382   HG23  VAL  44          2HG2      VAL  44  -1.248  -8.737   2.843
  383    H    ALA  45           HN       ALA  45   1.872 -12.080   2.606
  384    HA   ALA  45           HA       ALA  45   1.545 -14.908   2.797
  385    HB1  ALA  45           1HB      ALA  45   3.888 -14.910   3.550
  386    HB2  ALA  45           2HB      ALA  45   3.661 -13.838   2.148
  387    HB3  ALA  45           3HB      ALA  45   3.816 -13.147   3.781
  388    HA   PRO  46           HA       PRO  46  -0.051 -15.837   6.764
  389    HB2  PRO  46           2HB      PRO  46   2.159 -17.566   7.559
  390    HB3  PRO  46           3HB      PRO  46   0.550 -18.016   6.905
  391    HG2  PRO  46           2HG      PRO  46   3.123 -17.738   5.508
  392    HG3  PRO  46           3HG      PRO  46   1.723 -18.790   5.119
  393    HD2  PRO  46           2HD      PRO  46   2.338 -16.605   3.654
  394    HD3  PRO  46           3HD      PRO  46   0.636 -17.043   3.994
  395    H    LEU  47           HN       LEU  47   3.500 -15.377   6.750
  396    HA   LEU  47           HA       LEU  47   3.618 -14.626   9.527
  397    HB2  LEU  47           2HB      LEU  47   5.457 -15.637   8.146
  398    HB3  LEU  47           3HB      LEU  47   5.606 -14.075   7.305
  399    HG   LEU  47           HG       LEU  47   7.282 -14.647   9.159
  400   HD11  LEU  47          1HD1      LEU  47   7.417 -12.300   9.886
  401   HD12  LEU  47          2HD1      LEU  47   7.079 -12.427   8.145
  402   HD13  LEU  47          3HD1      LEU  47   5.769 -12.020   9.279
  403   HD21  LEU  47          3HD2      LEU  47   5.656 -15.441  10.811
  404   HD22  LEU  47          1HD2      LEU  47   6.583 -14.061  11.444
  405   HD23  LEU  47          2HD2      LEU  47   4.917 -13.824  10.870
  406    H    GLY  48           HN       GLY  48   3.216 -12.884   6.476
  407    HA2  GLY  48           1HA      GLY  48   2.129 -10.676   6.640
  408    HA3  GLY  48           2HA      GLY  48   3.168 -10.347   8.046
  409    H    ASP  49           HN       ASP  49   5.073 -12.077   6.083
  410    HA   ASP  49           HA       ASP  49   5.862  -9.819   4.331
  411    HB2  ASP  49           2HB      ASP  49   7.253  -9.662   6.363
  412    HB3  ASP  49           3HB      ASP  49   7.746 -11.357   6.160
  413    HD2  ASP  49           2HD      ASP  49   9.377  -8.617   3.794
  414    HA   PRO  50           HA       PRO  50   6.438  -9.401   2.718
  415    HB2  PRO  50           2HB      PRO  50   6.283  -9.396   0.027
  416    HB3  PRO  50           3HB      PRO  50   7.775  -9.969   0.842
  417    HG2  PRO  50           2HG      PRO  50   5.529 -11.593  -0.277
  418    HG3  PRO  50           3HG      PRO  50   7.292 -11.807  -0.529
  419    HD2  PRO  50           2HD      PRO  50   5.749 -13.188   1.339
  420    HD3  PRO  50           3HD      PRO  50   7.510 -12.906   1.498
  421    H    ILE  51           HN       ILE  51   4.888  -8.040   1.209
  422    HA   ILE  51           HA       ILE  51   2.178  -9.261   1.328
  423    HB   ILE  51           HB       ILE  51   2.945  -6.332   1.664
  424   HG12  ILE  51          2HG1      ILE  51   1.747  -8.316   3.625
  425   HG13  ILE  51          3HG1      ILE  51   3.433  -7.747   3.626
  426   HG21  ILE  51          1HG2      ILE  51   0.543  -5.966   2.079
  427   HG22  ILE  51          2HG2      ILE  51   0.828  -6.612   0.445
  428   HG23  ILE  51          3HG2      ILE  51   0.223  -7.682   1.732
  429   HD11  ILE  51          3HD1      ILE  51   0.977  -6.029   4.051
  430   HD12  ILE  51          1HD1      ILE  51   2.095  -6.570   5.320
  431   HD13  ILE  51          2HD1      ILE  51   2.663  -5.462   4.055
  432    H    GLN  52           HN       GLN  52   1.300  -9.591  -0.602
  433    HA   GLN  52           HA       GLN  52   2.452  -8.172  -2.924
  434    HB2  GLN  52           2HB      GLN  52   2.264 -10.645  -2.953
  435    HB3  GLN  52           3HB      GLN  52   0.497 -10.488  -2.803
  436    HG2  GLN  52           2HG      GLN  52   0.360  -9.401  -4.952
  437    HG3  GLN  52           3HG      GLN  52   2.132  -9.362  -5.089
  438   HE21  GLN  52          1HE2      GLN  52   3.281 -11.277  -5.535
  439   HE22  GLN  52          2HE2      GLN  52   2.480 -12.703  -6.160
  440    H    ILE  53           HN       ILE  53   1.526  -6.393  -3.601
  441    HA   ILE  53           HA       ILE  53  -1.408  -6.117  -3.229
  442    HB   ILE  53           HB       ILE  53  -0.709  -3.536  -3.229
  443   HG12  ILE  53          2HG1      ILE  53   1.300  -3.264  -1.721
  444   HG13  ILE  53          3HG1      ILE  53   1.711  -4.958  -2.085
  445   HG21  ILE  53          1HG2      ILE  53  -0.849  -3.591  -0.773
  446   HG22  ILE  53          2HG2      ILE  53  -2.031  -4.695  -1.516
  447   HG23  ILE  53          3HG2      ILE  53  -0.537  -5.342  -0.795
  448   HD11  ILE  53          3HD1      ILE  53   1.512  -2.705  -4.093
  449   HD12  ILE  53          1HD1      ILE  53   3.019  -3.407  -3.470
  450   HD13  ILE  53          2HD1      ILE  53   1.924  -4.398  -4.454
  451    H    ASN  54           HN       ASN  54  -2.560  -4.987  -4.852
  452    HA   ASN  54           HA       ASN  54  -1.141  -5.135  -7.450
  453    HB2  ASN  54           2HB      ASN  54  -3.268  -6.396  -7.163
  454    HB3  ASN  54           3HB      ASN  54  -4.112  -4.856  -6.887
  455   HD21  ASN  54          1HD2      ASN  54  -2.561  -6.948  -9.235
  456   HD22  ASN  54          2HD2      ASN  54  -3.090  -6.081 -10.661
  457    H    VAL  55           HN       VAL  55  -0.272  -3.338  -8.173
  458    HA   VAL  55           HA       VAL  55  -1.661  -0.768  -7.585
  459    HB   VAL  55           HB       VAL  55   1.318  -1.166  -8.042
  460   HG11  VAL  55          1HG1      VAL  55   1.503   1.127  -7.177
  461   HG12  VAL  55          2HG1      VAL  55   0.468   1.055  -8.623
  462   HG13  VAL  55          3HG1      VAL  55  -0.267   1.204  -7.008
  463   HG21  VAL  55          3HG2      VAL  55   0.644  -2.286  -5.971
  464   HG22  VAL  55          1HG2      VAL  55   1.605  -0.830  -5.623
  465   HG23  VAL  55          2HG2      VAL  55  -0.162  -0.797  -5.420
  466    H    ARG  56           HN       ARG  56  -2.394   0.267  -9.314
  467    HA   ARG  56           HA       ARG  56  -2.621   1.040 -11.451
  468    HB2  ARG  56           2HB      ARG  56   0.171  -0.052 -11.933
  469    HB3  ARG  56           3HB      ARG  56  -0.705   1.117 -12.950
  470    HG2  ARG  56           2HG      ARG  56   0.216   1.574 -10.099
  471    HG3  ARG  56           3HG      ARG  56   0.997   2.208 -11.569
  472    HD2  ARG  56           2HD      ARG  56  -1.842   2.817 -10.692
  473    HD3  ARG  56           3HD      ARG  56  -0.441   3.880 -10.437
  474    HE   ARG  56           HE       ARG  56  -0.797   3.148 -13.215
  475   HH11  ARG  56          2HH1      ARG  56  -1.781   5.351 -10.654
  476   HH12  ARG  56          1HH1      ARG  56  -2.312   6.599 -11.758
  477   HH21  ARG  56          2HH2      ARG  56  -1.514   4.772 -14.650
  478   HH22  ARG  56          1HH2      ARG  56  -2.161   6.271 -14.022
  479    H    GLY  57           HN       GLY  57  -2.882  -1.968 -10.577
  480    HA2  GLY  57           1HA      GLY  57  -4.113  -3.583 -11.826
  481    HA3  GLY  57           2HA      GLY  57  -3.401  -2.946 -13.326
  482    H    TYR  58           HN       TYR  58  -0.782  -2.878 -11.598
  483    HA   TYR  58           HA       TYR  58   0.002  -5.636 -12.369
  484    HB2  TYR  58           2HB      TYR  58   1.188  -3.619 -13.322
  485    HB3  TYR  58           3HB      TYR  58   1.748  -3.247 -11.683
  486    HD1  TYR  58           1HD      TYR  58   1.920  -5.789 -14.390
  487    HD2  TYR  58           2HD      TYR  58   3.656  -4.348 -10.776
  488    HE1  TYR  58           1HE      TYR  58   3.850  -7.266 -14.728
  489    HE2  TYR  58           2HE      TYR  58   5.588  -5.826 -11.113
  490    HH   TYR  58           HH       TYR  58   6.573  -7.389 -12.438
  491    H    GLU  59           HN       GLU  59   0.642  -7.109 -10.874
  492    HA   GLU  59           HA       GLU  59   0.281  -6.371  -8.076
  493    HB2  GLU  59           2HB      GLU  59   0.797  -8.818  -7.685
  494    HB3  GLU  59           3HB      GLU  59  -0.656  -8.453  -8.645
  495    HG2  GLU  59           2HG      GLU  59   1.960  -9.076  -9.987
  496    HG3  GLU  59           3HG      GLU  59   0.916 -10.377  -9.379
  497    HE2  GLU  59           2HE      GLU  59  -1.351  -9.950 -11.959
  498    H    LEU  60           HN       LEU  60   1.785  -5.782  -6.710
  499    HA   LEU  60           HA       LEU  60   4.624  -6.375  -7.403
  500    HB2  LEU  60           2HB      LEU  60   3.394  -3.994  -5.988
  501    HB3  LEU  60           3HB      LEU  60   5.141  -4.332  -6.027
  502    HG   LEU  60           HG       LEU  60   3.418  -3.844  -8.471
  503   HD11  LEU  60          1HD1      LEU  60   4.518  -1.643  -8.570
  504   HD12  LEU  60          2HD1      LEU  60   3.576  -1.830  -7.073
  505   HD13  LEU  60          3HD1      LEU  60   5.348  -1.990  -7.035
  506   HD21  LEU  60          3HD2      LEU  60   5.398  -5.240  -8.881
  507   HD22  LEU  60          1HD2      LEU  60   5.583  -3.635  -9.626
  508   HD23  LEU  60          2HD2      LEU  60   6.429  -4.012  -8.107
  509    H    SER  61           HN       SER  61   6.050  -6.802  -5.641
  510    HA   SER  61           HA       SER  61   4.617  -7.761  -3.206
  511    HB2  SER  61           2HB      SER  61   5.472  -9.604  -4.636
  512    HB3  SER  61           3HB      SER  61   7.111  -8.922  -4.510
  513    HG   SER  61           HG       SER  61   6.731 -10.610  -2.996
  514    H    LEU  62           HN       LEU  62   4.994  -6.273  -1.666
  515    HA   LEU  62           HA       LEU  62   7.770  -5.238  -1.433
  516    HB2  LEU  62           2HB      LEU  62   5.095  -4.169  -0.563
  517    HB3  LEU  62           3HB      LEU  62   6.591  -3.636   0.239
  518    HG   LEU  62           HG       LEU  62   5.838  -3.288  -2.670
  519   HD11  LEU  62          1HD1      LEU  62   5.970  -0.888  -2.128
  520   HD12  LEU  62          2HD1      LEU  62   4.766  -1.718  -1.116
  521   HD13  LEU  62          3HD1      LEU  62   6.356  -1.294  -0.439
  522   HD21  LEU  62          3HD2      LEU  62   8.225  -3.821  -2.457
  523   HD22  LEU  62          1HD2      LEU  62   7.991  -2.117  -2.910
  524   HD23  LEU  62          2HD2      LEU  62   8.406  -2.541  -1.233
  525    H    ARG  63           HN       ARG  63   8.931  -5.486   0.440
  526    HA   ARG  63           HA       ARG  63   8.075  -7.591   2.226
  527    HB2  ARG  63           2HB      ARG  63  10.384  -5.632   2.416
  528    HB3  ARG  63           3HB      ARG  63  10.140  -7.046   3.469
  529    HG2  ARG  63           2HG      ARG  63  10.213  -8.475   1.394
  530    HG3  ARG  63           3HG      ARG  63  10.722  -7.021   0.501
  531    HD2  ARG  63           2HD      ARG  63  12.160  -8.309   2.841
  532    HD3  ARG  63           3HD      ARG  63  12.662  -8.348   1.137
  533    HE   ARG  63           HE       ARG  63  12.537  -5.681   1.639
  534   HH11  ARG  63          2HH1      ARG  63  14.061  -8.377   3.317
  535   HH12  ARG  63          1HH1      ARG  63  15.363  -7.403   3.964
  536   HH21  ARG  63          2HH2      ARG  63  14.232  -4.416   2.488
  537   HH22  ARG  63          1HH2      ARG  63  15.459  -5.154   3.492
  538    H    LYS  64           HN       LYS  64   7.918  -7.313   4.585
  539    HA   LYS  64           HA       LYS  64   5.804  -5.595   5.205
  540    HB2  LYS  64           2HB      LYS  64   6.265  -6.133   7.565
  541    HB3  LYS  64           3HB      LYS  64   6.297  -7.571   6.516
  542    HG2  LYS  64           2HG      LYS  64   8.727  -7.573   6.544
  543    HG3  LYS  64           3HG      LYS  64   8.738  -6.082   7.516
  544    HD2  LYS  64           2HD      LYS  64   7.510  -8.720   8.378
  545    HD3  LYS  64           3HD      LYS  64   9.117  -8.129   8.868
  546    HE2  LYS  64           2HE      LYS  64   6.498  -6.689   9.392
  547    HE3  LYS  64           3HE      LYS  64   7.349  -7.713  10.569
  548    HZ1  LYS  64           3HZ      LYS  64   8.422  -5.261   9.341
  549    HZ2  LYS  64           1HZ      LYS  64   7.852  -5.393  10.882
  550    HZ3  LYS  64           2HZ      LYS  64   9.211  -6.212  10.434
  551    H    SER  65           HN       SER  65   9.293  -5.071   5.546
  552    HA   SER  65           HA       SER  65   9.264  -2.838   7.249
  553    HB2  SER  65           2HB      SER  65  11.172  -3.173   4.921
  554    HB3  SER  65           3HB      SER  65  11.493  -2.487   6.533
  555    HG   SER  65           HG       SER  65  12.285  -4.634   6.304
  556    H    ALA  66           HN       ALA  66   8.871  -3.023   3.701
  557    HA   ALA  66           HA       ALA  66   8.816  -0.144   3.402
  558    HB1  ALA  66           1HB      ALA  66   8.183  -0.633   1.071
  559    HB2  ALA  66           2HB      ALA  66   9.574  -1.615   1.586
  560    HB3  ALA  66           3HB      ALA  66   7.954  -2.345   1.495
  561    H    ALA  67           HN       ALA  67   6.421  -2.708   3.858
  562    HA   ALA  67           HA       ALA  67   4.171  -1.059   3.130
  563    HB1  ALA  67           1HB      ALA  67   2.821  -2.876   4.099
  564    HB2  ALA  67           2HB      ALA  67   4.090  -3.511   3.025
  565    HB3  ALA  67           3HB      ALA  67   4.292  -3.598   4.792
  566    H    GLU  68           HN       GLU  68   6.000  -1.624   6.075
  567    HA   GLU  68           HA       GLU  68   4.051  -0.548   7.894
  568    HB2  GLU  68           2HB      GLU  68   7.064  -0.879   8.120
  569    HB3  GLU  68           3HB      GLU  68   5.996  -0.399   9.461
  570    HG2  GLU  68           2HG      GLU  68   4.826  -2.512   9.339
  571    HG3  GLU  68           3HG      GLU  68   5.771  -2.989   7.912
  572    HE2  GLU  68           2HE      GLU  68   7.245  -3.715  11.445
  573    H    MET  69           HN       MET  69   6.033   0.972   5.535
  574    HA   MET  69           HA       MET  69   5.953   3.495   7.106
  575    HB2  MET  69           2HB      MET  69   7.726   4.337   5.728
  576    HB3  MET  69           3HB      MET  69   8.191   2.731   6.339
  577    HG2  MET  69           2HG      MET  69   7.608   1.743   4.169
  578    HG3  MET  69           3HG      MET  69   7.155   3.344   3.560
  579    HE1  MET  69           3HE      MET  69  10.077   1.039   4.812
  580    HE2  MET  69           1HE      MET  69  11.467   2.146   4.774
  581    HE3  MET  69           2HE      MET  69  10.160   2.403   5.951
  582    H    ILE  70           HN       ILE  70   4.005   1.964   5.031
  583    HA   ILE  70           HA       ILE  70   3.523   4.331   3.318
  584    HB   ILE  70           HB       ILE  70   2.228   1.576   3.214
  585   HG12  ILE  70          2HG1      ILE  70   4.587   1.442   2.662
  586   HG13  ILE  70          3HG1      ILE  70   3.599   1.240   1.196
  587   HG21  ILE  70          1HG2      ILE  70   1.391   2.306   1.014
  588   HG22  ILE  70          2HG2      ILE  70   0.799   3.364   2.316
  589   HG23  ILE  70          3HG2      ILE  70   2.128   3.905   1.265
  590   HD11  ILE  70          3HD1      ILE  70   5.042   3.760   2.036
  591   HD12  ILE  70          1HD1      ILE  70   5.565   2.641   0.759
  592   HD13  ILE  70          2HD1      ILE  70   4.055   3.556   0.568
  593    H    GLU  71           HN       GLU  71   2.148   5.820   3.998
  594    HA   GLU  71           HA       GLU  71   0.044   5.117   5.958
  595    HB2  GLU  71           2HB      GLU  71   1.511   7.154   6.198
  596    HB3  GLU  71           3HB      GLU  71   0.754   7.800   4.723
  597    HG2  GLU  71           2HG      GLU  71  -0.407   8.853   6.433
  598    HG3  GLU  71           3HG      GLU  71  -1.471   7.502   5.987
  599    HE2  GLU  71           2HE      GLU  71   0.431   7.254   9.479
  600    H    VAL  72           HN       VAL  72  -1.962   4.586   5.255
  601    HA   VAL  72           HA       VAL  72  -2.732   5.589   2.567
  602    HB   VAL  72           HB       VAL  72  -3.951   3.427   2.206
  603   HG11  VAL  72          1HG1      VAL  72  -1.951   2.138   1.582
  604   HG12  VAL  72          2HG1      VAL  72  -1.772   3.857   1.167
  605   HG13  VAL  72          3HG1      VAL  72  -0.950   3.197   2.601
  606   HG21  VAL  72          3HG2      VAL  72  -4.111   2.717   4.548
  607   HG22  VAL  72          1HG2      VAL  72  -3.317   1.471   3.557
  608   HG23  VAL  72          2HG2      VAL  72  -2.343   2.518   4.614
  609    H    GLU  73           HN       GLU  73  -5.049   5.546   2.137
  610    HA   GLU  73           HA       GLU  73  -6.671   5.820   4.623
  611    HB2  GLU  73           2HB      GLU  73  -7.904   7.635   3.595
  612    HB3  GLU  73           3HB      GLU  73  -6.171   8.036   3.599
  613    HG2  GLU  73           2HG      GLU  73  -5.970   7.793   1.303
  614    HG3  GLU  73           3HG      GLU  73  -7.401   6.748   1.182
  615    HE2  GLU  73           2HE      GLU  73  -7.871  10.565   0.621
  616    H    LEU  74           HN       LEU  74  -8.837   5.109   4.471
  617    HA   LEU  74           HA       LEU  74  -9.423   3.336   2.204
  618    HB2  LEU  74           2HB      LEU  74 -10.722   3.972   4.840
  619    HB3  LEU  74           3HB      LEU  74 -11.678   3.216   3.544
  620    HG   LEU  74           HG       LEU  74 -10.894   1.548   5.105
  621   HD11  LEU  74          1HD1      LEU  74  -9.769   0.028   3.533
  622   HD12  LEU  74          2HD1      LEU  74 -11.083   0.929   2.743
  623   HD13  LEU  74          3HD1      LEU  74  -9.390   1.407   2.474
  624   HD21  LEU  74          3HD2      LEU  74  -8.914   2.713   5.952
  625   HD22  LEU  74          1HD2      LEU  74  -8.503   1.070   5.411
  626   HD23  LEU  74          2HD2      LEU  74  -8.094   2.468   4.392
  627    H    GLU  75           HN       GLU  75 -10.438   4.043   0.397
  628    HA   GLU  75           HA       GLU  75 -11.393   6.715   0.147
  629    HB2  GLU  75           2HB      GLU  75 -10.681   5.230  -1.738
  630    HB3  GLU  75           3HB      GLU  75 -12.203   4.330  -1.538
  631    HG2  GLU  75           2HG      GLU  75 -13.505   6.225  -2.147
  632    HG3  GLU  75           3HG      GLU  75 -12.098   7.305  -2.056
  633    HE2  GLU  75           2HE      GLU  75 -12.716   5.248  -5.360
  634    H    HIS  76           HN       HIS  76 -12.868   3.718   1.198
  635    HA   HIS  76           HA       HIS  76 -15.234   5.336   2.023
  636    HB2  HIS  76           2HB      HIS  76 -15.022   2.357   1.481
  637    HB3  HIS  76           3HB      HIS  76 -16.411   3.135   2.261
  638    HD1  HIS  76           1HD      HIS  76 -18.155   4.170   0.786
  639    HD2  HIS  76           2HD      HIS  76 -14.700   3.092  -1.304
  640    HE1  HIS  76           1HE      HIS  76 -18.702   4.435  -1.675
  641    HE2  HIS  76           2HE      HIS  76 -16.599   3.783  -2.935
  642    H    HIS  77           HN       HIS  77 -14.260   6.080   3.950
  643    HA   HIS  77           HA       HIS  77 -12.688   4.385   5.610
  644    HB2  HIS  77           2HB      HIS  77 -12.731   6.109   7.253
  645    HB3  HIS  77           3HB      HIS  77 -12.609   6.871   5.655
  646    HD1  HIS  77           1HD      HIS  77 -14.525   6.935   8.764
  647    HD2  HIS  77           2HD      HIS  77 -15.142   8.065   4.791
  648    HE1  HIS  77           1HE      HIS  77 -16.470   8.557   8.785
  649    HE2  HIS  77           2HE      HIS  77 -16.835   9.250   6.369
  650    H    HIS  78           HN       HIS  78 -13.104   3.203   7.393
  651    HA   HIS  78           HA       HIS  78 -15.687   1.948   7.398
  652    HB2  HIS  78           2HB      HIS  78 -13.180   1.640   9.046
  653    HB3  HIS  78           3HB      HIS  78 -14.663   0.758   9.453
  654    HD1  HIS  78           1HD      HIS  78 -14.372  -1.580   8.674
  655    HD2  HIS  78           2HD      HIS  78 -12.905   1.182   5.899
  656    HE1  HIS  78           1HE      HIS  78 -13.617  -2.927   6.667
  657    HE2  HIS  78           2HE      HIS  78 -12.730  -1.247   4.981
  658    H    HIS  79           HN       HIS  79 -17.375   3.044   8.091
  659    HA   HIS  79           HA       HIS  79 -17.269   4.811  10.392
  660    HB2  HIS  79           2HB      HIS  79 -18.779   5.226   8.494
  661    HB3  HIS  79           3HB      HIS  79 -19.602   3.685   8.798
  662    HD1  HIS  79           1HD      HIS  79 -19.385   7.223   9.973
  663    HD2  HIS  79           2HD      HIS  79 -21.369   3.702  11.027
  664    HE1  HIS  79           1HE      HIS  79 -21.205   7.900  11.596
  665    HE2  HIS  79           2HE      HIS  79 -22.415   5.762  12.231
  666    H    HIS  80           HN       HIS  80 -16.576   3.574  12.153
  667    HA   HIS  80           HA       HIS  80 -18.040   1.133  12.816
  668    HB2  HIS  80           2HB      HIS  80 -15.621   1.322  13.253
  669    HB3  HIS  80           3HB      HIS  80 -15.932   2.660  14.375
  670    HD1  HIS  80           1HD      HIS  80 -17.079  -0.977  13.992
  671    HD2  HIS  80           2HD      HIS  80 -16.069   1.807  16.939
  672    HE1  HIS  80           1HE      HIS  80 -17.244  -2.200  16.205
  673    HE2  HIS  80           2HE      HIS  80 -16.628  -0.504  17.992
  674    H    HIS  81           HN       HIS  81 -20.149   1.933  13.006
  675    HA   HIS  81           HA       HIS  81 -20.928   2.544  15.662
  676    HB2  HIS  81           2HB      HIS  81 -19.999   4.811  14.909
  677    HB3  HIS  81           3HB      HIS  81 -21.358   4.876  13.772
  678    HD1  HIS  81           1HD      HIS  81 -20.443   6.043  16.986
  679    HD2  HIS  81           2HD      HIS  81 -23.941   4.428  15.376
  680    HE1  HIS  81           1HE      HIS  81 -22.324   6.747  18.530
  681    HE2  HIS  81           2HE      HIS  81 -24.447   5.768  17.544
  Start of MODEL    9
    1    H1   MET   1           HN       MET   1  -1.405   5.737  13.269
    2    HA   MET   1           HA       MET   1  -1.764   7.268  10.905
    3    HB2  MET   1           2HB      MET   1   0.150   6.532   9.543
    4    HB3  MET   1           3HB      MET   1   0.664   7.556  10.905
    5    HG2  MET   1           2HG      MET   1   1.485   5.663  12.114
    6    HG3  MET   1           3HG      MET   1   0.772   4.535  10.949
    7    HE1  MET   1           3HE      MET   1   1.418   5.789   8.156
    8    HE2  MET   1           1HE      MET   1   2.977   5.023   7.776
    9    HE3  MET   1           2HE      MET   1   1.689   4.075   8.554
   10    H    PHE   2           HN       PHE   2  -2.828   6.073   9.371
   11    HA   PHE   2           HA       PHE   2  -3.263   3.235   9.968
   12    HB2  PHE   2           2HB      PHE   2  -5.124   4.719   9.232
   13    HB3  PHE   2           3HB      PHE   2  -4.310   4.922   7.671
   14    HD1  PHE   2           1HD      PHE   2  -5.599   2.239   9.942
   15    HD2  PHE   2           2HD      PHE   2  -4.825   3.465   5.936
   16    HE1  PHE   2           1HE      PHE   2  -6.695   0.205   9.108
   17    HE2  PHE   2           2HE      PHE   2  -5.926   1.435   5.102
   18    HZ   PHE   2           HZ       PHE   2  -6.853  -0.205   6.687
   19    H    SER   3           HN       SER   3  -1.852   1.776   9.319
   20    HA   SER   3           HA       SER   3   0.092   2.537   7.262
   21    HB2  SER   3           2HB      SER   3   0.995   1.610   9.278
   22    HB3  SER   3           3HB      SER   3  -0.117   0.221   9.210
   23    HG   SER   3           HG       SER   3   1.994  -0.291   8.460
   24    H    LEU   4           HN       LEU   4   0.595   1.371   5.445
   25    HA   LEU   4           HA       LEU   4  -1.534   0.152   4.003
   26    HB2  LEU   4           2HB      LEU   4   0.476   1.282   3.044
   27    HB3  LEU   4           3HB      LEU   4   1.463  -0.097   3.584
   28    HG   LEU   4           HG       LEU   4   0.095  -1.567   2.095
   29   HD11  LEU   4          1HD1      LEU   4  -1.242  -0.514   0.323
   30   HD12  LEU   4          2HD1      LEU   4  -1.897  -0.152   1.935
   31   HD13  LEU   4          3HD1      LEU   4  -0.959   1.081   1.059
   32   HD21  LEU   4          3HD2      LEU   4   2.295  -0.712   1.423
   33   HD22  LEU   4          1HD2      LEU   4   1.205  -0.840   0.023
   34   HD23  LEU   4          2HD2      LEU   4   1.530   0.748   0.755
   35    H    ARG   5           HN       ARG   5   0.636  -1.066   6.409
   36    HA   ARG   5           HA       ARG   5   0.666  -3.806   5.440
   37    HB2  ARG   5           2HB      ARG   5   2.042  -4.280   7.272
   38    HB3  ARG   5           3HB      ARG   5   2.433  -2.584   6.894
   39    HG2  ARG   5           2HG      ARG   5   1.184  -1.781   8.731
   40    HG3  ARG   5           3HG      ARG   5   0.398  -3.359   8.983
   41    HD2  ARG   5           2HD      ARG   5   2.654  -4.307   9.532
   42    HD3  ARG   5           3HD      ARG   5   3.308  -2.657   9.456
   43    HE   ARG   5           HE       ARG   5   1.088  -2.649  11.204
   44   HH11  ARG   5          2HH1      ARG   5   4.410  -3.817  11.019
   45   HH12  ARG   5          1HH1      ARG   5   4.612  -3.882  12.755
   46   HH21  ARG   5          2HH2      ARG   5   1.343  -2.780  13.455
   47   HH22  ARG   5          1HH2      ARG   5   2.871  -3.292  14.137
   48    H    ASP   6           HN       ASP   6  -1.596  -1.886   7.173
   49    HA   ASP   6           HA       ASP   6  -2.589  -4.132   8.792
   50    HB2  ASP   6           2HB      ASP   6  -2.501  -1.792   9.681
   51    HB3  ASP   6           3HB      ASP   6  -3.737  -1.338   8.487
   52    HD2  ASP   6           2HD      ASP   6  -4.843  -3.539  11.616
   53    H    ALA   7           HN       ALA   7  -3.102  -2.779   5.691
   54    HA   ALA   7           HA       ALA   7  -5.872  -3.331   5.363
   55    HB1  ALA   7           1HB      ALA   7  -5.385  -3.228   2.956
   56    HB2  ALA   7           2HB      ALA   7  -4.588  -1.904   3.838
   57    HB3  ALA   7           3HB      ALA   7  -3.642  -3.317   3.305
   58    H    LYS   8           HN       LYS   8  -6.881  -5.053   4.142
   59    HA   LYS   8           HA       LYS   8  -5.458  -7.629   4.624
   60    HB2  LYS   8           2HB      LYS   8  -8.405  -6.948   4.860
   61    HB3  LYS   8           3HB      LYS   8  -7.737  -8.594   4.968
   62    HG2  LYS   8           2HG      LYS   8  -7.000  -6.306   6.814
   63    HG3  LYS   8           3HG      LYS   8  -8.209  -7.560   7.180
   64    HD2  LYS   8           2HD      LYS   8  -6.478  -9.293   6.959
   65    HD3  LYS   8           3HD      LYS   8  -5.269  -8.038   6.596
   66    HE2  LYS   8           2HE      LYS   8  -6.889  -8.107   9.153
   67    HE3  LYS   8           3HE      LYS   8  -5.299  -8.882   8.981
   68    HZ1  LYS   8           3HZ      LYS   8  -5.855  -6.016   8.610
   69    HZ2  LYS   8           1HZ      LYS   8  -5.120  -6.689   9.922
   70    HZ3  LYS   8           2HZ      LYS   8  -4.381  -6.736   8.450
   71    H    CYS   9           HN       CYS   9  -6.458  -9.478   3.316
   72    HA   CYS   9           HA       CYS   9  -6.063  -8.848   0.560
   73    HB2  CYS   9           2HB      CYS   9  -6.871 -11.238   0.244
   74    HB3  CYS   9           3HB      CYS   9  -5.438 -10.997   1.274
   75    HG   CYS   9           HG       CYS   9  -6.878 -12.972   2.202
   76    H    GLY  10           HN       GLY  10  -7.423  -7.730  -0.654
   77    HA2  GLY  10           1HA      GLY  10  -9.532  -7.883  -1.899
   78    HA3  GLY  10           2HA      GLY  10 -10.327  -8.348  -0.379
   79    H    GLN  11           HN       GLN  11  -8.289  -6.198   0.772
   80    HA   GLN  11           HA       GLN  11 -10.310  -4.083   0.722
   81    HB2  GLN  11           2HB      GLN  11  -7.717  -4.470   2.232
   82    HB3  GLN  11           3HB      GLN  11  -8.677  -2.974   2.329
   83    HG2  GLN  11           2HG      GLN  11  -9.724  -5.725   3.029
   84    HG3  GLN  11           3HG      GLN  11  -9.042  -4.581   4.205
   85   HE21  GLN  11          1HE2      GLN  11 -10.940  -4.382   5.393
   86   HE22  GLN  11          2HE2      GLN  11 -12.342  -3.531   4.781
   87    H    THR  12           HN       THR  12 -10.068  -2.036  -0.017
   88    HA   THR  12           HA       THR  12  -7.691  -1.533  -1.736
   89    HB   THR  12           HB       THR  12 -10.352  -0.056  -1.772
   90    HG1  THR  12           1HG      THR  12 -10.799  -1.383  -3.613
   91   HG21  THR  12          3HG2      THR  12  -8.098  -0.270  -3.798
   92   HG22  THR  12          1HG2      THR  12  -9.603   0.652  -4.013
   93   HG23  THR  12          2HG2      THR  12  -8.438   1.135  -2.759
   94    H    VAL  13           HN       VAL  13  -6.352   0.142  -1.212
   95    HA   VAL  13           HA       VAL  13  -7.337   2.097   0.792
   96    HB   VAL  13           HB       VAL  13  -5.018   2.081   1.813
   97   HG11  VAL  13          1HG1      VAL  13  -5.448   0.119   3.235
   98   HG12  VAL  13          2HG1      VAL  13  -6.939   1.039   2.928
   99   HG13  VAL  13          3HG1      VAL  13  -6.632  -0.478   2.051
  100   HG21  VAL  13          3HG2      VAL  13  -3.858   0.932  -0.015
  101   HG22  VAL  13          1HG2      VAL  13  -3.654   0.056   1.520
  102   HG23  VAL  13          2HG2      VAL  13  -4.805  -0.541   0.303
  103    H    LYS  14           HN       LYS  14  -6.369   4.170   0.673
  104    HA   LYS  14           HA       LYS  14  -4.981   4.623  -1.925
  105    HB2  LYS  14           2HB      LYS  14  -7.223   5.601  -1.776
  106    HB3  LYS  14           3HB      LYS  14  -6.752   6.468  -0.294
  107    HG2  LYS  14           2HG      LYS  14  -5.204   7.835  -1.505
  108    HG3  LYS  14           3HG      LYS  14  -5.422   6.866  -2.982
  109    HD2  LYS  14           2HD      LYS  14  -6.683   8.971  -3.095
  110    HD3  LYS  14           3HD      LYS  14  -7.767   7.559  -3.107
  111    HE2  LYS  14           2HE      LYS  14  -8.090   7.879  -0.640
  112    HE3  LYS  14           3HE      LYS  14  -7.157   9.387  -0.765
  113    HZ1  LYS  14           3HZ      LYS  14  -9.665   8.800  -2.193
  114    HZ2  LYS  14           1HZ      LYS  14  -9.514   9.788  -0.882
  115    HZ3  LYS  14           2HZ      LYS  14  -8.799  10.198  -2.310
  116    H    VAL  15           HN       VAL  15  -2.962   5.347  -1.866
  117    HA   VAL  15           HA       VAL  15  -1.654   5.801   0.658
  118    HB   VAL  15           HB       VAL  15  -0.667   6.362  -2.166
  119   HG11  VAL  15          1HG1      VAL  15   1.585   6.249  -1.185
  120   HG12  VAL  15          2HG1      VAL  15   0.624   7.558  -0.461
  121   HG13  VAL  15          3HG1      VAL  15   0.871   6.036   0.429
  122   HG21  VAL  15          3HG2      VAL  15  -1.309   4.020  -1.851
  123   HG22  VAL  15          1HG2      VAL  15   0.457   4.183  -1.995
  124   HG23  VAL  15          2HG2      VAL  15  -0.284   3.928  -0.398
  125    H    VAL  16           HN       VAL  16  -1.325   7.631   1.761
  126    HA   VAL  16           HA       VAL  16  -1.965  10.163   0.347
  127    HB   VAL  16           HB       VAL  16  -2.446  11.053   2.718
  128   HG11  VAL  16          1HG1      VAL  16  -4.779  10.275   2.621
  129   HG12  VAL  16          2HG1      VAL  16  -4.165  10.695   1.005
  130   HG13  VAL  16          3HG1      VAL  16  -4.302   8.988   1.492
  131   HG21  VAL  16          3HG2      VAL  16  -1.513   9.164   3.975
  132   HG22  VAL  16          1HG2      VAL  16  -3.236   9.388   4.352
  133   HG23  VAL  16          2HG2      VAL  16  -2.730   8.079   3.259
  134    H    LYS  17           HN       LYS  17   0.082   8.699   2.914
  135    HA   LYS  17           HA       LYS  17   2.080  10.814   2.284
  136    HB2  LYS  17           2HB      LYS  17   1.049   9.938   4.970
  137    HB3  LYS  17           3HB      LYS  17   2.733  10.489   4.805
  138    HG2  LYS  17           2HG      LYS  17   1.431  12.345   5.535
  139    HG3  LYS  17           3HG      LYS  17   1.855  12.625   3.830
  140    HD2  LYS  17           2HD      LYS  17  -0.368  11.843   3.148
  141    HD3  LYS  17           3HD      LYS  17  -0.793  11.562   4.853
  142    HE2  LYS  17           2HE      LYS  17  -0.570  13.925   5.343
  143    HE3  LYS  17           3HE      LYS  17   0.004  14.248   3.693
  144    HZ1  LYS  17           3HZ      LYS  17  -2.664  13.233   4.411
  145    HZ2  LYS  17           1HZ      LYS  17  -2.316  14.775   3.945
  146    HZ3  LYS  17           2HZ      LYS  17  -2.131  13.533   2.879
  147    H    LEU  18           HN       LEU  18   4.288  10.222   2.736
  148    HA   LEU  18           HA       LEU  18   4.728   7.284   2.932
  149    HB2  LEU  18           2HB      LEU  18   6.028   9.231   1.002
  150    HB3  LEU  18           3HB      LEU  18   6.563   7.556   1.272
  151    HG   LEU  18           HG       LEU  18   3.846   8.364   0.197
  152   HD11  LEU  18          1HD1      LEU  18   4.697   7.548  -1.968
  153   HD12  LEU  18          2HD1      LEU  18   5.657   8.921  -1.370
  154   HD13  LEU  18          3HD1      LEU  18   6.292   7.264  -1.233
  155   HD21  LEU  18          3HD2      LEU  18   3.857   6.220   1.398
  156   HD22  LEU  18          1HD2      LEU  18   3.643   5.971  -0.350
  157   HD23  LEU  18          2HD2      LEU  18   5.226   5.665   0.404
  158    H    HIS  19           HN       HIS  19   5.940   6.887   4.674
  159    HA   HIS  19           HA       HIS  19   7.606   9.054   5.782
  160    HB2  HIS  19           2HB      HIS  19   7.052   6.249   6.817
  161    HB3  HIS  19           3HB      HIS  19   7.929   7.525   7.684
  162    HD1  HIS  19           1HD      HIS  19   6.559   8.687   9.362
  163    HD2  HIS  19           2HD      HIS  19   4.235   7.252   6.199
  164    HE1  HIS  19           1HE      HIS  19   4.156   9.231   9.943
  165    HE2  HIS  19           2HE      HIS  19   2.753   8.365   8.020
  166    H    GLY  20           HN       GLY  20   9.811   8.158   6.752
  167    HA2  GLY  20           1HA      GLY  20  11.485   6.368   6.320
  168    HA3  GLY  20           2HA      GLY  20  11.056   6.511   4.601
  169    H    THR  21           HN       THR  21  13.545   6.681   4.790
  170    HA   THR  21           HA       THR  21  14.585   9.248   5.605
  171    HB   THR  21           HB       THR  21  16.637   8.348   4.277
  172    HG1  THR  21           1HG      THR  21  16.508   6.058   3.974
  173   HG21  THR  21          3HG2      THR  21  15.539   6.792   6.642
  174   HG22  THR  21          1HG2      THR  21  17.240   6.833   6.126
  175   HG23  THR  21          2HG2      THR  21  16.460   8.313   6.729
  176    H    GLY  22           HN       GLY  22  14.984   7.766   2.343
  177    HA2  GLY  22           1HA      GLY  22  13.654   9.993   1.058
  178    HA3  GLY  22           2HA      GLY  22  15.425  10.117   0.973
  179    H    ALA  23           HN       ALA  23  16.404   7.751   0.435
  180    HA   ALA  23           HA       ALA  23  15.713   7.345  -2.295
  181    HB1  ALA  23           1HB      ALA  23  17.292   5.459  -2.200
  182    HB2  ALA  23           2HB      ALA  23  17.953   6.900  -1.394
  183    HB3  ALA  23           3HB      ALA  23  17.301   5.558  -0.424
  184    H    LEU  24           HN       LEU  24  14.780   5.703   0.696
  185    HA   LEU  24           HA       LEU  24  13.466   3.464  -0.416
  186    HB2  LEU  24           2HB      LEU  24  13.866   3.688   1.963
  187    HB3  LEU  24           3HB      LEU  24  12.806   5.117   2.039
  188    HG   LEU  24           HG       LEU  24  10.891   3.662   1.397
  189   HD11  LEU  24          1HD1      LEU  24  11.130   1.222   1.587
  190   HD12  LEU  24          2HD1      LEU  24  12.145   1.877   0.282
  191   HD13  LEU  24          3HD1      LEU  24  12.881   1.415   1.835
  192   HD21  LEU  24          3HD2      LEU  24  11.341   4.243   3.733
  193   HD22  LEU  24          1HD2      LEU  24  10.662   2.604   3.603
  194   HD23  LEU  24          2HD2      LEU  24  12.404   2.824   3.887
  195    H    LYS  25           HN       LYS  25  12.317   6.791   0.194
  196    HA   LYS  25           HA       LYS  25   9.629   6.366  -0.628
  197    HB2  LYS  25           2HB      LYS  25  11.357   8.860  -0.684
  198    HB3  LYS  25           3HB      LYS  25   9.596   8.838  -0.944
  199    HG2  LYS  25           2HG      LYS  25   9.269   7.944   1.314
  200    HG3  LYS  25           3HG      LYS  25  11.029   7.946   1.575
  201    HD2  LYS  25           2HD      LYS  25  11.085  10.376   1.317
  202    HD3  LYS  25           3HD      LYS  25   9.335  10.396   0.990
  203    HE2  LYS  25           2HE      LYS  25   8.922   9.455   3.238
  204    HE3  LYS  25           3HE      LYS  25  10.669   9.484   3.562
  205    HZ1  LYS  25           3HZ      LYS  25   8.990  11.838   3.008
  206    HZ2  LYS  25           1HZ      LYS  25   9.562  11.393   4.488
  207    HZ3  LYS  25           2HZ      LYS  25  10.612  11.864   3.308
  208    H    ARG  26           HN       ARG  26  12.539   7.435  -2.417
  209    HA   ARG  26           HA       ARG  26  11.345   7.790  -4.950
  210    HB2  ARG  26           2HB      ARG  26  13.558   8.535  -4.684
  211    HB3  ARG  26           3HB      ARG  26  14.102   6.972  -4.029
  212    HG2  ARG  26           2HG      ARG  26  14.990   7.284  -6.249
  213    HG3  ARG  26           3HG      ARG  26  13.800   5.961  -6.258
  214    HD2  ARG  26           2HD      ARG  26  12.097   7.583  -7.107
  215    HD3  ARG  26           3HD      ARG  26  13.382   8.804  -7.228
  216    HE   ARG  26           HE       ARG  26  14.430   6.756  -8.651
  217   HH11  ARG  26          2HH1      ARG  26  11.303   8.384  -8.764
  218   HH12  ARG  26          1HH1      ARG  26  11.044   8.031 -10.457
  219   HH21  ARG  26          2HH2      ARG  26  14.062   6.272 -10.838
  220   HH22  ARG  26          1HH2      ARG  26  12.608   6.836 -11.631
  221    H    ARG  27           HN       ARG  27  12.737   4.871  -3.442
  222    HA   ARG  27           HA       ARG  27  12.396   3.107  -5.625
  223    HB2  ARG  27           2HB      ARG  27  13.768   2.636  -3.650
  224    HB3  ARG  27           3HB      ARG  27  12.308   2.586  -2.634
  225    HG2  ARG  27           2HG      ARG  27  13.084   0.345  -3.079
  226    HG3  ARG  27           3HG      ARG  27  11.525   0.617  -3.892
  227    HD2  ARG  27           2HD      ARG  27  12.435   0.496  -5.981
  228    HD3  ARG  27           3HD      ARG  27  13.988   1.186  -5.465
  229    HE   ARG  27           HE       ARG  27  14.583  -0.991  -4.545
  230   HH11  ARG  27          2HH1      ARG  27  11.791  -0.932  -6.707
  231   HH12  ARG  27          1HH1      ARG  27  11.917  -2.630  -7.101
  232   HH21  ARG  27          2HH2      ARG  27  14.735  -3.175  -5.067
  233   HH22  ARG  27          1HH2      ARG  27  13.586  -3.901  -6.170
  234    H    ILE  28           HN       ILE  28  10.219   3.835  -2.866
  235    HA   ILE  28           HA       ILE  28   8.161   2.032  -3.650
  236    HB   ILE  28           HB       ILE  28   7.980   4.616  -2.046
  237   HG12  ILE  28          2HG1      ILE  28   8.225   1.725  -1.156
  238   HG13  ILE  28          3HG1      ILE  28   9.531   2.933  -1.124
  239   HG21  ILE  28          1HG2      ILE  28   5.884   3.690  -1.148
  240   HG22  ILE  28          2HG2      ILE  28   5.790   3.922  -2.909
  241   HG23  ILE  28          3HG2      ILE  28   6.036   2.293  -2.237
  242   HD11  ILE  28          3HD1      ILE  28   6.947   3.065   0.452
  243   HD12  ILE  28          1HD1      ILE  28   8.539   2.634   1.109
  244   HD13  ILE  28          2HD1      ILE  28   8.255   4.272   0.484
  245    H    MET  29           HN       MET  29   8.768   5.455  -4.388
  246    HA   MET  29           HA       MET  29   6.297   5.941  -5.723
  247    HB2  MET  29           2HB      MET  29   9.008   7.273  -5.863
  248    HB3  MET  29           3HB      MET  29   7.609   7.844  -6.804
  249    HG2  MET  29           2HG      MET  29   6.364   8.227  -4.737
  250    HG3  MET  29           3HG      MET  29   7.732   7.626  -3.787
  251    HE1  MET  29           3HE      MET  29   7.594   9.892  -2.364
  252    HE2  MET  29           1HE      MET  29   7.677  11.515  -3.085
  253    HE3  MET  29           2HE      MET  29   6.267  10.477  -3.398
  254    H    ASP  30           HN       ASP  30   9.551   5.102  -6.993
  255    HA   ASP  30           HA       ASP  30   8.773   5.207  -9.737
  256    HB2  ASP  30           2HB      ASP  30  11.131   5.267  -8.898
  257    HB3  ASP  30           3HB      ASP  30  10.991   3.541  -8.495
  258    HD2  ASP  30           2HD      ASP  30  11.140   4.534 -12.355
  259    H    MET  31           HN       MET  31   8.610   2.751  -7.256
  260    HA   MET  31           HA       MET  31   8.141   0.468  -8.888
  261    HB2  MET  31           2HB      MET  31   8.639   0.774  -6.338
  262    HB3  MET  31           3HB      MET  31   6.869   0.902  -6.195
  263    HG2  MET  31           2HG      MET  31   6.527  -1.301  -6.705
  264    HG3  MET  31           3HG      MET  31   8.004  -1.428  -7.675
  265    HE1  MET  31           3HE      MET  31   7.071  -0.383  -3.930
  266    HE2  MET  31           1HE      MET  31   8.618  -0.779  -3.149
  267    HE3  MET  31           2HE      MET  31   8.559   0.467  -4.416
  268    H    GLY  32           HN       GLY  32   6.119   3.168  -7.937
  269    HA2  GLY  32           1HA      GLY  32   4.221   3.420  -9.584
  270    HA3  GLY  32           2HA      GLY  32   3.787   1.754  -9.138
  271    H    ILE  33           HN       ILE  33   4.775   2.559  -6.304
  272    HA   ILE  33           HA       ILE  33   2.082   3.230  -5.422
  273    HB   ILE  33           HB       ILE  33   4.577   2.875  -3.719
  274   HG12  ILE  33          2HG1      ILE  33   3.367   0.574  -3.298
  275   HG13  ILE  33          3HG1      ILE  33   2.692   0.875  -4.918
  276   HG21  ILE  33          1HG2      ILE  33   2.967   2.384  -1.922
  277   HG22  ILE  33          2HG2      ILE  33   2.705   4.005  -2.605
  278   HG23  ILE  33          3HG2      ILE  33   1.623   2.665  -3.053
  279   HD11  ILE  33          3HD1      ILE  33   5.631   0.740  -4.213
  280   HD12  ILE  33          1HD1      ILE  33   4.704  -0.530  -5.038
  281   HD13  ILE  33          2HD1      ILE  33   4.956   1.037  -5.832
  282    H    THR  34           HN       THR  34   1.512   5.302  -5.689
  283    HA   THR  34           HA       THR  34   3.282   7.328  -4.449
  284    HB   THR  34           HB       THR  34   2.303   8.847  -6.407
  285    HG1  THR  34           1HG      THR  34   2.250   7.602  -8.352
  286   HG21  THR  34          3HG2      THR  34   4.638   6.938  -6.777
  287   HG22  THR  34          1HG2      THR  34   4.387   8.457  -7.667
  288   HG23  THR  34          2HG2      THR  34   4.688   8.494  -5.915
  289    H    ARG  35           HN       ARG  35   2.007   9.502  -4.300
  290    HA   ARG  35           HA       ARG  35  -0.207   8.854  -2.572
  291    HB2  ARG  35           2HB      ARG  35   0.780  11.548  -3.562
  292    HB3  ARG  35           3HB      ARG  35  -0.320  11.267  -2.191
  293    HG2  ARG  35           2HG      ARG  35   1.455  10.081  -0.998
  294    HG3  ARG  35           3HG      ARG  35   2.556  10.329  -2.373
  295    HD2  ARG  35           2HD      ARG  35   2.372  12.762  -2.084
  296    HD3  ARG  35           3HD      ARG  35   1.267  12.517  -0.715
  297    HE   ARG  35           HE       ARG  35   4.021  11.402  -0.633
  298   HH11  ARG  35          2HH1      ARG  35   1.549  13.580   0.613
  299   HH12  ARG  35          1HH1      ARG  35   2.438  13.958   2.071
  300   HH21  ARG  35          2HH2      ARG  35   5.174  11.905   1.270
  301   HH22  ARG  35          1HH2      ARG  35   4.492  13.011   2.443
  302    H    GLY  36           HN       GLY  36  -2.311   8.735  -3.016
  303    HA2  GLY  36           1HA      GLY  36  -4.288   9.631  -4.022
  304    HA3  GLY  36           2HA      GLY  36  -3.309  10.214  -5.387
  305    H    CYS  37           HN       CYS  37  -2.062   7.266  -4.915
  306    HA   CYS  37           HA       CYS  37  -3.720   6.141  -7.059
  307    HB2  CYS  37           2HB      CYS  37  -1.237   5.094  -5.671
  308    HB3  CYS  37           3HB      CYS  37  -2.028   4.347  -7.081
  309    HG   CYS  37           HG       CYS  37   0.204   5.485  -7.815
  310    H    GLU  38           HN       GLU  38  -4.920   4.285  -6.966
  311    HA   GLU  38           HA       GLU  38  -5.818   3.473  -4.295
  312    HB2  GLU  38           2HB      GLU  38  -6.661   2.508  -7.048
  313    HB3  GLU  38           3HB      GLU  38  -7.474   2.145  -5.508
  314    HG2  GLU  38           2HG      GLU  38  -8.056   4.485  -5.226
  315    HG3  GLU  38           3HG      GLU  38  -7.162   4.911  -6.700
  316    HE2  GLU  38           2HE      GLU  38 -10.685   4.521  -7.548
  317    H    ILE  39           HN       ILE  39  -4.944   1.857  -3.208
  318    HA   ILE  39           HA       ILE  39  -3.240  -0.072  -4.681
  319    HB   ILE  39           HB       ILE  39  -3.351   0.529  -1.695
  320   HG12  ILE  39          2HG1      ILE  39  -2.548   2.450  -3.048
  321   HG13  ILE  39          3HG1      ILE  39  -1.314   1.777  -1.957
  322   HG21  ILE  39          1HG2      ILE  39  -1.242  -0.735  -1.599
  323   HG22  ILE  39          2HG2      ILE  39  -2.570  -1.734  -2.233
  324   HG23  ILE  39          3HG2      ILE  39  -1.356  -1.056  -3.345
  325   HD11  ILE  39          3HD1      ILE  39  -1.520   1.275  -4.934
  326   HD12  ILE  39          1HD1      ILE  39  -0.350   2.353  -4.144
  327   HD13  ILE  39          2HD1      ILE  39  -0.284   0.604  -3.842
  328    H    TYR  40           HN       TYR  40  -4.223  -1.922  -5.149
  329    HA   TYR  40           HA       TYR  40  -6.360  -2.909  -3.366
  330    HB2  TYR  40           2HB      TYR  40  -6.587  -2.884  -5.887
  331    HB3  TYR  40           3HB      TYR  40  -5.326  -4.127  -5.943
  332    HD1  TYR  40           1HD      TYR  40  -8.783  -3.399  -4.826
  333    HD2  TYR  40           2HD      TYR  40  -5.837  -6.427  -5.390
  334    HE1  TYR  40           1HE      TYR  40 -10.501  -5.125  -4.525
  335    HE2  TYR  40           2HE      TYR  40  -7.557  -8.155  -5.081
  336    HH   TYR  40           HH       TYR  40  -9.753  -8.598  -4.684
  337    H    ILE  41           HN       ILE  41  -5.742  -4.049  -1.665
  338    HA   ILE  41           HA       ILE  41  -3.199  -5.503  -1.697
  339    HB   ILE  41           HB       ILE  41  -5.327  -5.491   0.474
  340   HG12  ILE  41          2HG1      ILE  41  -4.706  -3.177  -0.133
  341   HG13  ILE  41          3HG1      ILE  41  -4.191  -3.628   1.509
  342   HG21  ILE  41          1HG2      ILE  41  -3.422  -5.998   1.949
  343   HG22  ILE  41          2HG2      ILE  41  -3.589  -7.215   0.664
  344   HG23  ILE  41          3HG2      ILE  41  -2.328  -5.965   0.546
  345   HD11  ILE  41          3HD1      ILE  41  -2.422  -3.519  -0.943
  346   HD12  ILE  41          1HD1      ILE  41  -2.460  -2.314   0.361
  347   HD13  ILE  41          2HD1      ILE  41  -1.907  -3.968   0.701
  348    H    ARG  42           HN       ARG  42  -3.138  -7.477  -2.657
  349    HA   ARG  42           HA       ARG  42  -5.688  -8.989  -2.704
  350    HB2  ARG  42           2HB      ARG  42  -4.769 -10.206  -4.598
  351    HB3  ARG  42           3HB      ARG  42  -4.706  -8.450  -4.884
  352    HG2  ARG  42           2HG      ARG  42  -2.520  -8.538  -5.248
  353    HG3  ARG  42           3HG      ARG  42  -2.245  -9.339  -3.683
  354    HD2  ARG  42           2HD      ARG  42  -1.403 -10.732  -5.487
  355    HD3  ARG  42           3HD      ARG  42  -2.803 -11.513  -4.718
  356    HE   ARG  42           HE       ARG  42  -3.972 -10.209  -6.784
  357   HH11  ARG  42          2HH1      ARG  42  -1.131 -12.283  -6.592
  358   HH12  ARG  42          1HH1      ARG  42  -1.307 -12.895  -8.222
  359   HH21  ARG  42          2HH2      ARG  42  -4.193 -11.021  -8.919
  360   HH22  ARG  42          1HH2      ARG  42  -3.040 -12.181  -9.538
  361    H    LYS  43           HN       LYS  43  -2.473  -9.052  -1.382
  362    HA   LYS  43           HA       LYS  43  -3.078 -11.638  -0.125
  363    HB2  LYS  43           2HB      LYS  43  -2.016 -12.272  -2.249
  364    HB3  LYS  43           3HB      LYS  43  -0.623 -11.233  -1.862
  365    HG2  LYS  43           2HG      LYS  43  -0.101 -12.632   0.071
  366    HG3  LYS  43           3HG      LYS  43  -1.511 -13.660  -0.280
  367    HD2  LYS  43           2HD      LYS  43  -0.536 -14.239  -2.465
  368    HD3  LYS  43           3HD      LYS  43   0.879 -13.224  -2.098
  369    HE2  LYS  43           2HE      LYS  43  -0.019 -15.642  -0.503
  370    HE3  LYS  43           3HE      LYS  43   1.306 -15.621  -1.687
  371    HZ1  LYS  43           3HZ      LYS  43   1.195 -14.031   0.789
  372    HZ2  LYS  43           1HZ      LYS  43   2.113 -15.380   0.555
  373    HZ3  LYS  43           2HZ      LYS  43   2.425 -14.012  -0.310
  374    H    VAL  44           HN       VAL  44  -2.479 -11.580   1.922
  375    HA   VAL  44           HA       VAL  44  -0.170  -9.849   2.660
  376    HB   VAL  44           HB       VAL  44  -2.626 -10.396   4.372
  377   HG11  VAL  44          1HG1      VAL  44  -1.671  -8.705   5.884
  378   HG12  VAL  44          2HG1      VAL  44  -0.565 -10.079   5.662
  379   HG13  VAL  44          3HG1      VAL  44  -0.261  -8.545   4.811
  380   HG21  VAL  44          3HG2      VAL  44  -3.187  -8.920   2.502
  381   HG22  VAL  44          1HG2      VAL  44  -3.201  -8.030   4.041
  382   HG23  VAL  44          2HG2      VAL  44  -1.827  -7.854   2.927
  383    H    ALA  45           HN       ALA  45   1.467 -10.992   3.491
  384    HA   ALA  45           HA       ALA  45   1.172 -13.802   4.036
  385    HB1  ALA  45           1HB      ALA  45   3.543 -13.683   4.682
  386    HB2  ALA  45           2HB      ALA  45   3.246 -12.835   3.147
  387    HB3  ALA  45           3HB      ALA  45   3.463 -11.906   4.649
  388    HA   PRO  46           HA       PRO  46  -0.148 -13.849   8.215
  389    HB2  PRO  46           2HB      PRO  46   1.813 -16.092   8.648
  390    HB3  PRO  46           3HB      PRO  46   0.031 -16.045   8.846
  391    HG2  PRO  46           2HG      PRO  46   1.191 -17.302   6.806
  392    HG3  PRO  46           3HG      PRO  46  -0.402 -16.494   6.645
  393    HD2  PRO  46           2HD      PRO  46   2.332 -15.652   5.704
  394    HD3  PRO  46           3HD      PRO  46   0.729 -15.382   4.955
  395    H    LEU  47           HN       LEU  47   3.322 -13.831   7.501
  396    HA   LEU  47           HA       LEU  47   3.848 -12.796  10.231
  397    HB2  LEU  47           2HB      LEU  47   6.219 -13.138   9.689
  398    HB3  LEU  47           3HB      LEU  47   5.257 -14.628   9.561
  399    HG   LEU  47           HG       LEU  47   5.196 -13.857   6.994
  400   HD11  LEU  47          1HD1      LEU  47   7.404 -12.998   6.326
  401   HD12  LEU  47          2HD1      LEU  47   6.546 -11.845   7.373
  402   HD13  LEU  47          3HD1      LEU  47   7.861 -12.844   8.038
  403   HD21  LEU  47          3HD2      LEU  47   5.911 -16.036   7.862
  404   HD22  LEU  47          1HD2      LEU  47   7.033 -15.449   6.612
  405   HD23  LEU  47          2HD2      LEU  47   7.481 -15.341   8.329
  406    H    GLY  48           HN       GLY  48   2.811 -11.546   7.447
  407    HA2  GLY  48           1HA      GLY  48   2.560  -9.202   7.225
  408    HA3  GLY  48           2HA      GLY  48   4.083  -8.962   8.112
  409    H    ASP  49           HN       ASP  49   5.575 -10.934   6.493
  410    HA   ASP  49           HA       ASP  49   5.853  -9.179   4.092
  411    HB2  ASP  49           2HB      ASP  49   7.632  -8.943   5.870
  412    HB3  ASP  49           3HB      ASP  49   8.080 -10.633   5.554
  413    HD2  ASP  49           2HD      ASP  49   9.946  -9.700   2.833
  414    HA   PRO  50           HA       PRO  50   6.160  -8.983   2.455
  415    HB2  PRO  50           2HB      PRO  50   5.939  -9.282  -0.236
  416    HB3  PRO  50           3HB      PRO  50   7.454  -9.705   0.626
  417    HG2  PRO  50           2HG      PRO  50   5.356 -11.489  -0.459
  418    HG3  PRO  50           3HG      PRO  50   7.129 -11.745  -0.371
  419    HD2  PRO  50           2HD      PRO  50   5.102 -12.712   1.415
  420    HD3  PRO  50           3HD      PRO  50   6.875 -12.799   1.642
  421    H    ILE  51           HN       ILE  51   4.614  -7.590   1.202
  422    HA   ILE  51           HA       ILE  51   1.880  -8.759   1.257
  423    HB   ILE  51           HB       ILE  51   2.750  -5.844   1.393
  424   HG12  ILE  51          2HG1      ILE  51   1.485  -7.687   3.445
  425   HG13  ILE  51          3HG1      ILE  51   3.163  -7.092   3.455
  426   HG21  ILE  51          1HG2      ILE  51   0.361  -5.350   1.742
  427   HG22  ILE  51          2HG2      ILE  51   0.640  -6.112   0.158
  428   HG23  ILE  51          3HG2      ILE  51  -0.029  -7.069   1.502
  429   HD11  ILE  51          3HD1      ILE  51   0.671  -5.393   3.719
  430   HD12  ILE  51          1HD1      ILE  51   1.763  -5.842   5.044
  431   HD13  ILE  51          2HD1      ILE  51   2.349  -4.799   3.731
  432    H    GLN  52           HN       GLN  52   0.715  -8.877  -0.580
  433    HA   GLN  52           HA       GLN  52   2.125  -8.061  -3.060
  434    HB2  GLN  52           2HB      GLN  52   1.290 -10.459  -2.571
  435    HB3  GLN  52           3HB      GLN  52  -0.336  -9.801  -2.876
  436    HG2  GLN  52           2HG      GLN  52   0.375 -10.760  -4.909
  437    HG3  GLN  52           3HG      GLN  52   0.541  -9.003  -5.110
  438   HE21  GLN  52          1HE2      GLN  52   2.228 -12.060  -4.712
  439   HE22  GLN  52          2HE2      GLN  52   3.809 -11.479  -5.188
  440    H    ILE  53           HN       ILE  53   1.505  -6.207  -3.973
  441    HA   ILE  53           HA       ILE  53  -1.327  -5.375  -3.571
  442    HB   ILE  53           HB       ILE  53  -0.548  -3.025  -3.680
  443   HG12  ILE  53          2HG1      ILE  53   2.232  -4.243  -3.623
  444   HG13  ILE  53          3HG1      ILE  53   1.489  -3.400  -5.004
  445   HG21  ILE  53          1HG2      ILE  53   0.488  -2.944  -1.449
  446   HG22  ILE  53          2HG2      ILE  53  -0.840  -4.127  -1.505
  447   HG23  ILE  53          3HG2      ILE  53   0.851  -4.682  -1.555
  448   HD11  ILE  53          3HD1      ILE  53   2.133  -2.177  -2.309
  449   HD12  ILE  53          1HD1      ILE  53   3.060  -1.935  -3.805
  450   HD13  ILE  53          2HD1      ILE  53   1.392  -1.334  -3.691
  451    H    ASN  54           HN       ASN  54  -2.468  -4.668  -5.320
  452    HA   ASN  54           HA       ASN  54  -1.144  -5.076  -7.929
  453    HB2  ASN  54           2HB      ASN  54  -4.041  -4.868  -7.078
  454    HB3  ASN  54           3HB      ASN  54  -3.540  -4.837  -8.783
  455   HD21  ASN  54          1HD2      ASN  54  -1.321  -6.692  -8.456
  456   HD22  ASN  54          2HD2      ASN  54  -2.031  -8.278  -8.232
  457    H    VAL  55           HN       VAL  55  -0.190  -3.385  -8.773
  458    HA   VAL  55           HA       VAL  55  -1.665  -0.809  -8.795
  459    HB   VAL  55           HB       VAL  55   1.332  -1.058  -8.321
  460   HG11  VAL  55          1HG1      VAL  55   1.238   1.369  -7.939
  461   HG12  VAL  55          2HG1      VAL  55   0.674   0.943  -9.571
  462   HG13  VAL  55          3HG1      VAL  55  -0.504   1.357  -8.302
  463   HG21  VAL  55          3HG2      VAL  55   0.091  -1.776  -6.338
  464   HG22  VAL  55          1HG2      VAL  55   0.900  -0.218  -6.052
  465   HG23  VAL  55          2HG2      VAL  55  -0.850  -0.265  -6.372
  466    H    ARG  56           HN       ARG  56  -1.781   0.061 -10.783
  467    HA   ARG  56           HA       ARG  56  -1.447   0.412 -13.010
  468    HB2  ARG  56           2HB      ARG  56   1.387  -0.464 -12.372
  469    HB3  ARG  56           3HB      ARG  56   0.865   0.297 -13.894
  470    HG2  ARG  56           2HG      ARG  56   0.731   1.547 -11.135
  471    HG3  ARG  56           3HG      ARG  56   1.925   1.920 -12.402
  472    HD2  ARG  56           2HD      ARG  56   0.182   2.767 -13.858
  473    HD3  ARG  56           3HD      ARG  56  -1.075   2.271 -12.703
  474    HE   ARG  56           HE       ARG  56   0.908   4.119 -11.623
  475   HH11  ARG  56          2HH1      ARG  56  -2.165   3.778 -13.308
  476   HH12  ARG  56          1HH1      ARG  56  -2.747   5.357 -12.831
  477   HH21  ARG  56          2HH2      ARG  56   0.133   6.178 -11.000
  478   HH22  ARG  56          1HH2      ARG  56  -1.446   6.715 -11.525
  479    H    GLY  57           HN       GLY  57  -2.152  -2.313 -11.902
  480    HA2  GLY  57           1HA      GLY  57  -3.005  -4.096 -13.177
  481    HA3  GLY  57           2HA      GLY  57  -1.901  -3.671 -14.504
  482    H    TYR  58           HN       TYR  58   0.145  -3.507 -12.056
  483    HA   TYR  58           HA       TYR  58   0.967  -6.324 -12.462
  484    HB2  TYR  58           2HB      TYR  58   2.508  -3.909 -11.450
  485    HB3  TYR  58           3HB      TYR  58   3.176  -5.540 -11.635
  486    HD1  TYR  58           2HD      TYR  58   3.074  -6.569 -14.023
  487    HD2  TYR  58           1HD      TYR  58   2.615  -2.406 -13.240
  488    HE1  TYR  58           2HE      TYR  58   3.662  -6.068 -16.353
  489    HE2  TYR  58           1HE      TYR  58   3.206  -1.904 -15.570
  490    HH   TYR  58           HH       TYR  58   3.977  -4.462 -17.926
  491    H    GLU  59           HN       GLU  59   1.775  -7.582 -10.712
  492    HA   GLU  59           HA       GLU  59   0.686  -6.766  -8.081
  493    HB2  GLU  59           2HB      GLU  59   1.213  -9.116  -7.421
  494    HB3  GLU  59           3HB      GLU  59  -0.003  -8.956  -8.710
  495    HG2  GLU  59           2HG      GLU  59   1.690  -9.521 -10.382
  496    HG3  GLU  59           3HG      GLU  59   2.913  -9.668  -9.102
  497    HE2  GLU  59           2HE      GLU  59   0.526 -12.696  -9.790
  498    H    LEU  60           HN       LEU  60   1.989  -5.714  -6.792
  499    HA   LEU  60           HA       LEU  60   4.914  -5.985  -7.218
  500    HB2  LEU  60           2HB      LEU  60   3.339  -3.851  -5.744
  501    HB3  LEU  60           3HB      LEU  60   5.083  -3.832  -6.097
  502    HG   LEU  60           HG       LEU  60   2.879  -3.753  -8.174
  503   HD11  LEU  60          1HD1      LEU  60   3.512  -1.393  -8.464
  504   HD12  LEU  60          2HD1      LEU  60   2.925  -1.712  -6.815
  505   HD13  LEU  60          3HD1      LEU  60   4.670  -1.540  -7.122
  506   HD21  LEU  60          3HD2      LEU  60   4.961  -4.772  -8.977
  507   HD22  LEU  60          1HD2      LEU  60   4.699  -3.181  -9.729
  508   HD23  LEU  60          2HD2      LEU  60   5.879  -3.357  -8.410
  509    H    SER  61           HN       SER  61   6.149  -6.943  -5.746
  510    HA   SER  61           HA       SER  61   4.925  -7.738  -3.191
  511    HB2  SER  61           2HB      SER  61   7.187  -8.941  -2.954
  512    HB3  SER  61           3HB      SER  61   6.082  -9.515  -4.226
  513    HG   SER  61           HG       SER  61   8.242  -9.257  -4.974
  514    H    LEU  62           HN       LEU  62   4.976  -6.299  -1.598
  515    HA   LEU  62           HA       LEU  62   7.311  -4.460  -1.467
  516    HB2  LEU  62           2HB      LEU  62   5.049  -3.459  -1.736
  517    HB3  LEU  62           3HB      LEU  62   4.571  -4.205  -0.193
  518    HG   LEU  62           HG       LEU  62   6.343  -2.874   0.938
  519   HD11  LEU  62          1HD1      LEU  62   7.340  -0.967  -0.255
  520   HD12  LEU  62          2HD1      LEU  62   7.807  -2.515  -0.995
  521   HD13  LEU  62          3HD1      LEU  62   6.559  -1.503  -1.761
  522   HD21  LEU  62          3HD2      LEU  62   4.003  -2.134   0.902
  523   HD22  LEU  62          1HD2      LEU  62   5.112  -0.743   0.857
  524   HD23  LEU  62          2HD2      LEU  62   4.292  -1.275  -0.629
  525    H    ARG  63           HN       ARG  63   8.576  -4.351   0.319
  526    HA   ARG  63           HA       ARG  63   8.565  -6.464   2.231
  527    HB2  ARG  63           2HB      ARG  63  10.546  -5.077   1.618
  528    HB3  ARG  63           3HB      ARG  63   9.800  -3.694   2.453
  529    HG2  ARG  63           2HG      ARG  63  11.316  -4.531   4.011
  530    HG3  ARG  63           3HG      ARG  63   9.760  -5.228   4.524
  531    HD2  ARG  63           2HD      ARG  63  11.224  -7.042   4.637
  532    HD3  ARG  63           3HD      ARG  63  10.432  -7.253   3.060
  533    HE   ARG  63           HE       ARG  63  13.126  -6.006   3.361
  534   HH11  ARG  63          2HH1      ARG  63  10.878  -8.164   1.718
  535   HH12  ARG  63          1HH1      ARG  63  12.054  -8.695   0.539
  536   HH21  ARG  63          2HH2      ARG  63  14.662  -6.739   1.838
  537   HH22  ARG  63          1HH2      ARG  63  14.194  -7.890   0.607
  538    H    LYS  64           HN       LYS  64   7.656  -6.649   4.244
  539    HA   LYS  64           HA       LYS  64   5.358  -5.171   4.898
  540    HB2  LYS  64           2HB      LYS  64   5.459  -6.201   7.081
  541    HB3  LYS  64           3HB      LYS  64   5.924  -7.389   5.840
  542    HG2  LYS  64           2HG      LYS  64   8.263  -7.137   6.418
  543    HG3  LYS  64           3HG      LYS  64   7.871  -5.845   7.576
  544    HD2  LYS  64           2HD      LYS  64   6.982  -8.742   7.748
  545    HD3  LYS  64           3HD      LYS  64   8.246  -7.968   8.732
  546    HE2  LYS  64           2HE      LYS  64   6.542  -6.403   9.633
  547    HE3  LYS  64           3HE      LYS  64   5.294  -7.257   8.700
  548    HZ1  LYS  64           3HZ      LYS  64   6.971  -8.448  10.807
  549    HZ2  LYS  64           1HZ      LYS  64   5.387  -8.021  10.966
  550    HZ3  LYS  64           2HZ      LYS  64   5.812  -9.239   9.941
  551    H    SER  65           HN       SER  65   8.752  -4.644   5.747
  552    HA   SER  65           HA       SER  65   8.381  -2.691   7.766
  553    HB2  SER  65           2HB      SER  65  10.521  -3.835   7.327
  554    HB3  SER  65           3HB      SER  65  10.648  -3.000   5.760
  555    HG   SER  65           HG       SER  65  11.851  -1.961   7.421
  556    H    ALA  66           HN       ALA  66   8.385  -2.483   4.227
  557    HA   ALA  66           HA       ALA  66   8.380   0.412   4.201
  558    HB1  ALA  66           1HB      ALA  66   7.858   0.152   1.811
  559    HB2  ALA  66           2HB      ALA  66   9.212  -0.893   2.296
  560    HB3  ALA  66           3HB      ALA  66   7.591  -1.588   2.059
  561    H    ALA  67           HN       ALA  67   5.946  -2.180   4.043
  562    HA   ALA  67           HA       ALA  67   3.690  -0.589   3.479
  563    HB1  ALA  67           1HB      ALA  67   2.380  -2.415   4.484
  564    HB2  ALA  67           2HB      ALA  67   3.674  -3.044   3.437
  565    HB3  ALA  67           3HB      ALA  67   3.863  -3.079   5.207
  566    H    GLU  68           HN       GLU  68   5.182  -1.442   6.619
  567    HA   GLU  68           HA       GLU  68   3.211   0.077   8.111
  568    HB2  GLU  68           2HB      GLU  68   4.908  -0.296  10.003
  569    HB3  GLU  68           3HB      GLU  68   4.095  -1.716   9.302
  570    HG2  GLU  68           2HG      GLU  68   6.067  -2.199   7.958
  571    HG3  GLU  68           3HG      GLU  68   6.879  -0.759   8.607
  572    HE2  GLU  68           2HE      GLU  68   6.533  -3.926  10.987
  573    H    MET  69           HN       MET  69   5.602   1.079   6.099
  574    HA   MET  69           HA       MET  69   6.110   3.525   7.727
  575    HB2  MET  69           2HB      MET  69   8.081   2.109   6.948
  576    HB3  MET  69           3HB      MET  69   7.655   2.597   5.290
  577    HG2  MET  69           2HG      MET  69   8.130   4.875   5.739
  578    HG3  MET  69           3HG      MET  69   8.222   4.590   7.486
  579    HE1  MET  69           3HE      MET  69   9.912   1.945   7.726
  580    HE2  MET  69           1HE      MET  69  11.561   2.594   7.864
  581    HE3  MET  69           2HE      MET  69  10.218   3.401   8.704
  582    H    ILE  70           HN       ILE  70   4.120   2.293   5.405
  583    HA   ILE  70           HA       ILE  70   3.998   4.843   3.891
  584    HB   ILE  70           HB       ILE  70   2.826   2.100   3.290
  585   HG12  ILE  70          2HG1      ILE  70   4.908   3.802   1.882
  586   HG13  ILE  70          3HG1      ILE  70   5.225   2.347   2.856
  587   HG21  ILE  70          1HG2      ILE  70   1.977   3.081   1.193
  588   HG22  ILE  70          2HG2      ILE  70   1.241   3.855   2.616
  589   HG23  ILE  70          3HG2      ILE  70   2.535   4.686   1.720
  590   HD11  ILE  70          3HD1      ILE  70   3.646   2.449   0.275
  591   HD12  ILE  70          1HD1      ILE  70   5.307   1.843   0.451
  592   HD13  ILE  70          2HD1      ILE  70   3.966   0.995   1.250
  593    H    GLU  71           HN       GLU  71   2.354   6.203   4.120
  594    HA   GLU  71           HA       GLU  71   0.302   5.521   6.148
  595    HB2  GLU  71           2HB      GLU  71   1.719   7.531   6.437
  596    HB3  GLU  71           3HB      GLU  71   1.101   8.167   4.894
  597    HG2  GLU  71           2HG      GLU  71  -0.786   8.916   5.824
  598    HG3  GLU  71           3HG      GLU  71  -1.001   7.449   6.805
  599    HE2  GLU  71           2HE      GLU  71  -0.085  10.425   8.857
  600    H    VAL  72           HN       VAL  72  -1.620   4.864   5.449
  601    HA   VAL  72           HA       VAL  72  -2.617   5.991   2.888
  602    HB   VAL  72           HB       VAL  72  -3.607   3.802   2.318
  603   HG11  VAL  72          1HG1      VAL  72  -1.541   2.640   1.668
  604   HG12  VAL  72          2HG1      VAL  72  -1.416   4.393   1.397
  605   HG13  VAL  72          3HG1      VAL  72  -0.618   3.650   2.804
  606   HG21  VAL  72          3HG2      VAL  72  -3.820   2.893   4.583
  607   HG22  VAL  72          1HG2      VAL  72  -2.941   1.766   3.524
  608   HG23  VAL  72          2HG2      VAL  72  -2.050   2.756   4.702
  609    H    GLU  73           HN       GLU  73  -5.038   5.174   2.651
  610    HA   GLU  73           HA       GLU  73  -6.390   5.180   5.289
  611    HB2  GLU  73           2HB      GLU  73  -6.405   7.503   4.409
  612    HB3  GLU  73           3HB      GLU  73  -7.205   6.913   2.932
  613    HG2  GLU  73           2HG      GLU  73  -8.767   7.960   4.541
  614    HG3  GLU  73           3HG      GLU  73  -9.158   6.262   4.187
  615    HE2  GLU  73           2HE      GLU  73  -8.064   7.235   7.871
  616    H    LEU  74           HN       LEU  74  -8.307   3.991   5.321
  617    HA   LEU  74           HA       LEU  74  -8.452   1.885   3.366
  618    HB2  LEU  74           2HB      LEU  74  -9.145   2.011   5.917
  619    HB3  LEU  74           3HB      LEU  74 -10.709   2.522   5.238
  620    HG   LEU  74           HG       LEU  74 -10.679   0.137   5.766
  621   HD11  LEU  74          1HD1      LEU  74 -11.464  -0.743   3.610
  622   HD12  LEU  74          2HD1      LEU  74 -12.075   0.899   3.909
  623   HD13  LEU  74          3HD1      LEU  74 -10.723   0.643   2.779
  624   HD21  LEU  74          3HD2      LEU  74  -8.285  -0.277   5.465
  625   HD22  LEU  74          1HD2      LEU  74  -9.253  -1.426   4.514
  626   HD23  LEU  74          2HD2      LEU  74  -8.460  -0.053   3.708
  627    H    GLU  75           HN       GLU  75  -9.195   2.153   1.374
  628    HA   GLU  75           HA       GLU  75 -10.836   4.338   0.576
  629    HB2  GLU  75           2HB      GLU  75  -9.822   1.836  -0.685
  630    HB3  GLU  75           3HB      GLU  75 -11.224   2.627  -1.443
  631    HG2  GLU  75           2HG      GLU  75  -8.583   3.979  -0.833
  632    HG3  GLU  75           3HG      GLU  75  -9.051   3.317  -2.416
  633    HE2  GLU  75           2HE      GLU  75 -10.395   6.852  -1.389
  634    H    HIS  76           HN       HIS  76 -12.705   4.568   1.600
  635    HA   HIS  76           HA       HIS  76 -14.549   2.497   2.228
  636    HB2  HIS  76           2HB      HIS  76 -15.233   5.379   1.571
  637    HB3  HIS  76           3HB      HIS  76 -16.116   4.264   2.631
  638    HD1  HIS  76           1HD      HIS  76 -13.907   7.051   2.818
  639    HD2  HIS  76           2HD      HIS  76 -14.243   3.453   4.920
  640    HE1  HIS  76           1HE      HIS  76 -12.643   7.379   4.990
  641    HE2  HIS  76           2HE      HIS  76 -12.844   5.190   6.262
  642    H    HIS  77           HN       HIS  77 -15.523   1.195   0.812
  643    HA   HIS  77           HA       HIS  77 -15.906   2.261  -1.931
  644    HB2  HIS  77           2HB      HIS  77 -15.873  -0.223  -2.577
  645    HB3  HIS  77           3HB      HIS  77 -14.340   0.559  -2.152
  646    HD1  HIS  77           1HD      HIS  77 -13.245  -0.105   0.134
  647    HD2  HIS  77           2HD      HIS  77 -16.620  -2.336  -0.913
  648    HE1  HIS  77           1HE      HIS  77 -13.239  -2.146   1.637
  649    HE2  HIS  77           2HE      HIS  77 -15.295  -3.494   1.005
  650    H    HIS  78           HN       HIS  78 -17.910   3.146  -1.458
  651    HA   HIS  78           HA       HIS  78 -20.058   1.077  -1.481
  652    HB2  HIS  78           2HB      HIS  78 -20.069   2.513   0.576
  653    HB3  HIS  78           3HB      HIS  78 -20.282   3.931  -0.467
  654    HD1  HIS  78           1HD      HIS  78 -22.638   4.581  -0.955
  655    HD2  HIS  78           2HD      HIS  78 -22.319   0.594   0.255
  656    HE1  HIS  78           1HE      HIS  78 -25.009   3.704  -0.773
  657    HE2  HIS  78           2HE      HIS  78 -24.808   1.287  -0.033
  658    H    HIS  79           HN       HIS  79 -18.865   4.219  -2.569
  659    HA   HIS  79           HA       HIS  79 -18.970   5.290  -4.562
  660    HB2  HIS  79           2HB      HIS  79 -18.372   2.712  -5.120
  661    HB3  HIS  79           3HB      HIS  79 -19.862   2.889  -6.067
  662    HD1  HIS  79           1HD      HIS  79 -19.826   4.575  -8.060
  663    HD2  HIS  79           2HD      HIS  79 -16.181   4.148  -6.065
  664    HE1  HIS  79           1HE      HIS  79 -18.078   5.661  -9.539
  665    HE2  HIS  79           2HE      HIS  79 -15.868   5.397  -8.321
  666    H    HIS  80           HN       HIS  80 -21.367   5.370  -3.010
  667    HA   HIS  80           HA       HIS  80 -23.110   6.398  -5.050
  668    HB2  HIS  80           2HB      HIS  80 -23.489   3.826  -5.059
  669    HB3  HIS  80           3HB      HIS  80 -24.303   4.093  -3.506
  670    HD1  HIS  80           1HD      HIS  80 -24.806   4.248  -7.138
  671    HD2  HIS  80           2HD      HIS  80 -26.629   5.859  -3.739
  672    HE1  HIS  80           1HE      HIS  80 -27.080   5.083  -7.883
  673    HE2  HIS  80           2HE      HIS  80 -28.179   6.058  -5.816
  674    H    HIS  81           HN       HIS  81 -24.050   8.113  -4.163
  675    HA   HIS  81           HA       HIS  81 -24.184   8.297  -1.227
  676    HB2  HIS  81           2HB      HIS  81 -23.354  10.172  -2.715
  677    HB3  HIS  81           3HB      HIS  81 -25.016  10.340  -3.311
  678    HD1  HIS  81           1HD      HIS  81 -22.765  11.383  -0.609
  679    HD2  HIS  81           2HD      HIS  81 -26.893  11.150  -1.209
  680    HE1  HIS  81           1HE      HIS  81 -23.820  12.836   1.178
  681    HE2  HIS  81           2HE      HIS  81 -26.326  12.690   0.808
  Start of MODEL   10
    1    H1   MET   1           HN       MET   1  -2.480   4.860  13.970
    2    HA   MET   1           HA       MET   1  -1.153   6.179  11.829
    3    HB2  MET   1           2HB      MET   1   0.835   5.940  13.301
    4    HB3  MET   1           3HB      MET   1   0.600   4.176  13.288
    5    HG2  MET   1           2HG      MET   1   0.979   4.127  10.877
    6    HG3  MET   1           3HG      MET   1   1.161   5.890  10.854
    7    HE1  MET   1           3HE      MET   1   3.498   5.724   9.645
    8    HE2  MET   1           1HE      MET   1   4.834   4.688  10.193
    9    HE3  MET   1           2HE      MET   1   3.328   3.953   9.597
   10    H    PHE   2           HN       PHE   2  -1.778   5.153  10.011
   11    HA   PHE   2           HA       PHE   2  -2.471   2.274  10.313
   12    HB2  PHE   2           2HB      PHE   2  -4.436   3.846  10.036
   13    HB3  PHE   2           3HB      PHE   2  -3.815   4.217   8.419
   14    HD1  PHE   2           2HD      PHE   2  -5.101   1.483  10.574
   15    HD2  PHE   2           1HD      PHE   2  -4.195   2.734   6.605
   16    HE1  PHE   2           2HE      PHE   2  -6.243  -0.503   9.690
   17    HE2  PHE   2           1HE      PHE   2  -5.335   0.748   5.718
   18    HZ   PHE   2           HZ       PHE   2  -6.374  -0.870   7.258
   19    H    SER   3           HN       SER   3  -0.670   1.366   9.540
   20    HA   SER   3           HA       SER   3   0.562   2.386   7.085
   21    HB2  SER   3           2HB      SER   3   1.245  -0.088   8.715
   22    HB3  SER   3           3HB      SER   3   2.278   0.747   7.529
   23    HG   SER   3           HG       SER   3   2.792   1.301   9.705
   24    H    LEU   4           HN       LEU   4   0.957   0.991   5.236
   25    HA   LEU   4           HA       LEU   4  -1.355  -0.319   4.262
   26    HB2  LEU   4           2HB      LEU   4   0.489   0.633   2.892
   27    HB3  LEU   4           3HB      LEU   4   1.525  -0.721   3.403
   28    HG   LEU   4           HG       LEU   4   0.019  -2.298   2.289
   29   HD11  LEU   4          1HD1      LEU   4  -1.785  -1.483   0.825
   30   HD12  LEU   4          2HD1      LEU   4  -2.075  -1.039   2.522
   31   HD13  LEU   4          3HD1      LEU   4  -1.476   0.181   1.373
   32   HD21  LEU   4          3HD2      LEU   4   1.923  -1.349   1.066
   33   HD22  LEU   4          1HD2      LEU   4   0.554  -1.664  -0.027
   34   HD23  LEU   4          2HD2      LEU   4   0.900  -0.002   0.509
   35    H    ARG   5           HN       ARG   5   1.315  -1.424   6.204
   36    HA   ARG   5           HA       ARG   5   1.178  -4.202   5.984
   37    HB2  ARG   5           2HB      ARG   5   2.812  -2.945   7.326
   38    HB3  ARG   5           3HB      ARG   5   1.524  -2.466   8.456
   39    HG2  ARG   5           2HG      ARG   5   1.190  -5.028   8.754
   40    HG3  ARG   5           3HG      ARG   5   2.832  -5.138   8.074
   41    HD2  ARG   5           2HD      ARG   5   2.940  -5.067  10.505
   42    HD3  ARG   5           3HD      ARG   5   3.638  -3.583   9.822
   43    HE   ARG   5           HE       ARG   5   0.822  -3.319  10.452
   44   HH11  ARG   5          2HH1      ARG   5   4.090  -3.120  11.759
   45   HH12  ARG   5          1HH1      ARG   5   3.623  -2.082  13.087
   46   HH21  ARG   5          2HH2      ARG   5   0.233  -1.989  12.185
   47   HH22  ARG   5          1HH2      ARG   5   1.441  -1.444  13.327
   48    H    ASP   6           HN       ASP   6  -1.055  -1.964   7.579
   49    HA   ASP   6           HA       ASP   6  -2.345  -4.142   9.058
   50    HB2  ASP   6           2HB      ASP   6  -2.406  -1.171   9.090
   51    HB3  ASP   6           3HB      ASP   6  -3.919  -1.991   9.534
   52    HD2  ASP   6           2HD      ASP   6  -2.639  -3.003  12.566
   53    H    ALA   7           HN       ALA   7  -2.597  -2.872   5.958
   54    HA   ALA   7           HA       ALA   7  -5.488  -3.125   5.720
   55    HB1  ALA   7           1HB      ALA   7  -5.086  -2.773   3.320
   56    HB2  ALA   7           2HB      ALA   7  -4.238  -1.559   4.306
   57    HB3  ALA   7           3HB      ALA   7  -3.334  -2.916   3.593
   58    H    LYS   8           HN       LYS   8  -6.648  -4.797   4.785
   59    HA   LYS   8           HA       LYS   8  -5.187  -7.375   4.835
   60    HB2  LYS   8           2HB      LYS   8  -8.183  -6.909   4.764
   61    HB3  LYS   8           3HB      LYS   8  -7.325  -8.418   5.160
   62    HG2  LYS   8           2HG      LYS   8  -7.336  -5.869   6.800
   63    HG3  LYS   8           3HG      LYS   8  -8.212  -7.373   7.171
   64    HD2  LYS   8           2HD      LYS   8  -6.110  -8.574   7.423
   65    HD3  LYS   8           3HD      LYS   8  -5.195  -7.121   6.949
   66    HE2  LYS   8           2HE      LYS   8  -6.070  -5.932   8.919
   67    HE3  LYS   8           3HE      LYS   8  -6.975  -7.387   9.395
   68    HZ1  LYS   8           3HZ      LYS   8  -4.044  -7.187   9.174
   69    HZ2  LYS   8           1HZ      LYS   8  -4.903  -7.201  10.581
   70    HZ3  LYS   8           2HZ      LYS   8  -4.884  -8.536   9.615
   71    H    CYS   9           HN       CYS   9  -5.544  -8.962   3.205
   72    HA   CYS   9           HA       CYS   9  -5.561  -7.908   0.550
   73    HB2  CYS   9           2HB      CYS   9  -5.825 -10.413  -0.016
   74    HB3  CYS   9           3HB      CYS   9  -4.348  -9.869   0.819
   75    HG   CYS   9           HG       CYS   9  -5.042 -12.234   1.688
   76    H    GLY  10           HN       GLY  10  -7.183  -7.432  -0.785
   77    HA2  GLY  10           1HA      GLY  10  -9.338  -8.009  -1.735
   78    HA3  GLY  10           2HA      GLY  10  -9.852  -8.575  -0.130
   79    H    GLN  11           HN       GLN  11  -8.030  -5.752   0.172
   80    HA   GLN  11           HA       GLN  11 -10.517  -4.104   0.159
   81    HB2  GLN  11           2HB      GLN  11  -7.994  -3.732   1.807
   82    HB3  GLN  11           3HB      GLN  11  -9.437  -2.692   1.847
   83    HG2  GLN  11           2HG      GLN  11 -10.754  -4.661   2.627
   84    HG3  GLN  11           3HG      GLN  11  -9.235  -5.578   2.727
   85   HE21  GLN  11          1HE2      GLN  11 -11.188  -3.020   4.117
   86   HE22  GLN  11          2HE2      GLN  11 -10.257  -2.831   5.589
   87    H    THR  12           HN       THR  12 -10.173  -1.787  -0.299
   88    HA   THR  12           HA       THR  12  -7.829  -1.344  -2.081
   89    HB   THR  12           HB       THR  12 -10.593  -0.106  -2.385
   90    HG1  THR  12           1HG      THR  12 -10.722  -1.526  -4.206
   91   HG21  THR  12          3HG2      THR  12  -8.160  -0.104  -4.207
   92   HG22  THR  12          1HG2      THR  12  -9.737   0.629  -4.580
   93   HG23  THR  12          2HG2      THR  12  -8.749   1.277  -3.250
   94    H    VAL  13           HN       VAL  13  -6.471   0.054  -1.171
   95    HA   VAL  13           HA       VAL  13  -7.651   2.220   0.497
   96    HB   VAL  13           HB       VAL  13  -5.562   2.254   1.795
   97   HG11  VAL  13          1HG1      VAL  13  -5.856   0.148   3.026
   98   HG12  VAL  13          2HG1      VAL  13  -7.420   0.877   2.594
   99   HG13  VAL  13          3HG1      VAL  13  -6.799  -0.511   1.669
  100   HG21  VAL  13          3HG2      VAL  13  -4.035   1.445   0.059
  101   HG22  VAL  13          1HG2      VAL  13  -3.879   0.478   1.545
  102   HG23  VAL  13          2HG2      VAL  13  -4.775  -0.172   0.153
  103    H    LYS  14           HN       LYS  14  -6.374   4.228   0.554
  104    HA   LYS  14           HA       LYS  14  -4.804   4.594  -1.949
  105    HB2  LYS  14           2HB      LYS  14  -6.703   6.483  -0.542
  106    HB3  LYS  14           3HB      LYS  14  -5.542   7.006  -1.786
  107    HG2  LYS  14           2HG      LYS  14  -6.588   5.489  -3.401
  108    HG3  LYS  14           3HG      LYS  14  -7.748   4.964  -2.158
  109    HD2  LYS  14           2HD      LYS  14  -8.741   6.633  -3.645
  110    HD3  LYS  14           3HD      LYS  14  -8.605   7.252  -1.982
  111    HE2  LYS  14           2HE      LYS  14  -6.549   8.457  -2.609
  112    HE3  LYS  14           3HE      LYS  14  -6.710   7.852  -4.273
  113    HZ1  LYS  14           3HZ      LYS  14  -8.647   9.579  -2.884
  114    HZ2  LYS  14           1HZ      LYS  14  -7.584  10.068  -4.045
  115    HZ3  LYS  14           2HZ      LYS  14  -8.795   9.019  -4.428
  116    H    VAL  15           HN       VAL  15  -2.940   5.757  -1.846
  117    HA   VAL  15           HA       VAL  15  -1.672   5.758   0.772
  118    HB   VAL  15           HB       VAL  15  -0.621   6.733  -1.910
  119   HG11  VAL  15          1HG1      VAL  15   1.600   6.453  -0.892
  120   HG12  VAL  15          2HG1      VAL  15   0.618   7.638   0.000
  121   HG13  VAL  15          3HG1      VAL  15   0.835   5.994   0.647
  122   HG21  VAL  15          3HG2      VAL  15  -1.287   4.379  -1.983
  123   HG22  VAL  15          1HG2      VAL  15   0.484   4.543  -2.051
  124   HG23  VAL  15          2HG2      VAL  15  -0.305   4.049  -0.535
  125    H    VAL  16           HN       VAL  16  -1.399   7.450   2.128
  126    HA   VAL  16           HA       VAL  16  -2.159  10.102   1.025
  127    HB   VAL  16           HB       VAL  16  -2.717  10.707   3.430
  128   HG11  VAL  16          1HG1      VAL  16  -4.953   9.679   3.316
  129   HG12  VAL  16          2HG1      VAL  16  -4.427  10.271   1.723
  130   HG13  VAL  16          3HG1      VAL  16  -4.361   8.531   2.093
  131   HG21  VAL  16          3HG2      VAL  16  -1.553   8.856   4.541
  132   HG22  VAL  16          1HG2      VAL  16  -3.282   8.860   4.957
  133   HG23  VAL  16          2HG2      VAL  16  -2.658   7.692   3.770
  134    H    LYS  17           HN       LYS  17   0.101   8.397   3.210
  135    HA   LYS  17           HA       LYS  17   1.893  10.743   2.922
  136    HB2  LYS  17           2HB      LYS  17   0.534  10.853   5.066
  137    HB3  LYS  17           3HB      LYS  17   1.403   9.388   5.584
  138    HG2  LYS  17           2HG      LYS  17   3.505  10.544   5.549
  139    HG3  LYS  17           3HG      LYS  17   2.759  11.981   4.809
  140    HD2  LYS  17           2HD      LYS  17   1.336  12.231   6.836
  141    HD3  LYS  17           3HD      LYS  17   2.202  10.863   7.576
  142    HE2  LYS  17           2HE      LYS  17   4.303  12.098   7.460
  143    HE3  LYS  17           3HE      LYS  17   3.486  13.450   6.644
  144    HZ1  LYS  17           3HZ      LYS  17   2.912  12.494   9.370
  145    HZ2  LYS  17           1HZ      LYS  17   3.755  13.858   8.988
  146    HZ3  LYS  17           2HZ      LYS  17   2.154  13.749   8.613
  147    H    LEU  18           HN       LEU  18   3.848  10.144   2.318
  148    HA   LEU  18           HA       LEU  18   4.615   7.304   2.690
  149    HB2  LEU  18           2HB      LEU  18   5.728   9.497   0.916
  150    HB3  LEU  18           3HB      LEU  18   6.394   7.851   1.032
  151    HG   LEU  18           HG       LEU  18   3.604   8.560   0.078
  152   HD11  LEU  18          1HD1      LEU  18   4.435   7.907  -2.146
  153   HD12  LEU  18          2HD1      LEU  18   5.343   9.291  -1.494
  154   HD13  LEU  18          3HD1      LEU  18   6.060   7.663  -1.466
  155   HD21  LEU  18          3HD2      LEU  18   3.745   6.360   1.163
  156   HD22  LEU  18          1HD2      LEU  18   3.501   6.192  -0.591
  157   HD23  LEU  18          2HD2      LEU  18   5.113   5.923   0.111
  158    H    HIS  19           HN       HIS  19   5.838   6.835   4.385
  159    HA   HIS  19           HA       HIS  19   7.367   9.007   5.675
  160    HB2  HIS  19           2HB      HIS  19   6.839   6.142   6.547
  161    HB3  HIS  19           3HB      HIS  19   7.670   7.379   7.509
  162    HD1  HIS  19           1HD      HIS  19   6.239   9.130   8.708
  163    HD2  HIS  19           2HD      HIS  19   4.026   6.450   6.392
  164    HE1  HIS  19           1HE      HIS  19   3.817   9.451   9.376
  165    HE2  HIS  19           2HE      HIS  19   2.472   7.815   7.974
  166    H    GLY  20           HN       GLY  20   9.612   8.798   6.192
  167    HA2  GLY  20           1HA      GLY  20  11.527   7.230   6.226
  168    HA3  GLY  20           2HA      GLY  20  10.982   6.656   4.633
  169    H    THR  21           HN       THR  21  13.297   7.122   4.175
  170    HA   THR  21           HA       THR  21  13.977   9.958   3.893
  171    HB   THR  21           HB       THR  21  16.097   8.964   2.868
  172    HG1  THR  21           1HG      THR  21  16.346   6.698   3.261
  173   HG21  THR  21          3HG2      THR  21  15.328   8.045   5.661
  174   HG22  THR  21          1HG2      THR  21  16.987   8.193   5.036
  175   HG23  THR  21          2HG2      THR  21  15.979   9.644   5.230
  176    H    GLY  22           HN       GLY  22  15.112  10.520   1.699
  177    HA2  GLY  22           1HA      GLY  22  13.106  10.543  -0.295
  178    HA3  GLY  22           2HA      GLY  22  14.817  10.972  -0.529
  179    H    ALA  23           HN       ALA  23  16.003   8.493   0.097
  180    HA   ALA  23           HA       ALA  23  15.839   7.164  -2.392
  181    HB1  ALA  23           1HB      ALA  23  17.209   5.416  -1.326
  182    HB2  ALA  23           2HB      ALA  23  17.794   7.043  -0.910
  183    HB3  ALA  23           3HB      ALA  23  16.846   6.107   0.272
  184    H    LEU  24           HN       LEU  24  14.284   6.462   0.744
  185    HA   LEU  24           HA       LEU  24  13.114   3.990  -0.159
  186    HB2  LEU  24           2HB      LEU  24  12.839   5.762   2.224
  187    HB3  LEU  24           3HB      LEU  24  11.524   4.611   1.883
  188    HG   LEU  24           HG       LEU  24  13.098   3.693   3.495
  189   HD11  LEU  24          1HD1      LEU  24  13.586   1.564   2.360
  190   HD12  LEU  24          2HD1      LEU  24  11.967   2.169   1.942
  191   HD13  LEU  24          3HD1      LEU  24  13.308   2.343   0.785
  192   HD21  LEU  24          3HD2      LEU  24  15.108   4.916   2.812
  193   HD22  LEU  24          1HD2      LEU  24  15.417   3.165   2.872
  194   HD23  LEU  24          2HD2      LEU  24  15.177   3.971   1.305
  195    H    LYS  25           HN       LYS  25  11.907   7.353   0.146
  196    HA   LYS  25           HA       LYS  25   9.265   6.825  -0.743
  197    HB2  LYS  25           2HB      LYS  25  10.990   9.301  -1.057
  198    HB3  LYS  25           3HB      LYS  25   9.246   9.231  -1.407
  199    HG2  LYS  25           2HG      LYS  25   8.771   8.702   0.920
  200    HG3  LYS  25           3HG      LYS  25  10.512   8.677   1.290
  201    HD2  LYS  25           2HD      LYS  25  10.670  11.056   0.652
  202    HD3  LYS  25           3HD      LYS  25   8.922  11.074   0.321
  203    HE2  LYS  25           2HE      LYS  25   8.444  10.544   2.648
  204    HE3  LYS  25           3HE      LYS  25  10.181  10.407   3.000
  205    HZ1  LYS  25           3HZ      LYS  25   8.797  12.857   2.133
  206    HZ2  LYS  25           1HZ      LYS  25   9.303  12.532   3.667
  207    HZ3  LYS  25           2HZ      LYS  25  10.408  12.730   2.460
  208    H    ARG  26           HN       ARG  26  12.249   7.638  -2.522
  209    HA   ARG  26           HA       ARG  26  11.108   7.708  -5.110
  210    HB2  ARG  26           2HB      ARG  26  13.828   7.344  -3.963
  211    HB3  ARG  26           3HB      ARG  26  13.583   6.828  -5.649
  212    HG2  ARG  26           2HG      ARG  26  12.951   9.581  -4.552
  213    HG3  ARG  26           3HG      ARG  26  14.414   9.145  -5.467
  214    HD2  ARG  26           2HD      ARG  26  12.902   8.375  -7.333
  215    HD3  ARG  26           3HD      ARG  26  11.540   9.072  -6.429
  216    HE   ARG  26           HE       ARG  26  13.164  11.199  -6.571
  217   HH11  ARG  26          2HH1      ARG  26  12.249   8.834  -9.009
  218   HH12  ARG  26          1HH1      ARG  26  12.406   9.954 -10.343
  219   HH21  ARG  26          2HH2      ARG  26  13.378  12.660  -8.320
  220   HH22  ARG  26          1HH2      ARG  26  13.046  12.125  -9.952
  221    H    ARG  27           HN       ARG  27  12.347   4.989  -3.160
  222    HA   ARG  27           HA       ARG  27  12.202   3.030  -5.218
  223    HB2  ARG  27           2HB      ARG  27  13.408   2.624  -3.157
  224    HB3  ARG  27           3HB      ARG  27  11.911   2.789  -2.208
  225    HG2  ARG  27           2HG      ARG  27  11.001   0.790  -3.290
  226    HG3  ARG  27           3HG      ARG  27  12.493   0.626  -4.247
  227    HD2  ARG  27           2HD      ARG  27  13.797   0.232  -2.266
  228    HD3  ARG  27           3HD      ARG  27  12.411   0.607  -1.219
  229    HE   ARG  27           HE       ARG  27  11.752  -1.533  -2.991
  230   HH11  ARG  27          2HH1      ARG  27  13.800  -0.841  -0.208
  231   HH12  ARG  27          1HH1      ARG  27  13.679  -2.459   0.442
  232   HH21  ARG  27          2HH2      ARG  27  11.558  -3.627  -2.101
  233   HH22  ARG  27          1HH2      ARG  27  12.410  -4.034  -0.629
  234    H    ILE  28           HN       ILE  28   9.851   4.021  -2.711
  235    HA   ILE  28           HA       ILE  28   7.799   2.222  -3.464
  236    HB   ILE  28           HB       ILE  28   7.588   4.979  -2.187
  237   HG12  ILE  28          2HG1      ILE  28   7.694   2.221  -0.921
  238   HG13  ILE  28          3HG1      ILE  28   9.057   3.363  -0.998
  239   HG21  ILE  28          1HG2      ILE  28   5.428   4.186  -1.312
  240   HG22  ILE  28          2HG2      ILE  28   5.442   4.205  -3.092
  241   HG23  ILE  28          3HG2      ILE  28   5.623   2.666  -2.215
  242   HD11  ILE  28          3HD1      ILE  28   6.424   3.829   0.426
  243   HD12  ILE  28          1HD1      ILE  28   7.967   3.425   1.208
  244   HD13  ILE  28          2HD1      ILE  28   7.789   4.970   0.350
  245    H    MET  29           HN       MET  29   8.503   5.576  -4.495
  246    HA   MET  29           HA       MET  29   6.221   5.796  -6.215
  247    HB2  MET  29           2HB      MET  29   8.870   7.269  -6.185
  248    HB3  MET  29           3HB      MET  29   7.498   7.698  -7.233
  249    HG2  MET  29           2HG      MET  29   6.116   8.097  -5.234
  250    HG3  MET  29           3HG      MET  29   7.502   7.703  -4.204
  251    HE1  MET  29           3HE      MET  29   7.189  10.031  -2.952
  252    HE2  MET  29           1HE      MET  29   7.120  11.602  -3.783
  253    HE3  MET  29           2HE      MET  29   5.812  10.420  -4.012
  254    H    ASP  30           HN       ASP  30   9.522   4.603  -6.667
  255    HA   ASP  30           HA       ASP  30   9.539   4.517  -9.502
  256    HB2  ASP  30           2HB      ASP  30  11.529   4.203  -8.026
  257    HB3  ASP  30           3HB      ASP  30  10.897   2.608  -7.566
  258    HD2  ASP  30           2HD      ASP  30  12.658   3.030 -11.079
  259    H    MET  31           HN       MET  31   8.387   2.221  -7.045
  260    HA   MET  31           HA       MET  31   7.726   0.141  -8.903
  261    HB2  MET  31           2HB      MET  31   6.683   0.755  -6.123
  262    HB3  MET  31           3HB      MET  31   6.353  -0.742  -7.029
  263    HG2  MET  31           2HG      MET  31   8.756  -1.242  -7.070
  264    HG3  MET  31           3HG      MET  31   9.083   0.245  -6.162
  265    HE1  MET  31           3HE      MET  31   6.520   0.238  -4.184
  266    HE2  MET  31           1HE      MET  31   7.235  -0.526  -2.747
  267    HE3  MET  31           2HE      MET  31   8.169   0.671  -3.671
  268    H    GLY  32           HN       GLY  32   6.125   3.096  -7.892
  269    HA2  GLY  32           1HA      GLY  32   4.574   3.826  -9.742
  270    HA3  GLY  32           2HA      GLY  32   3.776   2.252  -9.518
  271    H    ILE  33           HN       ILE  33   4.880   3.468  -6.560
  272    HA   ILE  33           HA       ILE  33   2.071   4.164  -5.915
  273    HB   ILE  33           HB       ILE  33   4.344   3.392  -4.040
  274   HG12  ILE  33          2HG1      ILE  33   2.017   1.712  -5.022
  275   HG13  ILE  33          3HG1      ILE  33   3.691   1.580  -5.614
  276   HG21  ILE  33          1HG2      ILE  33   2.551   3.081  -2.383
  277   HG22  ILE  33          2HG2      ILE  33   2.594   4.754  -2.986
  278   HG23  ILE  33          3HG2      ILE  33   1.352   3.626  -3.578
  279   HD11  ILE  33          3HD1      ILE  33   2.764   1.083  -2.773
  280   HD12  ILE  33          1HD1      ILE  33   3.190  -0.170  -3.957
  281   HD13  ILE  33          2HD1      ILE  33   4.437   0.949  -3.366
  282    H    THR  34           HN       THR  34   1.743   6.306  -6.070
  283    HA   THR  34           HA       THR  34   3.588   8.007  -4.465
  284    HB   THR  34           HB       THR  34   2.841   9.940  -5.856
  285    HG1  THR  34           1HG      THR  34   1.819   9.442  -7.865
  286   HG21  THR  34          3HG2      THR  34   4.118   7.680  -7.429
  287   HG22  THR  34          1HG2      THR  34   4.205   9.408  -7.837
  288   HG23  THR  34          2HG2      THR  34   4.965   8.808  -6.346
  289    H    ARG  35           HN       ARG  35   2.205  10.165  -3.853
  290    HA   ARG  35           HA       ARG  35   0.147   9.090  -2.130
  291    HB2  ARG  35           2HB      ARG  35  -0.062  11.315  -1.256
  292    HB3  ARG  35           3HB      ARG  35   1.664  10.940  -1.476
  293    HG2  ARG  35           2HG      ARG  35   1.547  12.211  -3.652
  294    HG3  ARG  35           3HG      ARG  35  -0.078  12.746  -3.160
  295    HD2  ARG  35           2HD      ARG  35   0.946  13.637  -1.045
  296    HD3  ARG  35           3HD      ARG  35   2.543  13.257  -1.724
  297    HE   ARG  35           HE       ARG  35   0.633  15.284  -2.768
  298   HH11  ARG  35          2HH1      ARG  35   3.859  13.874  -2.655
  299   HH12  ARG  35          1HH1      ARG  35   4.602  15.195  -3.528
  300   HH21  ARG  35          2HH2      ARG  35   1.613  16.999  -3.898
  301   HH22  ARG  35          1HH2      ARG  35   3.330  16.965  -4.232
  302    H    GLY  36           HN       GLY  36  -2.033   9.157  -2.290
  303    HA2  GLY  36           1HA      GLY  36  -4.090   9.906  -3.197
  304    HA3  GLY  36           2HA      GLY  36  -3.214  10.630  -4.565
  305    H    CYS  37           HN       CYS  37  -1.701   7.824  -4.405
  306    HA   CYS  37           HA       CYS  37  -3.322   6.657  -6.520
  307    HB2  CYS  37           2HB      CYS  37  -0.792   5.732  -5.133
  308    HB3  CYS  37           3HB      CYS  37  -1.557   4.893  -6.506
  309    HG   CYS  37           HG       CYS  37   0.591   6.139  -7.309
  310    H    GLU  38           HN       GLU  38  -4.405   4.738  -6.512
  311    HA   GLU  38           HA       GLU  38  -5.161   3.759  -3.823
  312    HB2  GLU  38           2HB      GLU  38  -7.037   2.672  -5.047
  313    HB3  GLU  38           3HB      GLU  38  -7.010   4.446  -5.194
  314    HG2  GLU  38           2HG      GLU  38  -5.641   3.869  -7.396
  315    HG3  GLU  38           3HG      GLU  38  -6.535   2.340  -7.252
  316    HE2  GLU  38           2HE      GLU  38  -8.526   5.637  -8.186
  317    H    ILE  39           HN       ILE  39  -4.798   1.733  -3.153
  318    HA   ILE  39           HA       ILE  39  -3.268  -0.021  -5.001
  319    HB   ILE  39           HB       ILE  39  -2.904   0.360  -2.002
  320   HG12  ILE  39          2HG1      ILE  39  -1.093   0.993  -4.351
  321   HG13  ILE  39          3HG1      ILE  39  -1.942   2.171  -3.321
  322   HG21  ILE  39          1HG2      ILE  39  -1.061  -1.258  -2.204
  323   HG22  ILE  39          2HG2      ILE  39  -2.618  -1.987  -2.659
  324   HG23  ILE  39          3HG2      ILE  39  -1.461  -1.499  -3.920
  325   HD11  ILE  39          3HD1      ILE  39   0.221   0.252  -2.419
  326   HD12  ILE  39          1HD1      ILE  39   0.433   1.993  -2.701
  327   HD13  ILE  39          2HD1      ILE  39  -0.627   1.432  -1.390
  328    H    TYR  40           HN       TYR  40  -4.263  -1.841  -5.434
  329    HA   TYR  40           HA       TYR  40  -6.398  -2.811  -3.647
  330    HB2  TYR  40           2HB      TYR  40  -6.548  -2.713  -6.203
  331    HB3  TYR  40           3HB      TYR  40  -5.396  -4.060  -6.219
  332    HD1  TYR  40           1HD      TYR  40  -6.079  -6.288  -5.352
  333    HD2  TYR  40           2HD      TYR  40  -8.842  -3.051  -5.566
  334    HE1  TYR  40           1HE      TYR  40  -7.948  -7.864  -5.114
  335    HE2  TYR  40           2HE      TYR  40 -10.706  -4.623  -5.321
  336    HH   TYR  40           HH       TYR  40 -11.343  -6.780  -5.081
  337    H    ILE  41           HN       ILE  41  -5.562  -3.787  -1.864
  338    HA   ILE  41           HA       ILE  41  -3.050  -5.176  -1.932
  339    HB   ILE  41           HB       ILE  41  -5.196  -5.452   0.203
  340   HG12  ILE  41          2HG1      ILE  41  -3.591  -3.712   1.353
  341   HG13  ILE  41          3HG1      ILE  41  -3.190  -3.279  -0.326
  342   HG21  ILE  41          1HG2      ILE  41  -3.269  -5.967   1.653
  343   HG22  ILE  41          2HG2      ILE  41  -3.367  -7.097   0.284
  344   HG23  ILE  41          3HG2      ILE  41  -2.175  -5.775   0.264
  345   HD11  ILE  41          3HD1      ILE  41  -5.953  -3.238   0.909
  346   HD12  ILE  41          1HD1      ILE  41  -4.946  -1.814   0.577
  347   HD13  ILE  41          2HD1      ILE  41  -5.550  -2.802  -0.770
  348    H    ARG  42           HN       ARG  42  -2.646  -7.126  -2.682
  349    HA   ARG  42           HA       ARG  42  -4.954  -8.698  -3.633
  350    HB2  ARG  42           2HB      ARG  42  -3.030  -7.917  -5.089
  351    HB3  ARG  42           3HB      ARG  42  -2.001  -9.070  -4.205
  352    HG2  ARG  42           2HG      ARG  42  -4.496 -10.018  -5.575
  353    HG3  ARG  42           3HG      ARG  42  -3.011  -9.721  -6.511
  354    HD2  ARG  42           2HD      ARG  42  -1.995 -11.180  -4.477
  355    HD3  ARG  42           3HD      ARG  42  -3.640 -11.848  -4.538
  356    HE   ARG  42           HE       ARG  42  -2.349 -11.654  -7.138
  357   HH11  ARG  42          2HH1      ARG  42  -3.001 -13.653  -4.321
  358   HH12  ARG  42          1HH1      ARG  42  -2.551 -15.143  -5.117
  359   HH21  ARG  42          2HH2      ARG  42  -1.693 -13.590  -8.149
  360   HH22  ARG  42          1HH2      ARG  42  -1.810 -15.108  -7.287
  361    H    LYS  43           HN       LYS  43  -1.913  -9.196  -1.757
  362    HA   LYS  43           HA       LYS  43  -3.276 -11.328  -0.274
  363    HB2  LYS  43           2HB      LYS  43  -2.426 -12.580  -2.168
  364    HB3  LYS  43           3HB      LYS  43  -0.808 -11.867  -1.956
  365    HG2  LYS  43           2HG      LYS  43  -0.897 -14.171  -1.125
  366    HG3  LYS  43           3HG      LYS  43  -0.566 -13.017   0.189
  367    HD2  LYS  43           2HD      LYS  43  -2.916 -13.106   0.878
  368    HD3  LYS  43           3HD      LYS  43  -3.276 -14.224  -0.460
  369    HE2  LYS  43           2HE      LYS  43  -3.032 -15.447   1.642
  370    HE3  LYS  43           3HE      LYS  43  -1.735 -15.880   0.509
  371    HZ1  LYS  43           3HZ      LYS  43  -1.485 -13.995   2.757
  372    HZ2  LYS  43           1HZ      LYS  43  -0.898 -15.533   2.727
  373    HZ3  LYS  43           2HZ      LYS  43  -0.281 -14.398   1.704
  374    H    VAL  44           HN       VAL  44  -2.882 -10.862   1.770
  375    HA   VAL  44           HA       VAL  44  -0.215  -9.762   2.478
  376    HB   VAL  44           HB       VAL  44  -2.752  -9.918   4.157
  377   HG11  VAL  44          1HG1      VAL  44  -1.589  -8.367   5.672
  378   HG12  VAL  44          2HG1      VAL  44  -0.699  -9.896   5.494
  379   HG13  VAL  44          3HG1      VAL  44  -0.147  -8.438   4.634
  380   HG21  VAL  44          3HG2      VAL  44  -3.032  -8.406   2.255
  381   HG22  VAL  44          1HG2      VAL  44  -2.949  -7.500   3.783
  382   HG23  VAL  44          2HG2      VAL  44  -1.536  -7.554   2.703
  383    H    ALA  45           HN       ALA  45   1.205 -10.971   3.651
  384    HA   ALA  45           HA       ALA  45   0.348 -13.656   4.482
  385    HB1  ALA  45           1HB      ALA  45   2.721 -13.972   5.056
  386    HB2  ALA  45           2HB      ALA  45   2.532 -13.363   3.395
  387    HB3  ALA  45           3HB      ALA  45   3.036 -12.258   4.697
  388    HA   PRO  46           HA       PRO  46  -0.684 -12.528   8.604
  389    HB2  PRO  46           2HB      PRO  46   0.508 -15.154   9.452
  390    HB3  PRO  46           3HB      PRO  46  -1.163 -14.523   9.611
  391    HG2  PRO  46           2HG      PRO  46  -0.542 -16.419   7.854
  392    HG3  PRO  46           3HG      PRO  46  -1.806 -15.191   7.516
  393    HD2  PRO  46           2HD      PRO  46   1.037 -15.414   6.522
  394    HD3  PRO  46           3HD      PRO  46  -0.431 -14.845   5.670
  395    H    LEU  47           HN       LEU  47   2.568 -13.557   7.786
  396    HA   LEU  47           HA       LEU  47   3.780 -12.766  10.291
  397    HB2  LEU  47           2HB      LEU  47   4.983 -13.027   7.516
  398    HB3  LEU  47           3HB      LEU  47   5.888 -12.895   9.043
  399    HG   LEU  47           HG       LEU  47   4.044 -15.170   8.281
  400   HD11  LEU  47          1HD1      LEU  47   6.114 -16.481   8.040
  401   HD12  LEU  47          2HD1      LEU  47   6.073 -15.114   6.902
  402   HD13  LEU  47          3HD1      LEU  47   7.075 -15.021   8.371
  403   HD21  LEU  47          3HD2      LEU  47   4.162 -14.776  10.702
  404   HD22  LEU  47          1HD2      LEU  47   4.994 -16.284  10.261
  405   HD23  LEU  47          2HD2      LEU  47   5.939 -14.822  10.628
  406    H    GLY  48           HN       GLY  48   2.642 -11.139   7.450
  407    HA2  GLY  48           1HA      GLY  48   2.442  -8.737   7.452
  408    HA3  GLY  48           2HA      GLY  48   3.933  -8.643   8.417
  409    H    ASP  49           HN       ASP  49   4.813 -10.973   6.481
  410    HA   ASP  49           HA       ASP  49   5.180  -9.449   3.997
  411    HB2  ASP  49           2HB      ASP  49   7.557  -9.511   3.986
  412    HB3  ASP  49           3HB      ASP  49   7.088  -8.823   5.555
  413    HD2  ASP  49           2HD      ASP  49   9.199 -12.121   5.495
  414    HA   PRO  50           HA       PRO  50   5.947  -9.603   2.313
  415    HB2  PRO  50           2HB      PRO  50   5.718 -10.401  -0.271
  416    HB3  PRO  50           3HB      PRO  50   7.174 -10.786   0.704
  417    HG2  PRO  50           2HG      PRO  50   4.876 -12.535  -0.001
  418    HG3  PRO  50           3HG      PRO  50   6.624 -12.935   0.053
  419    HD2  PRO  50           2HD      PRO  50   4.704 -13.461   2.057
  420    HD3  PRO  50           3HD      PRO  50   6.478 -13.449   2.286
  421    H    ILE  51           HN       ILE  51   4.510  -8.158   1.291
  422    HA   ILE  51           HA       ILE  51   1.700  -9.120   1.198
  423    HB   ILE  51           HB       ILE  51   2.759  -6.289   1.569
  424   HG12  ILE  51          2HG1      ILE  51   1.409  -8.178   3.522
  425   HG13  ILE  51          3HG1      ILE  51   3.132  -7.728   3.524
  426   HG21  ILE  51          1HG2      ILE  51   0.407  -5.695   1.997
  427   HG22  ILE  51          2HG2      ILE  51   0.621  -6.355   0.360
  428   HG23  ILE  51          3HG2      ILE  51  -0.080  -7.368   1.643
  429   HD11  ILE  51          3HD1      ILE  51   0.801  -5.845   3.969
  430   HD12  ILE  51          1HD1      ILE  51   1.881  -6.471   5.231
  431   HD13  ILE  51          2HD1      ILE  51   2.523  -5.396   3.971
  432    H    GLN  52           HN       GLN  52   1.112  -9.583  -0.813
  433    HA   GLN  52           HA       GLN  52   2.315  -8.169  -3.073
  434    HB2  GLN  52           2HB      GLN  52   0.325 -10.427  -2.818
  435    HB3  GLN  52           3HB      GLN  52   0.637  -9.623  -4.375
  436    HG2  GLN  52           2HG      GLN  52   1.950 -11.617  -4.278
  437    HG3  GLN  52           3HG      GLN  52   3.041 -10.221  -4.140
  438   HE21  GLN  52          1HE2      GLN  52   1.579 -12.954  -2.474
  439   HE22  GLN  52          2HE2      GLN  52   2.661 -12.946  -1.098
  440    H    ILE  53           HN       ILE  53   1.578  -6.309  -3.788
  441    HA   ILE  53           HA       ILE  53  -1.327  -5.737  -3.472
  442    HB   ILE  53           HB       ILE  53  -0.638  -3.299  -3.388
  443   HG12  ILE  53          2HG1      ILE  53   2.106  -4.491  -2.872
  444   HG13  ILE  53          3HG1      ILE  53   1.617  -3.599  -4.334
  445   HG21  ILE  53          1HG2      ILE  53  -0.050  -3.354  -0.998
  446   HG22  ILE  53          2HG2      ILE  53  -1.322  -4.537  -1.382
  447   HG23  ILE  53          3HG2      ILE  53   0.355  -5.080  -1.137
  448   HD11  ILE  53          3HD1      ILE  53   1.726  -2.484  -1.521
  449   HD12  ILE  53          1HD1      ILE  53   2.910  -2.170  -2.806
  450   HD13  ILE  53          2HD1      ILE  53   1.241  -1.592  -2.983
  451    H    ASN  54           HN       ASN  54  -2.399  -4.996  -5.283
  452    HA   ASN  54           HA       ASN  54  -0.785  -5.060  -7.760
  453    HB2  ASN  54           2HB      ASN  54  -2.948  -6.383  -7.486
  454    HB3  ASN  54           3HB      ASN  54  -3.798  -4.824  -7.543
  455   HD21  ASN  54          1HD2      ASN  54  -1.996  -7.227  -9.347
  456   HD22  ASN  54          2HD2      ASN  54  -2.291  -6.558 -10.938
  457    H    VAL  55           HN       VAL  55   0.093  -3.213  -8.352
  458    HA   VAL  55           HA       VAL  55  -1.520  -0.737  -7.997
  459    HB   VAL  55           HB       VAL  55   1.513  -0.992  -7.928
  460   HG11  VAL  55          1HG1      VAL  55   1.481   1.374  -7.260
  461   HG12  VAL  55          2HG1      VAL  55   0.740   1.138  -8.860
  462   HG13  VAL  55          3HG1      VAL  55  -0.289   1.397  -7.431
  463   HG21  VAL  55          3HG2      VAL  55   0.480  -1.940  -5.918
  464   HG22  VAL  55          1HG2      VAL  55   1.329  -0.423  -5.542
  465   HG23  VAL  55          2HG2      VAL  55  -0.444  -0.439  -5.676
  466    H    ARG  56           HN       ARG  56  -2.134   0.139  -9.822
  467    HA   ARG  56           HA       ARG  56  -2.238   0.777 -11.998
  468    HB2  ARG  56           2HB      ARG  56   0.774   0.415 -12.015
  469    HB3  ARG  56           3HB      ARG  56  -0.196   1.380 -13.154
  470    HG2  ARG  56           2HG      ARG  56  -0.934   2.724 -11.096
  471    HG3  ARG  56           3HG      ARG  56   0.421   1.932 -10.256
  472    HD2  ARG  56           2HD      ARG  56   0.594   3.622 -12.767
  473    HD3  ARG  56           3HD      ARG  56   1.099   4.104 -11.133
  474    HE   ARG  56           HE       ARG  56   2.392   1.698 -12.186
  475   HH11  ARG  56          2HH1      ARG  56   2.488   5.196 -11.838
  476   HH12  ARG  56          1HH1      ARG  56   4.222   5.298 -12.047
  477   HH21  ARG  56          2HH2      ARG  56   4.658   1.836 -12.448
  478   HH22  ARG  56          1HH2      ARG  56   5.451   3.394 -12.393
  479    H    GLY  57           HN       GLY  57  -2.137  -2.189 -11.214
  480    HA2  GLY  57           1HA      GLY  57  -2.886  -3.878 -12.712
  481    HA3  GLY  57           2HA      GLY  57  -1.986  -3.092 -14.029
  482    H    TYR  58           HN       TYR  58   0.085  -3.032 -11.467
  483    HA   TYR  58           HA       TYR  58   1.206  -5.694 -12.218
  484    HB2  TYR  58           2HB      TYR  58   2.523  -3.726 -13.013
  485    HB3  TYR  58           3HB      TYR  58   2.718  -3.217 -11.327
  486    HD1  TYR  58           1HD      TYR  58   3.500  -5.963 -13.717
  487    HD2  TYR  58           2HD      TYR  58   4.433  -4.160  -9.973
  488    HE1  TYR  58           1HE      TYR  58   5.490  -7.387 -13.529
  489    HE2  TYR  58           2HE      TYR  58   6.424  -5.586  -9.782
  490    HH   TYR  58           HH       TYR  58   7.689  -7.215 -10.735
  491    H    GLU  59           HN       GLU  59   1.584  -7.121 -10.635
  492    HA   GLU  59           HA       GLU  59   0.782  -6.347  -7.930
  493    HB2  GLU  59           2HB      GLU  59   1.169  -8.804  -7.469
  494    HB3  GLU  59           3HB      GLU  59  -0.104  -8.405  -8.645
  495    HG2  GLU  59           2HG      GLU  59   1.486  -8.904 -10.479
  496    HG3  GLU  59           3HG      GLU  59   2.689  -9.395  -9.266
  497    HE2  GLU  59           2HE      GLU  59  -0.282 -11.865 -10.118
  498    H    LEU  60           HN       LEU  60   2.145  -5.414  -6.648
  499    HA   LEU  60           HA       LEU  60   5.038  -5.967  -6.879
  500    HB2  LEU  60           2HB      LEU  60   3.467  -3.918  -5.278
  501    HB3  LEU  60           3HB      LEU  60   5.242  -4.036  -5.340
  502    HG   LEU  60           HG       LEU  60   3.532  -3.523  -7.778
  503   HD11  LEU  60          1HD1      LEU  60   4.130  -1.149  -7.519
  504   HD12  LEU  60          2HD1      LEU  60   3.170  -1.730  -6.139
  505   HD13  LEU  60          3HD1      LEU  60   4.930  -1.521  -5.973
  506   HD21  LEU  60          3HD2      LEU  60   5.792  -4.401  -8.178
  507   HD22  LEU  60          1HD2      LEU  60   5.661  -2.708  -8.709
  508   HD23  LEU  60          2HD2      LEU  60   6.478  -3.098  -7.178
  509    H    SER  61           HN       SER  61   6.033  -7.319  -5.499
  510    HA   SER  61           HA       SER  61   4.614  -8.149  -3.057
  511    HB2  SER  61           2HB      SER  61   6.645  -9.634  -2.797
  512    HB3  SER  61           3HB      SER  61   5.690  -9.914  -4.273
  513    HG   SER  61           HG       SER  61   7.951  -9.810  -4.684
  514    H    LEU  62           HN       LEU  62   4.688  -6.716  -1.445
  515    HA   LEU  62           HA       LEU  62   7.259  -5.275  -0.990
  516    HB2  LEU  62           2HB      LEU  62   5.175  -3.963  -1.622
  517    HB3  LEU  62           3HB      LEU  62   4.491  -4.474  -0.061
  518    HG   LEU  62           HG       LEU  62   6.451  -3.366   1.055
  519   HD11  LEU  62          1HD1      LEU  62   7.708  -1.693  -0.243
  520   HD12  LEU  62          2HD1      LEU  62   7.967  -3.335  -0.876
  521   HD13  LEU  62          3HD1      LEU  62   6.874  -2.217  -1.724
  522   HD21  LEU  62          3HD2      LEU  62   4.235  -2.322   0.924
  523   HD22  LEU  62          1HD2      LEU  62   5.525  -1.101   0.811
  524   HD23  LEU  62          2HD2      LEU  62   4.656  -1.615  -0.655
  525    H    ARG  63           HN       ARG  63   8.296  -5.613   0.911
  526    HA   ARG  63           HA       ARG  63   7.093  -7.552   2.741
  527    HB2  ARG  63           2HB      ARG  63   9.793  -6.173   2.730
  528    HB3  ARG  63           3HB      ARG  63   9.282  -7.387   3.926
  529    HG2  ARG  63           2HG      ARG  63   8.975  -9.023   2.090
  530    HG3  ARG  63           3HG      ARG  63   9.583  -7.808   0.939
  531    HD2  ARG  63           2HD      ARG  63  11.716  -7.724   2.185
  532    HD3  ARG  63           3HD      ARG  63  11.107  -8.976   3.289
  533    HE   ARG  63           HE       ARG  63  10.842 -10.010   0.706
  534   HH11  ARG  63          2HH1      ARG  63  13.427  -8.950   2.851
  535   HH12  ARG  63          1HH1      ARG  63  14.625 -10.002   2.133
  536   HH21  ARG  63          2HH2      ARG  63  12.423 -11.363  -0.239
  537   HH22  ARG  63          1HH2      ARG  63  14.057 -11.368   0.384
  538    H    LYS  64           HN       LYS  64   7.488  -7.111   5.174
  539    HA   LYS  64           HA       LYS  64   5.542  -5.204   5.858
  540    HB2  LYS  64           2HB      LYS  64   6.165  -5.649   8.188
  541    HB3  LYS  64           3HB      LYS  64   6.048  -7.150   7.239
  542    HG2  LYS  64           2HG      LYS  64   8.468  -7.272   7.077
  543    HG3  LYS  64           3HG      LYS  64   8.627  -5.722   7.936
  544    HD2  LYS  64           2HD      LYS  64   9.045  -7.537   9.480
  545    HD3  LYS  64           3HD      LYS  64   7.509  -6.746   9.906
  546    HE2  LYS  64           2HE      LYS  64   6.304  -8.535   8.649
  547    HE3  LYS  64           3HE      LYS  64   7.863  -9.350   8.394
  548    HZ1  LYS  64           3HZ      LYS  64   6.646  -8.758  11.008
  549    HZ2  LYS  64           1HZ      LYS  64   6.693 -10.238  10.284
  550    HZ3  LYS  64           2HZ      LYS  64   8.092  -9.516  10.772
  551    H    SER  65           HN       SER  65   9.068  -4.908   5.727
  552    HA   SER  65           HA       SER  65   9.428  -2.702   7.408
  553    HB2  SER  65           2HB      SER  65  10.909  -3.217   4.807
  554    HB3  SER  65           3HB      SER  65  11.509  -2.353   6.242
  555    HG   SER  65           HG       SER  65  12.252  -4.528   6.140
  556    H    ALA  66           HN       ALA  66   8.888  -2.646   3.835
  557    HA   ALA  66           HA       ALA  66   8.647   0.243   3.872
  558    HB1  ALA  66           1HB      ALA  66   8.093   0.020   1.488
  559    HB2  ALA  66           2HB      ALA  66   9.537  -0.925   1.913
  560    HB3  ALA  66           3HB      ALA  66   7.973  -1.744   1.684
  561    H    ALA  67           HN       ALA  67   6.422  -2.493   4.042
  562    HA   ALA  67           HA       ALA  67   4.067  -1.038   3.334
  563    HB1  ALA  67           1HB      ALA  67   2.844  -2.930   4.324
  564    HB2  ALA  67           2HB      ALA  67   4.176  -3.488   3.286
  565    HB3  ALA  67           3HB      ALA  67   4.353  -3.520   5.057
  566    H    GLU  68           HN       GLU  68   5.920  -1.261   6.304
  567    HA   GLU  68           HA       GLU  68   3.808  -0.132   7.960
  568    HB2  GLU  68           2HB      GLU  68   6.797  -0.394   8.416
  569    HB3  GLU  68           3HB      GLU  68   5.614   0.137   9.635
  570    HG2  GLU  68           2HG      GLU  68   4.494  -2.046   9.477
  571    HG3  GLU  68           3HG      GLU  68   5.708  -2.574   8.291
  572    HE2  GLU  68           2HE      GLU  68   6.548  -3.113  11.988
  573    H    MET  69           HN       MET  69   6.265   1.037   5.807
  574    HA   MET  69           HA       MET  69   6.413   3.680   7.057
  575    HB2  MET  69           2HB      MET  69   7.620   2.552   4.512
  576    HB3  MET  69           3HB      MET  69   7.946   4.176   5.163
  577    HG2  MET  69           2HG      MET  69   8.966   3.244   7.134
  578    HG3  MET  69           3HG      MET  69   8.496   1.603   6.660
  579    HE1  MET  69           3HE      MET  69  10.735   4.720   5.747
  580    HE2  MET  69           1HE      MET  69  11.588   4.132   4.302
  581    HE3  MET  69           2HE      MET  69   9.834   4.414   4.243
  582    H    ILE  70           HN       ILE  70   4.347   2.123   4.858
  583    HA   ILE  70           HA       ILE  70   3.710   4.654   3.474
  584    HB   ILE  70           HB       ILE  70   2.630   1.848   3.001
  585   HG12  ILE  70          2HG1      ILE  70   4.675   3.480   1.460
  586   HG13  ILE  70          3HG1      ILE  70   5.025   2.066   2.483
  587   HG21  ILE  70          1HG2      ILE  70   1.729   2.789   0.908
  588   HG22  ILE  70          2HG2      ILE  70   1.051   3.612   2.333
  589   HG23  ILE  70          3HG2      ILE  70   2.329   4.398   1.374
  590   HD11  ILE  70          3HD1      ILE  70   3.349   2.066  -0.040
  591   HD12  ILE  70          1HD1      ILE  70   5.013   1.460   0.098
  592   HD13  ILE  70          2HD1      ILE  70   3.701   0.652   0.982
  593    H    GLU  71           HN       GLU  71   2.355   5.951   4.484
  594    HA   GLU  71           HA       GLU  71   0.305   4.944   6.317
  595    HB2  GLU  71           2HB      GLU  71   1.638   7.107   6.552
  596    HB3  GLU  71           3HB      GLU  71   0.660   7.742   5.208
  597    HG2  GLU  71           2HG      GLU  71  -0.482   8.564   7.012
  598    HG3  GLU  71           3HG      GLU  71  -1.353   7.042   6.726
  599    HE2  GLU  71           2HE      GLU  71  -0.773   6.376  10.056
  600    H    VAL  72           HN       VAL  72  -1.612   4.192   5.585
  601    HA   VAL  72           HA       VAL  72  -2.544   5.277   2.980
  602    HB   VAL  72           HB       VAL  72  -3.627   3.058   2.567
  603   HG11  VAL  72          1HG1      VAL  72  -1.569   1.909   1.867
  604   HG12  VAL  72          2HG1      VAL  72  -1.499   3.650   1.508
  605   HG13  VAL  72          3HG1      VAL  72  -0.613   2.992   2.905
  606   HG21  VAL  72          3HG2      VAL  72  -3.707   2.258   4.880
  607   HG22  VAL  72          1HG2      VAL  72  -2.858   1.097   3.833
  608   HG23  VAL  72          2HG2      VAL  72  -1.930   2.161   4.914
  609    H    GLU  73           HN       GLU  73  -4.816   5.197   2.594
  610    HA   GLU  73           HA       GLU  73  -6.459   5.180   5.072
  611    HB2  GLU  73           2HB      GLU  73  -5.913   7.509   4.431
  612    HB3  GLU  73           3HB      GLU  73  -6.591   7.210   2.813
  613    HG2  GLU  73           2HG      GLU  73  -8.152   8.437   4.248
  614    HG3  GLU  73           3HG      GLU  73  -8.796   6.849   3.776
  615    HE2  GLU  73           2HE      GLU  73  -8.635   5.677   7.069
  616    H    LEU  74           HN       LEU  74  -8.521   4.350   4.831
  617    HA   LEU  74           HA       LEU  74  -8.872   2.528   2.643
  618    HB2  LEU  74           2HB      LEU  74 -10.384   3.328   5.074
  619    HB3  LEU  74           3HB      LEU  74 -11.323   2.597   3.749
  620    HG   LEU  74           HG       LEU  74 -10.668   0.947   5.427
  621   HD11  LEU  74          1HD1      LEU  74  -9.679  -0.709   3.900
  622   HD12  LEU  74          2HD1      LEU  74 -10.933   0.256   3.090
  623   HD13  LEU  74          3HD1      LEU  74  -9.213   0.598   2.787
  624   HD21  LEU  74          3HD2      LEU  74  -8.593   1.988   6.207
  625   HD22  LEU  74          1HD2      LEU  74  -8.315   0.300   5.723
  626   HD23  LEU  74          2HD2      LEU  74  -7.817   1.625   4.646
  627    H    GLU  75           HN       GLU  75 -11.033   2.435   1.445
  628    HA   GLU  75           HA       GLU  75 -11.275   4.811  -0.141
  629    HB2  GLU  75           2HB      GLU  75 -13.303   3.536  -1.072
  630    HB3  GLU  75           3HB      GLU  75 -11.680   2.839  -1.297
  631    HG2  GLU  75           2HG      GLU  75 -13.250   1.095  -0.742
  632    HG3  GLU  75           3HG      GLU  75 -12.097   1.310   0.592
  633    HE2  GLU  75           2HE      GLU  75 -15.747   2.711   1.347
  634    H    HIS  76           HN       HIS  76 -13.574   5.691  -0.626
  635    HA   HIS  76           HA       HIS  76 -14.957   6.158   1.970
  636    HB2  HIS  76           2HB      HIS  76 -14.249   8.214  -0.150
  637    HB3  HIS  76           3HB      HIS  76 -15.316   8.512   1.235
  638    HD1  HIS  76           1HD      HIS  76 -14.009   7.777   3.652
  639    HD2  HIS  76           2HD      HIS  76 -11.725   9.029   0.385
  640    HE1  HIS  76           1HE      HIS  76 -11.766   8.495   4.591
  641    HE2  HIS  76           2HE      HIS  76 -10.386   9.258   2.604
  642    H    HIS  77           HN       HIS  77 -15.555   4.260  -0.105
  643    HA   HIS  77           HA       HIS  77 -17.559   5.252  -1.890
  644    HB2  HIS  77           2HB      HIS  77 -16.332   3.149  -2.247
  645    HB3  HIS  77           3HB      HIS  77 -17.086   2.455  -0.800
  646    HD1  HIS  77           1HD      HIS  77 -17.848   3.449  -4.365
  647    HD2  HIS  77           2HD      HIS  77 -19.668   1.486  -1.157
  648    HE1  HIS  77           1HE      HIS  77 -19.941   2.360  -5.294
  649    HE2  HIS  77           2HE      HIS  77 -21.039   1.162  -3.342
  650    H    HIS  78           HN       HIS  78 -17.570   4.320   1.471
  651    HA   HIS  78           HA       HIS  78 -20.498   4.079   1.567
  652    HB2  HIS  78           2HB      HIS  78 -18.834   2.686   2.920
  653    HB3  HIS  78           3HB      HIS  78 -18.555   4.145   3.889
  654    HD1  HIS  78           1HD      HIS  78 -19.555   3.209   6.042
  655    HD2  HIS  78           2HD      HIS  78 -22.186   3.098   2.798
  656    HE1  HIS  78           1HE      HIS  78 -21.830   2.617   6.992
  657    HE2  HIS  78           2HE      HIS  78 -23.416   2.549   5.018
  658    H    HIS  79           HN       HIS  79 -18.693   6.602   1.015
  659    HA   HIS  79           HA       HIS  79 -20.430   8.382   2.644
  660    HB2  HIS  79           2HB      HIS  79 -17.459   8.465   2.257
  661    HB3  HIS  79           3HB      HIS  79 -18.344  10.000   2.320
  662    HD1  HIS  79           1HD      HIS  79 -16.872   7.406   4.453
  663    HD2  HIS  79           2HD      HIS  79 -19.812  10.351   4.815
  664    HE1  HIS  79           1HE      HIS  79 -17.223   7.755   6.939
  665    HE2  HIS  79           2HE      HIS  79 -19.008   9.547   7.154
  666    H    HIS  80           HN       HIS  80 -18.028   8.519   0.003
  667    HA   HIS  80           HA       HIS  80 -18.008   9.626  -1.981
  668    HB2  HIS  80           2HB      HIS  80 -19.663   7.816  -2.455
  669    HB3  HIS  80           3HB      HIS  80 -20.963   8.954  -2.059
  670    HD1  HIS  80           1HD      HIS  80 -21.899  10.185  -3.997
  671    HD2  HIS  80           2HD      HIS  80 -17.983   8.906  -4.685
  672    HE1  HIS  80           1HE      HIS  80 -21.343  10.848  -6.378
  673    HE2  HIS  80           2HE      HIS  80 -18.964  10.068  -6.790
  674    H    HIS  81           HN       HIS  81 -17.556  11.586  -0.830
  675    HA   HIS  81           HA       HIS  81 -17.811  13.807  -0.403
  676    HB2  HIS  81           2HB      HIS  81 -18.562  13.691  -2.851
  677    HB3  HIS  81           3HB      HIS  81 -20.221  13.788  -2.231
  678    HD1  HIS  81           1HD      HIS  81 -21.048  16.060  -1.368
  679    HD2  HIS  81           2HD      HIS  81 -17.040  16.058  -2.539
  680    HE1  HIS  81           1HE      HIS  81 -20.334  18.490  -1.448
  681    HE2  HIS  81           2HE      HIS  81 -17.896  18.483  -2.159
  Start of MODEL   11
    1    H1   MET   1           HN       MET   1  -2.013   7.014  13.078
    2    HA   MET   1           HA       MET   1  -1.107   7.736  10.484
    3    HB2  MET   1           2HB      MET   1   1.136   7.867  11.341
    4    HB3  MET   1           3HB      MET   1   0.963   6.308  12.182
    5    HG2  MET   1           2HG      MET   1   0.798   5.155  10.030
    6    HG3  MET   1           3HG      MET   1   0.931   6.702   9.177
    7    HE1  MET   1           3HE      MET   1   2.863   5.586   7.729
    8    HE2  MET   1           1HE      MET   1   4.323   4.849   8.431
    9    HE3  MET   1           2HE      MET   1   2.735   4.087   8.680
   10    H    PHE   2           HN       PHE   2  -1.719   6.223   9.025
   11    HA   PHE   2           HA       PHE   2  -2.415   3.528  10.098
   12    HB2  PHE   2           2HB      PHE   2  -4.379   4.886   9.385
   13    HB3  PHE   2           3HB      PHE   2  -3.678   5.002   7.762
   14    HD1  PHE   2           1HD      PHE   2  -5.125   2.679  10.247
   15    HD2  PHE   2           2HD      PHE   2  -3.845   3.190   6.219
   16    HE1  PHE   2           1HE      PHE   2  -6.212   0.565   9.634
   17    HE2  PHE   2           2HE      PHE   2  -4.930   1.077   5.601
   18    HZ   PHE   2           HZ       PHE   2  -6.107  -0.249   7.313
   19    H    SER   3           HN       SER   3  -0.929   2.104   9.484
   20    HA   SER   3           HA       SER   3   0.746   2.706   7.156
   21    HB2  SER   3           2HB      SER   3   1.962   0.619   7.949
   22    HB3  SER   3           3HB      SER   3   1.925   1.981   9.094
   23    HG   SER   3           HG       SER   3   1.418  -0.031  10.088
   24    H    LEU   4           HN       LEU   4   1.070   1.334   5.397
   25    HA   LEU   4           HA       LEU   4  -1.293   0.135   4.341
   26    HB2  LEU   4           2HB      LEU   4   0.488   1.115   2.968
   27    HB3  LEU   4           3HB      LEU   4   1.612  -0.154   3.511
   28    HG   LEU   4           HG       LEU   4   0.248  -1.849   2.387
   29   HD11  LEU   4          1HD1      LEU   4  -1.577  -1.182   0.877
   30   HD12  LEU   4          2HD1      LEU   4  -1.934  -0.743   2.562
   31   HD13  LEU   4          3HD1      LEU   4  -1.400   0.505   1.411
   32   HD21  LEU   4          3HD2      LEU   4   2.098  -0.780   1.182
   33   HD22  LEU   4          1HD2      LEU   4   0.775  -1.205   0.071
   34   HD23  LEU   4          2HD2      LEU   4   0.991   0.483   0.592
   35    H    ARG   5           HN       ARG   5   1.281  -1.072   6.342
   36    HA   ARG   5           HA       ARG   5   0.992  -3.859   5.686
   37    HB2  ARG   5           2HB      ARG   5   2.959  -2.634   6.758
   38    HB3  ARG   5           3HB      ARG   5   2.019  -2.658   8.269
   39    HG2  ARG   5           2HG      ARG   5   2.535  -5.217   6.807
   40    HG3  ARG   5           3HG      ARG   5   3.829  -4.480   7.781
   41    HD2  ARG   5           2HD      ARG   5   1.065  -5.264   8.753
   42    HD3  ARG   5           3HD      ARG   5   2.584  -6.123   9.089
   43    HE   ARG   5           HE       ARG   5   3.311  -4.049  10.305
   44   HH11  ARG   5          2HH1      ARG   5  -0.109  -4.714   9.782
   45   HH12  ARG   5          1HH1      ARG   5  -0.634  -3.793  11.171
   46   HH21  ARG   5          2HH2      ARG   5   2.599  -2.845  12.132
   47   HH22  ARG   5          1HH2      ARG   5   0.893  -2.737  12.497
   48    H    ASP   6           HN       ASP   6  -0.909  -1.648   7.584
   49    HA   ASP   6           HA       ASP   6  -2.016  -3.812   9.242
   50    HB2  ASP   6           2HB      ASP   6  -1.623  -1.523  10.169
   51    HB3  ASP   6           3HB      ASP   6  -2.875  -0.906   9.069
   52    HD2  ASP   6           2HD      ASP   6  -4.073  -3.198  12.114
   53    H    ALA   7           HN       ALA   7  -2.551  -2.417   6.188
   54    HA   ALA   7           HA       ALA   7  -5.398  -2.838   6.046
   55    HB1  ALA   7           1HB      ALA   7  -5.080  -2.570   3.620
   56    HB2  ALA   7           2HB      ALA   7  -4.222  -1.304   4.529
   57    HB3  ALA   7           3HB      ALA   7  -3.317  -2.674   3.839
   58    H    LYS   8           HN       LYS   8  -6.552  -4.561   5.187
   59    HA   LYS   8           HA       LYS   8  -5.016  -7.090   5.241
   60    HB2  LYS   8           2HB      LYS   8  -7.955  -6.476   5.626
   61    HB3  LYS   8           3HB      LYS   8  -7.310  -8.127   5.473
   62    HG2  LYS   8           2HG      LYS   8  -6.552  -6.111   7.608
   63    HG3  LYS   8           3HG      LYS   8  -7.639  -7.505   7.820
   64    HD2  LYS   8           2HD      LYS   8  -5.798  -9.022   7.217
   65    HD3  LYS   8           3HD      LYS   8  -4.714  -7.624   7.029
   66    HE2  LYS   8           2HE      LYS   8  -5.025  -7.065   9.403
   67    HE3  LYS   8           3HE      LYS   8  -6.112  -8.458   9.591
   68    HZ1  LYS   8           3HZ      LYS   8  -3.272  -8.594   8.822
   69    HZ2  LYS   8           1HZ      LYS   8  -3.885  -8.968  10.307
   70    HZ3  LYS   8           2HZ      LYS   8  -4.281  -9.887   8.998
   71    H    CYS   9           HN       CYS   9  -5.546  -8.780   3.770
   72    HA   CYS   9           HA       CYS   9  -5.574  -7.875   1.060
   73    HB2  CYS   9           2HB      CYS   9  -5.864 -10.410   0.667
   74    HB3  CYS   9           3HB      CYS   9  -4.376  -9.819   1.446
   75    HG   CYS   9           HG       CYS   9  -5.070 -12.117   2.481
   76    H    GLY  10           HN       GLY  10  -7.192  -7.457  -0.285
   77    HA2  GLY  10           1HA      GLY  10  -9.347  -8.109  -1.208
   78    HA3  GLY  10           2HA      GLY  10  -9.874  -8.536   0.436
   79    H    GLN  11           HN       GLN  11  -8.103  -5.835   0.880
   80    HA   GLN  11           HA       GLN  11 -10.501  -4.092   0.616
   81    HB2  GLN  11           2HB      GLN  11  -8.021  -3.733   2.332
   82    HB3  GLN  11           3HB      GLN  11  -9.457  -2.681   2.316
   83    HG2  GLN  11           2HG      GLN  11 -10.821  -4.586   3.113
   84    HG3  GLN  11           3HG      GLN  11  -9.348  -5.577   3.197
   85   HE21  GLN  11          1HE2      GLN  11 -11.178  -2.961   4.643
   86   HE22  GLN  11          2HE2      GLN  11 -10.237  -2.847   6.116
   87    H    THR  12           HN       THR  12 -10.008  -1.760   0.146
   88    HA   THR  12           HA       THR  12  -7.661  -1.533  -1.669
   89    HB   THR  12           HB       THR  12 -10.391  -0.261  -2.101
   90    HG1  THR  12           1HG      THR  12 -10.490  -1.798  -3.827
   91   HG21  THR  12          3HG2      THR  12  -7.917  -0.402  -3.863
   92   HG22  THR  12          1HG2      THR  12  -9.477   0.323  -4.319
   93   HG23  THR  12          2HG2      THR  12  -8.511   1.044  -3.012
   94    H    VAL  13           HN       VAL  13  -6.293   0.003  -1.094
   95    HA   VAL  13           HA       VAL  13  -7.323   2.153   0.688
   96    HB   VAL  13           HB       VAL  13  -5.049   2.315   1.612
   97   HG11  VAL  13          1HG1      VAL  13  -5.009   0.194   2.854
   98   HG12  VAL  13          2HG1      VAL  13  -6.663   0.831   2.701
   99   HG13  VAL  13          3HG1      VAL  13  -6.129  -0.518   1.670
  100   HG21  VAL  13          3HG2      VAL  13  -3.803   1.592  -0.369
  101   HG22  VAL  13          1HG2      VAL  13  -3.337   0.639   1.058
  102   HG23  VAL  13          2HG2      VAL  13  -4.422  -0.063  -0.164
  103    H    LYS  14           HN       LYS  14  -5.826   4.123   0.644
  104    HA   LYS  14           HA       LYS  14  -4.862   4.621  -2.132
  105    HB2  LYS  14           2HB      LYS  14  -6.975   5.797  -1.770
  106    HB3  LYS  14           3HB      LYS  14  -6.335   6.516  -0.273
  107    HG2  LYS  14           2HG      LYS  14  -4.468   7.430  -1.884
  108    HG3  LYS  14           3HG      LYS  14  -5.712   7.160  -3.129
  109    HD2  LYS  14           2HD      LYS  14  -5.993   8.846  -0.624
  110    HD3  LYS  14           3HD      LYS  14  -5.831   9.442  -2.293
  111    HE2  LYS  14           2HE      LYS  14  -7.953   8.466  -2.905
  112    HE3  LYS  14           3HE      LYS  14  -8.095   7.679  -1.317
  113    HZ1  LYS  14           3HZ      LYS  14  -8.057  10.585  -1.792
  114    HZ2  LYS  14           1HZ      LYS  14  -9.392   9.687  -1.434
  115    HZ3  LYS  14           2HZ      LYS  14  -8.190   9.854  -0.319
  116    H    VAL  15           HN       VAL  15  -2.807   5.352  -2.238
  117    HA   VAL  15           HA       VAL  15  -1.320   5.747   0.226
  118    HB   VAL  15           HB       VAL  15  -0.468   6.286  -2.643
  119   HG11  VAL  15          1HG1      VAL  15   1.816   6.045  -1.767
  120   HG12  VAL  15          2HG1      VAL  15   0.947   7.373  -0.966
  121   HG13  VAL  15          3HG1      VAL  15   1.162   5.818  -0.129
  122   HG21  VAL  15          3HG2      VAL  15  -1.206   3.974  -2.364
  123   HG22  VAL  15          1HG2      VAL  15   0.557   4.059  -2.583
  124   HG23  VAL  15          2HG2      VAL  15  -0.124   3.791  -0.962
  125    H    VAL  16           HN       VAL  16  -1.414   7.597   1.353
  126    HA   VAL  16           HA       VAL  16  -1.986  10.065  -0.190
  127    HB   VAL  16           HB       VAL  16  -2.674  11.016   2.064
  128   HG11  VAL  16          1HG1      VAL  16  -4.901   9.974   1.991
  129   HG12  VAL  16          2HG1      VAL  16  -4.290  10.321   0.357
  130   HG13  VAL  16          3HG1      VAL  16  -4.249   8.657   0.989
  131   HG21  VAL  16          3HG2      VAL  16  -1.574   9.360   3.498
  132   HG22  VAL  16          1HG2      VAL  16  -3.322   9.419   3.820
  133   HG23  VAL  16          2HG2      VAL  16  -2.642   8.088   2.857
  134    H    LYS  17           HN       LYS  17   0.101   8.625   2.270
  135    HA   LYS  17           HA       LYS  17   1.991  10.868   1.871
  136    HB2  LYS  17           2HB      LYS  17   0.485  11.367   3.810
  137    HB3  LYS  17           3HB      LYS  17   1.083   9.883   4.589
  138    HG2  LYS  17           2HG      LYS  17   3.321  10.803   4.705
  139    HG3  LYS  17           3HG      LYS  17   2.796  12.259   3.826
  140    HD2  LYS  17           2HD      LYS  17   1.210  12.778   5.630
  141    HD3  LYS  17           3HD      LYS  17   1.730  11.319   6.508
  142    HE2  LYS  17           2HE      LYS  17   3.983  12.227   6.727
  143    HE3  LYS  17           3HE      LYS  17   3.516  13.662   5.790
  144    HZ1  LYS  17           3HZ      LYS  17   2.368  12.860   8.382
  145    HZ2  LYS  17           1HZ      LYS  17   3.452  14.081   8.147
  146    HZ3  LYS  17           2HZ      LYS  17   1.935  14.193   7.512
  147    H    LEU  18           HN       LEU  18   4.162  10.327   2.450
  148    HA   LEU  18           HA       LEU  18   4.585   7.427   2.964
  149    HB2  LEU  18           2HB      LEU  18   5.939   9.140   0.859
  150    HB3  LEU  18           3HB      LEU  18   6.479   7.514   1.342
  151    HG   LEU  18           HG       LEU  18   3.768   8.150   0.143
  152   HD11  LEU  18          1HD1      LEU  18   4.637   7.120  -1.918
  153   HD12  LEU  18          2HD1      LEU  18   5.567   8.570  -1.475
  154   HD13  LEU  18          3HD1      LEU  18   6.237   6.952  -1.157
  155   HD21  LEU  18          3HD2      LEU  18   3.812   6.148   1.568
  156   HD22  LEU  18          1HD2      LEU  18   3.615   5.707  -0.144
  157   HD23  LEU  18          2HD2      LEU  18   5.198   5.517   0.645
  158    H    HIS  19           HN       HIS  19   5.574   7.318   4.871
  159    HA   HIS  19           HA       HIS  19   7.195   9.561   5.811
  160    HB2  HIS  19           2HB      HIS  19   6.599   6.849   7.042
  161    HB3  HIS  19           3HB      HIS  19   7.495   8.155   7.840
  162    HD1  HIS  19           1HD      HIS  19   6.142   9.580   9.323
  163    HD2  HIS  19           2HD      HIS  19   3.820   7.783   6.354
  164    HE1  HIS  19           1HE      HIS  19   3.741  10.214   9.823
  165    HE2  HIS  19           2HE      HIS  19   2.330   9.120   8.017
  166    H    GLY  20           HN       GLY  20   8.041   6.149   6.252
  167    HA2  GLY  20           1HA      GLY  20   9.982   5.008   5.856
  168    HA3  GLY  20           2HA      GLY  20  10.058   5.909   4.324
  169    H    THR  21           HN       THR  21  12.230   6.174   4.265
  170    HA   THR  21           HA       THR  21  13.389   7.891   6.412
  171    HB   THR  21           HB       THR  21  15.606   6.945   5.550
  172    HG1  THR  21           1HG      THR  21  15.374   4.942   4.414
  173   HG21  THR  21          3HG2      THR  21  13.626   4.991   6.775
  174   HG22  THR  21          1HG2      THR  21  15.398   4.843   6.826
  175   HG23  THR  21          2HG2      THR  21  14.595   6.191   7.664
  176    H    GLY  22           HN       GLY  22  11.916   8.368   3.699
  177    HA2  GLY  22           1HA      GLY  22  12.140  10.134   2.176
  178    HA3  GLY  22           2HA      GLY  22  13.832  10.349   2.681
  179    H    ALA  23           HN       ALA  23  15.190   8.218   2.193
  180    HA   ALA  23           HA       ALA  23  15.298   7.990  -0.645
  181    HB1  ALA  23           1HB      ALA  23  16.988   6.252  -0.230
  182    HB2  ALA  23           2HB      ALA  23  17.249   7.672   0.809
  183    HB3  ALA  23           3HB      ALA  23  16.512   6.200   1.483
  184    H    LEU  24           HN       LEU  24  13.617   6.170   1.834
  185    HA   LEU  24           HA       LEU  24  13.008   3.879   0.218
  186    HB2  LEU  24           2HB      LEU  24  12.850   3.913   2.681
  187    HB3  LEU  24           3HB      LEU  24  11.494   5.061   2.566
  188    HG   LEU  24           HG       LEU  24  10.176   3.344   1.372
  189   HD11  LEU  24          1HD1      LEU  24  10.956   1.010   1.344
  190   HD12  LEU  24          2HD1      LEU  24  12.032   2.069   0.401
  191   HD13  LEU  24          3HD1      LEU  24  12.516   1.525   2.026
  192   HD21  LEU  24          3HD2      LEU  24   9.976   3.619   3.802
  193   HD22  LEU  24          1HD2      LEU  24   9.754   1.918   3.332
  194   HD23  LEU  24          2HD2      LEU  24  11.294   2.448   4.048
  195    H    LYS  25           HN       LYS  25  11.578   7.083   0.631
  196    HA   LYS  25           HA       LYS  25   9.027   6.567  -0.499
  197    HB2  LYS  25           2HB      LYS  25  10.725   9.085  -0.462
  198    HB3  LYS  25           3HB      LYS  25   9.013   9.029  -0.950
  199    HG2  LYS  25           2HG      LYS  25   8.310   8.451   1.240
  200    HG3  LYS  25           3HG      LYS  25   9.979   8.118   1.765
  201    HD2  LYS  25           2HD      LYS  25   9.348  10.228   2.696
  202    HD3  LYS  25           3HD      LYS  25  10.496  10.552   1.376
  203    HE2  LYS  25           2HE      LYS  25   7.495  10.686   0.998
  204    HE3  LYS  25           3HE      LYS  25   8.456  12.080   1.539
  205    HZ1  LYS  25           3HZ      LYS  25   8.830  10.619  -0.990
  206    HZ2  LYS  25           1HZ      LYS  25   8.120  12.098  -0.833
  207    HZ3  LYS  25           2HZ      LYS  25   9.721  11.913  -0.490
  208    H    ARG  26           HN       ARG  26  12.086   7.682  -1.977
  209    HA   ARG  26           HA       ARG  26  11.088   7.967  -4.617
  210    HB2  ARG  26           2HB      ARG  26  13.223   8.897  -3.893
  211    HB3  ARG  26           3HB      ARG  26  13.868   7.261  -3.620
  212    HG2  ARG  26           2HG      ARG  26  14.744   8.143  -5.687
  213    HG3  ARG  26           3HG      ARG  26  13.631   6.799  -6.039
  214    HD2  ARG  26           2HD      ARG  26  11.844   8.443  -6.531
  215    HD3  ARG  26           3HD      ARG  26  13.004   9.760  -6.247
  216    HE   ARG  26           HE       ARG  26  13.853   7.806  -8.240
  217   HH11  ARG  26          2HH1      ARG  26  12.088  10.802  -7.661
  218   HH12  ARG  26          1HH1      ARG  26  12.264  11.366  -9.307
  219   HH21  ARG  26          2HH2      ARG  26  14.077   8.544 -10.369
  220   HH22  ARG  26          1HH2      ARG  26  13.393  10.084 -10.843
  221    H    ARG  27           HN       ARG  27  12.476   5.186  -2.879
  222    HA   ARG  27           HA       ARG  27  12.651   3.436  -5.110
  223    HB2  ARG  27           2HB      ARG  27  13.794   3.059  -2.971
  224    HB3  ARG  27           3HB      ARG  27  12.224   2.819  -2.169
  225    HG2  ARG  27           2HG      ARG  27  11.819   0.828  -3.509
  226    HG3  ARG  27           3HG      ARG  27  13.349   1.082  -4.380
  227    HD2  ARG  27           2HD      ARG  27  14.587   0.842  -2.262
  228    HD3  ARG  27           3HD      ARG  27  13.056   0.571  -1.403
  229    HE   ARG  27           HE       ARG  27  12.859  -1.398  -3.128
  230   HH11  ARG  27          2HH1      ARG  27  15.764  -0.270  -1.478
  231   HH12  ARG  27          1HH1      ARG  27  16.542  -1.836  -1.519
  232   HH21  ARG  27          2HH2      ARG  27  13.880  -3.423  -3.184
  233   HH22  ARG  27          1HH2      ARG  27  15.473  -3.625  -2.486
  234    H    ILE  28           HN       ILE  28  10.041   4.053  -2.755
  235    HA   ILE  28           HA       ILE  28   8.291   2.022  -3.725
  236    HB   ILE  28           HB       ILE  28   7.626   4.645  -2.327
  237   HG12  ILE  28          2HG1      ILE  28   8.016   1.849  -1.211
  238   HG13  ILE  28          3HG1      ILE  28   9.200   3.174  -1.101
  239   HG21  ILE  28          1HG2      ILE  28   5.525   3.529  -1.683
  240   HG22  ILE  28          2HG2      ILE  28   5.674   3.660  -3.451
  241   HG23  ILE  28          3HG2      ILE  28   5.988   2.105  -2.643
  242   HD11  ILE  28          3HD1      ILE  28   6.426   3.162   0.110
  243   HD12  ILE  28          1HD1      ILE  28   7.945   2.924   0.999
  244   HD13  ILE  28          2HD1      ILE  28   7.610   4.485   0.223
  245    H    MET  29           HN       MET  29   8.640   5.499  -4.495
  246    HA   MET  29           HA       MET  29   6.410   5.628  -6.254
  247    HB2  MET  29           2HB      MET  29   8.931   7.300  -6.106
  248    HB3  MET  29           3HB      MET  29   7.548   7.672  -7.164
  249    HG2  MET  29           2HG      MET  29   6.104   7.790  -5.139
  250    HG3  MET  29           3HG      MET  29   7.548   7.560  -4.138
  251    HE1  MET  29           3HE      MET  29   9.710   9.227  -5.865
  252    HE2  MET  29           1HE      MET  29   9.639  10.798  -5.036
  253    HE3  MET  29           2HE      MET  29   9.598   9.294  -4.090
  254    H    ASP  30           HN       ASP  30   9.758   4.640  -6.729
  255    HA   ASP  30           HA       ASP  30   9.856   4.709  -9.549
  256    HB2  ASP  30           2HB      ASP  30  11.861   4.349  -8.301
  257    HB3  ASP  30           3HB      ASP  30  11.189   2.909  -7.506
  258    HD2  ASP  30           2HD      ASP  30  12.736   2.533 -11.128
  259    H    MET  31           HN       MET  31   8.430   2.337  -7.328
  260    HA   MET  31           HA       MET  31   8.055   0.337  -9.400
  261    HB2  MET  31           2HB      MET  31   6.931   0.614  -6.594
  262    HB3  MET  31           3HB      MET  31   6.644  -0.785  -7.656
  263    HG2  MET  31           2HG      MET  31   9.025  -1.276  -7.699
  264    HG3  MET  31           3HG      MET  31   9.364   0.161  -6.720
  265    HE1  MET  31           3HE      MET  31   6.926   0.108  -4.647
  266    HE2  MET  31           1HE      MET  31   7.665  -0.772  -3.290
  267    HE3  MET  31           2HE      MET  31   8.612   0.440  -4.182
  268    H    GLY  32           HN       GLY  32   6.568   3.274  -8.842
  269    HA2  GLY  32           1HA      GLY  32   4.800   3.976 -10.307
  270    HA3  GLY  32           2HA      GLY  32   4.148   2.322 -10.277
  271    H    ILE  33           HN       ILE  33   5.131   3.065  -7.196
  272    HA   ILE  33           HA       ILE  33   2.328   3.674  -6.444
  273    HB   ILE  33           HB       ILE  33   4.619   2.699  -4.693
  274   HG12  ILE  33          2HG1      ILE  33   4.040   1.067  -6.435
  275   HG13  ILE  33          3HG1      ILE  33   3.592   0.502  -4.807
  276   HG21  ILE  33          1HG2      ILE  33   2.840   2.159  -3.079
  277   HG22  ILE  33          2HG2      ILE  33   2.858   3.893  -3.470
  278   HG23  ILE  33          3HG2      ILE  33   1.627   2.831  -4.194
  279   HD11  ILE  33          3HD1      ILE  33   1.708   1.679  -6.863
  280   HD12  ILE  33          1HD1      ILE  33   1.848  -0.043  -6.452
  281   HD13  ILE  33          2HD1      ILE  33   1.261   1.111  -5.236
  282    H    THR  34           HN       THR  34   1.981   5.807  -6.264
  283    HA   THR  34           HA       THR  34   3.861   7.297  -4.531
  284    HB   THR  34           HB       THR  34   4.496   7.876  -6.819
  285    HG1  THR  34           1HG      THR  34   4.134  10.149  -6.654
  286   HG21  THR  34          3HG2      THR  34   1.604   8.721  -7.181
  287   HG22  THR  34          1HG2      THR  34   2.914   8.966  -8.359
  288   HG23  THR  34          2HG2      THR  34   2.389   7.318  -7.945
  289    H    ARG  35           HN       ARG  35   2.779   9.599  -4.144
  290    HA   ARG  35           HA       ARG  35   0.435   8.963  -2.613
  291    HB2  ARG  35           2HB      ARG  35   1.610  11.679  -3.298
  292    HB3  ARG  35           3HB      ARG  35   0.498  11.303  -1.960
  293    HG2  ARG  35           2HG      ARG  35   2.167   9.993  -0.846
  294    HG3  ARG  35           3HG      ARG  35   3.259  10.095  -2.249
  295    HD2  ARG  35           2HD      ARG  35   4.032  11.634  -0.575
  296    HD3  ARG  35           3HD      ARG  35   3.350  12.568  -1.923
  297    HE   ARG  35           HE       ARG  35   1.351  12.107   0.064
  298   HH11  ARG  35          2HH1      ARG  35   4.253  14.004  -0.575
  299   HH12  ARG  35          1HH1      ARG  35   3.780  15.315   0.482
  300   HH21  ARG  35          2HH2      ARG  35   0.749  13.816   1.449
  301   HH22  ARG  35          1HH2      ARG  35   1.793  15.209   1.629
  302    H    GLY  36           HN       GLY  36  -1.576   8.804  -3.333
  303    HA2  GLY  36           1HA      GLY  36  -3.419  10.084  -4.384
  304    HA3  GLY  36           2HA      GLY  36  -2.303  10.429  -5.725
  305    H    CYS  37           HN       CYS  37  -1.396   7.441  -5.041
  306    HA   CYS  37           HA       CYS  37  -3.170   6.306  -7.099
  307    HB2  CYS  37           2HB      CYS  37  -0.702   5.183  -5.737
  308    HB3  CYS  37           3HB      CYS  37  -1.566   4.444  -7.108
  309    HG   CYS  37           HG       CYS  37   0.715   5.428  -7.921
  310    H    GLU  38           HN       GLU  38  -4.386   4.436  -6.857
  311    HA   GLU  38           HA       GLU  38  -5.071   3.779  -4.054
  312    HB2  GLU  38           2HB      GLU  38  -7.007   2.593  -5.070
  313    HB3  GLU  38           3HB      GLU  38  -6.956   4.332  -5.443
  314    HG2  GLU  38           2HG      GLU  38  -6.089   3.856  -7.665
  315    HG3  GLU  38           3HG      GLU  38  -6.050   2.118  -7.297
  316    HE2  GLU  38           2HE      GLU  38  -9.342   1.774  -8.211
  317    H    ILE  39           HN       ILE  39  -4.979   1.697  -3.231
  318    HA   ILE  39           HA       ILE  39  -3.473  -0.240  -4.909
  319    HB   ILE  39           HB       ILE  39  -3.029   0.428  -1.975
  320   HG12  ILE  39          2HG1      ILE  39  -1.262   0.598  -4.434
  321   HG13  ILE  39          3HG1      ILE  39  -1.912   1.955  -3.481
  322   HG21  ILE  39          1HG2      ILE  39  -1.350  -1.370  -1.970
  323   HG22  ILE  39          2HG2      ILE  39  -2.978  -2.002  -2.306
  324   HG23  ILE  39          3HG2      ILE  39  -1.810  -1.802  -3.634
  325   HD11  ILE  39          3HD1      ILE  39   0.080  -0.110  -2.507
  326   HD12  ILE  39          1HD1      ILE  39   0.462   1.563  -2.967
  327   HD13  ILE  39          2HD1      ILE  39  -0.570   1.248  -1.556
  328    H    TYR  40           HN       TYR  40  -4.611  -1.999  -5.239
  329    HA   TYR  40           HA       TYR  40  -6.583  -2.879  -3.216
  330    HB2  TYR  40           2HB      TYR  40  -7.308  -2.805  -5.552
  331    HB3  TYR  40           3HB      TYR  40  -5.960  -3.854  -6.026
  332    HD1  TYR  40           2HD      TYR  40  -8.921  -3.845  -3.708
  333    HD2  TYR  40           1HD      TYR  40  -6.351  -6.132  -6.225
  334    HE1  TYR  40           2HE      TYR  40 -10.321  -5.827  -3.337
  335    HE2  TYR  40           1HE      TYR  40  -7.751  -8.113  -5.852
  336    HH   TYR  40           HH       TYR  40 -10.641  -8.037  -3.780
  337    H    ILE  41           HN       ILE  41  -5.728  -4.045  -1.595
  338    HA   ILE  41           HA       ILE  41  -3.206  -5.430  -1.966
  339    HB   ILE  41           HB       ILE  41  -5.057  -5.539   0.449
  340   HG12  ILE  41          2HG1      ILE  41  -3.208  -3.893   1.328
  341   HG13  ILE  41          3HG1      ILE  41  -2.977  -3.541  -0.402
  342   HG21  ILE  41          1HG2      ILE  41  -3.004  -6.168   1.668
  343   HG22  ILE  41          2HG2      ILE  41  -3.360  -7.323   0.362
  344   HG23  ILE  41          3HG2      ILE  41  -2.083  -6.103   0.147
  345   HD11  ILE  41          3HD1      ILE  41  -5.562  -3.234   1.146
  346   HD12  ILE  41          1HD1      ILE  41  -4.493  -1.908   0.645
  347   HD13  ILE  41          2HD1      ILE  41  -5.330  -2.880  -0.582
  348    H    ARG  42           HN       ARG  42  -2.881  -7.475  -2.493
  349    HA   ARG  42           HA       ARG  42  -5.241  -9.097  -3.139
  350    HB2  ARG  42           2HB      ARG  42  -2.284  -9.567  -3.636
  351    HB3  ARG  42           3HB      ARG  42  -3.624 -10.533  -4.299
  352    HG2  ARG  42           2HG      ARG  42  -3.280  -7.572  -4.814
  353    HG3  ARG  42           3HG      ARG  42  -2.615  -8.840  -5.871
  354    HD2  ARG  42           2HD      ARG  42  -5.544  -8.699  -5.126
  355    HD3  ARG  42           3HD      ARG  42  -4.871  -7.852  -6.537
  356    HE   ARG  42           HE       ARG  42  -4.054 -10.189  -7.221
  357   HH11  ARG  42          2HH1      ARG  42  -6.917  -9.711  -5.226
  358   HH12  ARG  42          1HH1      ARG  42  -7.751 -11.105  -5.872
  359   HH21  ARG  42          2HH2      ARG  42  -5.180 -11.960  -8.107
  360   HH22  ARG  42          1HH2      ARG  42  -6.768 -12.378  -7.503
  361    H    LYS  43           HN       LYS  43  -2.129  -9.621  -1.407
  362    HA   LYS  43           HA       LYS  43  -3.553 -11.247   0.580
  363    HB2  LYS  43           2HB      LYS  43  -3.066 -12.925  -1.057
  364    HB3  LYS  43           3HB      LYS  43  -1.405 -12.318  -1.269
  365    HG2  LYS  43           2HG      LYS  43  -0.905 -12.987   1.060
  366    HG3  LYS  43           3HG      LYS  43  -2.541 -13.677   1.185
  367    HD2  LYS  43           2HD      LYS  43  -0.554 -14.488  -0.946
  368    HD3  LYS  43           3HD      LYS  43  -0.687 -15.308   0.628
  369    HE2  LYS  43           2HE      LYS  43  -2.997 -15.893   0.175
  370    HE3  LYS  43           3HE      LYS  43  -2.969 -14.967  -1.340
  371    HZ1  LYS  43           3HZ      LYS  43  -1.336 -17.344  -0.755
  372    HZ2  LYS  43           1HZ      LYS  43  -2.669 -17.308  -1.725
  373    HZ3  LYS  43           2HZ      LYS  43  -1.310 -16.484  -2.163
  374    H    VAL  44           HN       VAL  44  -2.629 -11.111   2.553
  375    HA   VAL  44           HA       VAL  44   0.075  -9.860   2.692
  376    HB   VAL  44           HB       VAL  44  -2.129  -9.720   4.789
  377   HG11  VAL  44          1HG1      VAL  44  -0.709  -8.002   5.827
  378   HG12  VAL  44          2HG1      VAL  44   0.142  -9.559   5.694
  379   HG13  VAL  44          3HG1      VAL  44   0.510  -8.242   4.554
  380   HG21  VAL  44          3HG2      VAL  44  -2.782  -8.477   2.783
  381   HG22  VAL  44          1HG2      VAL  44  -2.415  -7.370   4.126
  382   HG23  VAL  44          2HG2      VAL  44  -1.234  -7.599   2.816
  383    H    ALA  45           HN       ALA  45   1.605 -10.875   3.950
  384    HA   ALA  45           HA       ALA  45   0.985 -13.617   4.724
  385    HB1  ALA  45           1HB      ALA  45   3.386 -13.755   5.249
  386    HB2  ALA  45           2HB      ALA  45   3.114 -13.069   3.630
  387    HB3  ALA  45           3HB      ALA  45   3.544 -12.002   4.989
  388    HA   PRO  46           HA       PRO  46  -0.087 -12.942   8.919
  389    HB2  PRO  46           2HB      PRO  46   1.539 -15.385   9.589
  390    HB3  PRO  46           3HB      PRO  46  -0.207 -15.045   9.820
  391    HG2  PRO  46           2HG      PRO  46   0.675 -16.708   7.936
  392    HG3  PRO  46           3HG      PRO  46  -0.796 -15.706   7.713
  393    HD2  PRO  46           2HD      PRO  46   1.986 -15.394   6.599
  394    HD3  PRO  46           3HD      PRO  46   0.406 -14.994   5.861
  395    H    LEU  47           HN       LEU  47   3.258 -13.299   7.976
  396    HA   LEU  47           HA       LEU  47   4.120 -12.164  10.583
  397    HB2  LEU  47           2HB      LEU  47   6.408 -12.794   9.818
  398    HB3  LEU  47           3HB      LEU  47   5.295 -14.163  10.046
  399    HG   LEU  47           HG       LEU  47   4.929 -13.921   7.465
  400   HD11  LEU  47          1HD1      LEU  47   6.948 -13.187   6.263
  401   HD12  LEU  47          2HD1      LEU  47   6.223 -11.857   7.195
  402   HD13  LEU  47          3HD1      LEU  47   7.678 -12.682   7.805
  403   HD21  LEU  47          3HD2      LEU  47   5.886 -15.868   8.607
  404   HD22  LEU  47          1HD2      LEU  47   6.753 -15.529   7.091
  405   HD23  LEU  47          2HD2      LEU  47   7.476 -15.069   8.649
  406    H    GLY  48           HN       GLY  48   3.103 -11.116   7.647
  407    HA2  GLY  48           1HA      GLY  48   3.288  -8.611   7.523
  408    HA3  GLY  48           2HA      GLY  48   5.045  -8.858   7.646
  409    H    ASP  49           HN       ASP  49   6.191  -9.741   5.891
  410    HA   ASP  49           HA       ASP  49   4.726  -9.331   3.333
  411    HB2  ASP  49           2HB      ASP  49   6.813  -8.672   2.359
  412    HB3  ASP  49           3HB      ASP  49   6.618  -7.777   3.882
  413    HD2  ASP  49           2HD      ASP  49   9.719 -10.132   3.464
  414    HA   PRO  50           HA       PRO  50   6.192  -9.485   1.228
  415    HB2  PRO  50           2HB      PRO  50   5.395 -10.700  -1.090
  416    HB3  PRO  50           3HB      PRO  50   7.044 -10.896  -0.411
  417    HG2  PRO  50           2HG      PRO  50   4.703 -12.728  -0.174
  418    HG3  PRO  50           3HG      PRO  50   6.398 -13.129  -0.603
  419    HD2  PRO  50           2HD      PRO  50   5.337 -13.449   1.909
  420    HD3  PRO  50           3HD      PRO  50   7.057 -13.042   1.628
  421    H    ILE  51           HN       ILE  51   4.670  -8.009   0.873
  422    HA   ILE  51           HA       ILE  51   1.852  -8.824   1.190
  423    HB   ILE  51           HB       ILE  51   3.133  -6.063   1.061
  424   HG12  ILE  51          2HG1      ILE  51   2.009  -7.659   3.383
  425   HG13  ILE  51          3HG1      ILE  51   3.730  -7.325   3.070
  426   HG21  ILE  51          1HG2      ILE  51   0.936  -5.220   1.790
  427   HG22  ILE  51          2HG2      ILE  51   0.825  -6.045   0.218
  428   HG23  ILE  51          3HG2      ILE  51   0.273  -6.869   1.696
  429   HD11  ILE  51          3HD1      ILE  51   1.602  -5.263   3.693
  430   HD12  ILE  51          1HD1      ILE  51   2.841  -5.848   4.823
  431   HD13  ILE  51          2HD1      ILE  51   3.324  -4.931   3.381
  432    H    GLN  52           HN       GLN  52   0.822  -9.400  -0.587
  433    HA   GLN  52           HA       GLN  52   1.730  -8.547  -3.212
  434    HB2  GLN  52           2HB      GLN  52  -0.262 -10.447  -2.093
  435    HB3  GLN  52           3HB      GLN  52  -0.645  -9.755  -3.688
  436    HG2  GLN  52           2HG      GLN  52   1.937 -11.172  -2.990
  437    HG3  GLN  52           3HG      GLN  52   0.544 -11.929  -3.794
  438   HE21  GLN  52          1HE2      GLN  52   3.307 -11.572  -4.758
  439   HE22  GLN  52          2HE2      GLN  52   3.179 -10.663  -6.249
  440    H    ILE  53           HN       ILE  53   1.279  -6.595  -3.972
  441    HA   ILE  53           HA       ILE  53  -1.496  -5.610  -3.556
  442    HB   ILE  53           HB       ILE  53  -0.601  -3.295  -3.780
  443   HG12  ILE  53          2HG1      ILE  53   2.111  -4.617  -3.477
  444   HG13  ILE  53          3HG1      ILE  53   1.482  -3.895  -4.977
  445   HG21  ILE  53          1HG2      ILE  53   0.325  -3.153  -1.503
  446   HG22  ILE  53          2HG2      ILE  53  -1.062  -4.264  -1.572
  447   HG23  ILE  53          3HG2      ILE  53   0.594  -4.911  -1.504
  448   HD11  ILE  53          3HD1      ILE  53   2.008  -2.425  -2.381
  449   HD12  ILE  53          1HD1      ILE  53   3.029  -2.361  -3.832
  450   HD13  ILE  53          2HD1      ILE  53   1.381  -1.704  -3.883
  451    H    ASN  54           HN       ASN  54  -2.617  -4.994  -5.367
  452    HA   ASN  54           HA       ASN  54  -1.140  -5.383  -7.925
  453    HB2  ASN  54           2HB      ASN  54  -3.115  -6.898  -7.345
  454    HB3  ASN  54           3HB      ASN  54  -4.143  -5.463  -7.547
  455   HD21  ASN  54          1HD2      ASN  54  -2.072  -7.813  -9.136
  456   HD22  ASN  54          2HD2      ASN  54  -2.547  -7.425 -10.776
  457    H    VAL  55           HN       VAL  55  -0.536  -3.519  -8.781
  458    HA   VAL  55           HA       VAL  55  -2.527  -1.325  -8.862
  459    HB   VAL  55           HB       VAL  55   0.406  -0.947  -8.142
  460   HG11  VAL  55          1HG1      VAL  55  -0.197   1.417  -7.817
  461   HG12  VAL  55          2HG1      VAL  55  -0.498   0.892  -9.490
  462   HG13  VAL  55          3HG1      VAL  55  -1.856   1.065  -8.352
  463   HG21  VAL  55          3HG2      VAL  55  -0.874  -1.897  -6.280
  464   HG22  VAL  55          1HG2      VAL  55  -0.418  -0.210  -5.945
  465   HG23  VAL  55          2HG2      VAL  55  -2.081  -0.598  -6.439
  466    H    ARG  56           HN       ARG  56  -2.662  -0.329 -10.777
  467    HA   ARG  56           HA       ARG  56  -2.304   0.186 -12.969
  468    HB2  ARG  56           2HB      ARG  56   0.608  -0.401 -12.340
  469    HB3  ARG  56           3HB      ARG  56   0.001   0.412 -13.802
  470    HG2  ARG  56           2HG      ARG  56  -0.233   1.446 -10.964
  471    HG3  ARG  56           3HG      ARG  56   0.927   2.006 -12.192
  472    HD2  ARG  56           2HD      ARG  56  -0.759   3.610 -12.298
  473    HD3  ARG  56           3HD      ARG  56  -1.175   2.506 -13.627
  474    HE   ARG  56           HE       ARG  56  -2.572   1.574 -11.405
  475   HH11  ARG  56          2HH1      ARG  56  -2.439   4.509 -13.353
  476   HH12  ARG  56          1HH1      ARG  56  -4.093   4.960 -13.014
  477   HH21  ARG  56          2HH2      ARG  56  -4.727   2.194 -10.949
  478   HH22  ARG  56          1HH2      ARG  56  -5.388   3.651 -11.655
  479    H    GLY  57           HN       GLY  57  -2.569  -2.703 -11.921
  480    HA2  GLY  57           1HA      GLY  57  -3.127  -4.571 -13.241
  481    HA3  GLY  57           2HA      GLY  57  -2.140  -3.923 -14.570
  482    H    TYR  58           HN       TYR  58  -0.082  -3.429 -12.221
  483    HA   TYR  58           HA       TYR  58   1.311  -5.959 -12.724
  484    HB2  TYR  58           2HB      TYR  58   2.133  -3.431 -11.256
  485    HB3  TYR  58           3HB      TYR  58   3.178  -4.841 -11.490
  486    HD1  TYR  58           1HD      TYR  58   3.678  -5.541 -13.922
  487    HD2  TYR  58           2HD      TYR  58   2.067  -1.740 -12.878
  488    HE1  TYR  58           1HE      TYR  58   4.470  -4.620 -16.056
  489    HE2  TYR  58           2HE      TYR  58   2.840  -0.822 -15.018
  490    HH   TYR  58           HH       TYR  58   3.933  -1.218 -16.968
  491    H    GLU  59           HN       GLU  59   1.632  -7.560 -11.285
  492    HA   GLU  59           HA       GLU  59   0.492  -7.233  -8.594
  493    HB2  GLU  59           2HB      GLU  59   1.004  -9.622  -8.313
  494    HB3  GLU  59           3HB      GLU  59  -0.029  -9.298  -9.727
  495    HG2  GLU  59           2HG      GLU  59   2.951  -9.770  -9.885
  496    HG3  GLU  59           3HG      GLU  59   1.731 -11.051 -10.048
  497    HE2  GLU  59           2HE      GLU  59   2.459  -8.713 -13.122
  498    H    LEU  60           HN       LEU  60   1.684  -6.385  -7.056
  499    HA   LEU  60           HA       LEU  60   4.637  -6.519  -7.388
  500    HB2  LEU  60           2HB      LEU  60   2.916  -4.485  -5.940
  501    HB3  LEU  60           3HB      LEU  60   4.693  -4.455  -6.049
  502    HG   LEU  60           HG       LEU  60   2.791  -4.228  -8.398
  503   HD11  LEU  60          1HD1      LEU  60   3.461  -1.862  -8.448
  504   HD12  LEU  60          2HD1      LEU  60   2.658  -2.278  -6.917
  505   HD13  LEU  60          3HD1      LEU  60   4.428  -2.105  -6.975
  506   HD21  LEU  60          3HD2      LEU  60   4.964  -5.212  -8.978
  507   HD22  LEU  60          1HD2      LEU  60   4.805  -3.574  -9.653
  508   HD23  LEU  60          2HD2      LEU  60   5.796  -3.843  -8.201
  509    H    SER  61           HN       SER  61   5.787  -7.607  -5.952
  510    HA   SER  61           HA       SER  61   4.529  -8.373  -3.390
  511    HB2  SER  61           2HB      SER  61   7.244  -9.128  -4.538
  512    HB3  SER  61           3HB      SER  61   6.432  -9.866  -3.136
  513    HG   SER  61           HG       SER  61   6.163 -11.087  -5.064
  514    H    LEU  62           HN       LEU  62   4.635  -6.818  -1.871
  515    HA   LEU  62           HA       LEU  62   7.059  -5.095  -1.837
  516    HB2  LEU  62           2HB      LEU  62   4.881  -3.984  -2.169
  517    HB3  LEU  62           3HB      LEU  62   4.311  -4.665  -0.627
  518    HG   LEU  62           HG       LEU  62   6.133  -3.384   0.520
  519   HD11  LEU  62          1HD1      LEU  62   7.177  -1.510  -0.683
  520   HD12  LEU  62          2HD1      LEU  62   7.617  -3.074  -1.405
  521   HD13  LEU  62          3HD1      LEU  62   6.395  -2.045  -2.189
  522   HD21  LEU  62          3HD2      LEU  62   3.812  -2.595   0.461
  523   HD22  LEU  62          1HD2      LEU  62   4.951  -1.230   0.407
  524   HD23  LEU  62          2HD2      LEU  62   4.129  -1.760  -1.079
  525    H    ARG  63           HN       ARG  63   8.387  -5.070  -0.140
  526    HA   ARG  63           HA       ARG  63   8.032  -6.996   1.994
  527    HB2  ARG  63           2HB      ARG  63  10.080  -4.911   1.287
  528    HB3  ARG  63           3HB      ARG  63  10.075  -5.625   2.917
  529    HG2  ARG  63           2HG      ARG  63  11.652  -6.793   1.502
  530    HG3  ARG  63           3HG      ARG  63  10.296  -7.868   1.918
  531    HD2  ARG  63           2HD      ARG  63   9.276  -7.402  -0.284
  532    HD3  ARG  63           3HD      ARG  63  10.666  -6.377  -0.698
  533    HE   ARG  63           HE       ARG  63  11.843  -8.741  -0.028
  534   HH11  ARG  63          2HH1      ARG  63   9.301  -7.830  -2.300
  535   HH12  ARG  63          1HH1      ARG  63   9.607  -9.177  -3.371
  536   HH21  ARG  63          2HH2      ARG  63  12.202 -10.511  -1.400
  537   HH22  ARG  63          1HH2      ARG  63  11.254 -10.698  -2.859
  538    H    LYS  64           HN       LYS  64   7.571  -6.609   4.182
  539    HA   LYS  64           HA       LYS  64   5.658  -4.510   4.537
  540    HB2  LYS  64           2HB      LYS  64   5.316  -5.332   6.729
  541    HB3  LYS  64           3HB      LYS  64   5.599  -6.743   5.681
  542    HG2  LYS  64           2HG      LYS  64   7.787  -7.060   6.553
  543    HG3  LYS  64           3HG      LYS  64   7.751  -5.492   7.396
  544    HD2  LYS  64           2HD      LYS  64   5.848  -6.331   8.773
  545    HD3  LYS  64           3HD      LYS  64   6.028  -7.920   7.990
  546    HE2  LYS  64           2HE      LYS  64   7.131  -7.852  10.186
  547    HE3  LYS  64           3HE      LYS  64   8.294  -8.124   8.870
  548    HZ1  LYS  64           3HZ      LYS  64   7.786  -5.548  10.202
  549    HZ2  LYS  64           1HZ      LYS  64   9.099  -6.513  10.448
  550    HZ3  LYS  64           2HZ      LYS  64   8.865  -5.801   8.981
  551    H    SER  65           HN       SER  65   9.101  -4.752   5.143
  552    HA   SER  65           HA       SER  65   9.473  -2.742   7.052
  553    HB2  SER  65           2HB      SER  65  11.162  -3.241   4.570
  554    HB3  SER  65           3HB      SER  65  11.689  -2.445   6.073
  555    HG   SER  65           HG       SER  65  12.289  -4.665   5.984
  556    H    ALA  66           HN       ALA  66   8.818  -2.472   3.562
  557    HA   ALA  66           HA       ALA  66   8.917   0.428   3.603
  558    HB1  ALA  66           1HB      ALA  66   8.016   0.251   1.319
  559    HB2  ALA  66           2HB      ALA  66   9.397  -0.842   1.559
  560    HB3  ALA  66           3HB      ALA  66   7.738  -1.489   1.565
  561    H    ALA  67           HN       ALA  67   6.334  -2.053   3.551
  562    HA   ALA  67           HA       ALA  67   4.191  -0.229   3.213
  563    HB1  ALA  67           1HB      ALA  67   2.743  -2.119   3.842
  564    HB2  ALA  67           2HB      ALA  67   4.022  -2.624   2.716
  565    HB3  ALA  67           3HB      ALA  67   4.161  -3.000   4.450
  566    H    GLU  68           HN       GLU  68   5.892  -1.237   6.132
  567    HA   GLU  68           HA       GLU  68   3.771  -0.355   7.907
  568    HB2  GLU  68           2HB      GLU  68   6.696  -0.946   8.469
  569    HB3  GLU  68           3HB      GLU  68   5.426  -0.708   9.693
  570    HG2  GLU  68           2HG      GLU  68   4.214  -2.660   8.705
  571    HG3  GLU  68           3HG      GLU  68   5.622  -2.938   7.657
  572    HE2  GLU  68           2HE      GLU  68   7.461  -4.286  10.288
  573    H    MET  69           HN       MET  69   6.110   1.240   6.043
  574    HA   MET  69           HA       MET  69   6.051   3.611   7.838
  575    HB2  MET  69           2HB      MET  69   7.945   2.689   5.680
  576    HB3  MET  69           3HB      MET  69   7.861   4.405   6.146
  577    HG2  MET  69           2HG      MET  69   9.679   3.282   7.301
  578    HG3  MET  69           3HG      MET  69   8.440   3.821   8.447
  579    HE1  MET  69           3HE      MET  69   9.740   2.218  10.214
  580    HE2  MET  69           1HE      MET  69   9.969   0.473   9.963
  581    HE3  MET  69           2HE      MET  69  10.833   1.638   8.934
  582    H    ILE  70           HN       ILE  70   4.332   2.324   5.372
  583    HA   ILE  70           HA       ILE  70   4.082   4.800   3.798
  584    HB   ILE  70           HB       ILE  70   2.758   2.074   3.508
  585   HG12  ILE  70          2HG1      ILE  70   4.914   3.459   1.883
  586   HG13  ILE  70          3HG1      ILE  70   5.163   2.108   3.015
  587   HG21  ILE  70          1HG2      ILE  70   1.936   2.888   1.335
  588   HG22  ILE  70          2HG2      ILE  70   1.287   3.856   2.679
  589   HG23  ILE  70          3HG2      ILE  70   2.617   4.494   1.681
  590   HD11  ILE  70          3HD1      ILE  70   3.522   2.018   0.471
  591   HD12  ILE  70          1HD1      ILE  70   5.142   1.324   0.683
  592   HD13  ILE  70          2HD1      ILE  70   3.773   0.668   1.603
  593    H    GLU  71           HN       GLU  71   2.451   6.215   3.941
  594    HA   GLU  71           HA       GLU  71   0.398   5.740   6.035
  595    HB2  GLU  71           2HB      GLU  71   1.814   7.790   6.119
  596    HB3  GLU  71           3HB      GLU  71   1.160   8.269   4.533
  597    HG2  GLU  71           2HG      GLU  71  -0.135   9.516   5.955
  598    HG3  GLU  71           3HG      GLU  71  -1.147   8.071   5.742
  599    HE2  GLU  71           2HE      GLU  71   0.658   8.563   9.259
  600    H    VAL  72           HN       VAL  72  -1.409   4.806   5.256
  601    HA   VAL  72           HA       VAL  72  -2.452   5.860   2.679
  602    HB   VAL  72           HB       VAL  72  -3.410   3.600   2.228
  603   HG11  VAL  72          1HG1      VAL  72  -1.316   2.551   1.481
  604   HG12  VAL  72          2HG1      VAL  72  -1.320   4.300   1.157
  605   HG13  VAL  72          3HG1      VAL  72  -0.393   3.650   2.531
  606   HG21  VAL  72          3HG2      VAL  72  -3.427   2.746   4.525
  607   HG22  VAL  72          1HG2      VAL  72  -2.543   1.645   3.444
  608   HG23  VAL  72          2HG2      VAL  72  -1.648   2.724   4.537
  609    H    GLU  73           HN       GLU  73  -4.801   5.544   2.400
  610    HA   GLU  73           HA       GLU  73  -6.213   5.509   5.028
  611    HB2  GLU  73           2HB      GLU  73  -7.947   6.889   3.989
  612    HB3  GLU  73           3HB      GLU  73  -6.362   7.695   3.926
  613    HG2  GLU  73           2HG      GLU  73  -6.121   7.235   1.606
  614    HG3  GLU  73           3HG      GLU  73  -7.511   6.127   1.613
  615    HE2  GLU  73           2HE      GLU  73  -9.778   8.778   1.463
  616    H    LEU  74           HN       LEU  74  -8.074   4.238   5.201
  617    HA   LEU  74           HA       LEU  74  -8.250   2.070   3.227
  618    HB2  LEU  74           2HB      LEU  74  -8.527   2.162   5.933
  619    HB3  LEU  74           3HB      LEU  74 -10.229   2.278   5.430
  620    HG   LEU  74           HG       LEU  74  -9.767  -0.007   5.874
  621   HD11  LEU  74          1HD1      LEU  74 -10.177  -1.088   3.706
  622   HD12  LEU  74          2HD1      LEU  74 -11.140   0.394   3.889
  623   HD13  LEU  74          3HD1      LEU  74  -9.679   0.401   2.872
  624   HD21  LEU  74          3HD2      LEU  74  -7.324   0.092   5.768
  625   HD22  LEU  74          1HD2      LEU  74  -7.949  -1.263   4.801
  626   HD23  LEU  74          2HD2      LEU  74  -7.399   0.224   3.994
  627    H    GLU  75           HN       GLU  75  -8.866   4.327   1.907
  628    HA   GLU  75           HA       GLU  75 -10.451   5.508   0.754
  629    HB2  GLU  75           2HB      GLU  75 -10.970   3.233  -0.060
  630    HB3  GLU  75           3HB      GLU  75 -12.149   3.042   1.260
  631    HG2  GLU  75           2HG      GLU  75 -12.442   5.327  -0.657
  632    HG3  GLU  75           3HG      GLU  75 -12.918   3.692  -1.165
  633    HE2  GLU  75           2HE      GLU  75 -15.531   3.669   1.248
  634    H    HIS  76           HN       HIS  76 -10.739   7.234   2.162
  635    HA   HIS  76           HA       HIS  76 -13.244   7.166   3.686
  636    HB2  HIS  76           2HB      HIS  76 -11.504   6.203   5.201
  637    HB3  HIS  76           3HB      HIS  76 -10.591   7.718   5.059
  638    HD1  HIS  76           1HD      HIS  76 -13.805   6.316   6.485
  639    HD2  HIS  76           2HD      HIS  76 -11.478   9.778   6.680
  640    HE1  HIS  76           1HE      HIS  76 -14.772   7.713   8.365
  641    HE2  HIS  76           2HE      HIS  76 -13.351   9.813   8.481
  642    H    HIS  77           HN       HIS  77 -10.455   8.946   2.419
  643    HA   HIS  77           HA       HIS  77 -11.484  11.465   3.473
  644    HB2  HIS  77           2HB      HIS  77  -9.042  10.944   3.293
  645    HB3  HIS  77           3HB      HIS  77  -9.202  11.027   1.529
  646    HD1  HIS  77           1HD      HIS  77  -8.511  13.218   0.614
  647    HD2  HIS  77           2HD      HIS  77 -10.120  13.572   4.455
  648    HE1  HIS  77           1HE      HIS  77  -8.389  15.678   1.206
  649    HE2  HIS  77           2HE      HIS  77  -9.372  15.890   3.539
  650    H    HIS  78           HN       HIS  78 -13.565  10.972   2.328
  651    HA   HIS  78           HA       HIS  78 -15.111  11.607   0.783
  652    HB2  HIS  78           2HB      HIS  78 -14.339  13.735   1.862
  653    HB3  HIS  78           3HB      HIS  78 -13.275  13.998   0.469
  654    HD1  HIS  78           1HD      HIS  78 -14.249  15.257  -1.439
  655    HD2  HIS  78           2HD      HIS  78 -17.187  13.643   1.055
  656    HE1  HIS  78           1HE      HIS  78 -16.465  16.129  -2.303
  657    HE2  HIS  78           2HE      HIS  78 -18.248  15.143  -0.789
  658    H    HIS  79           HN       HIS  79 -14.118   9.751  -0.609
  659    HA   HIS  79           HA       HIS  79 -14.000  11.019  -3.282
  660    HB2  HIS  79           2HB      HIS  79 -11.703  10.186  -2.572
  661    HB3  HIS  79           3HB      HIS  79 -12.383   8.549  -2.620
  662    HD1  HIS  79           1HD      HIS  79 -11.741  11.531  -4.899
  663    HD2  HIS  79           2HD      HIS  79 -12.485   7.425  -5.134
  664    HE1  HIS  79           1HE      HIS  79 -11.426  10.893  -7.332
  665    HE2  HIS  79           2HE      HIS  79 -11.884   8.401  -7.469
  666    H    HIS  80           HN       HIS  80 -16.239  10.651  -3.275
  667    HA   HIS  80           HA       HIS  80 -17.388   8.090  -2.737
  668    HB2  HIS  80           2HB      HIS  80 -18.715  10.099  -2.548
  669    HB3  HIS  80           3HB      HIS  80 -18.419  10.514  -4.247
  670    HD1  HIS  80           1HD      HIS  80 -20.141   7.794  -2.192
  671    HD2  HIS  80           2HD      HIS  80 -20.310   9.568  -5.968
  672    HE1  HIS  80           1HE      HIS  80 -22.145   6.780  -3.360
  673    HE2  HIS  80           2HE      HIS  80 -22.249   7.861  -5.656
  674    H    HIS  81           HN       HIS  81 -17.542   6.335  -3.912
  675    HA   HIS  81           HA       HIS  81 -17.116   6.572  -6.853
  676    HB2  HIS  81           2HB      HIS  81 -15.233   5.440  -5.792
  677    HB3  HIS  81           3HB      HIS  81 -16.335   4.327  -4.960
  678    HD1  HIS  81           1HD      HIS  81 -17.027   2.253  -6.171
  679    HD2  HIS  81           2HD      HIS  81 -15.122   5.005  -8.667
  680    HE1  HIS  81           1HE      HIS  81 -16.636   1.057  -8.368
  681    HE2  HIS  81           2HE      HIS  81 -15.475   2.730  -9.888
  Start of MODEL   12
    1    H1   MET   1           HN       MET   1  -2.720   6.233  13.609
    2    HA   MET   1           HA       MET   1  -1.845   7.414  11.177
    3    HB2  MET   1           2HB      MET   1   0.317   7.723  12.221
    4    HB3  MET   1           3HB      MET   1   0.338   6.031  12.773
    5    HG2  MET   1           2HG      MET   1   0.347   5.313  10.386
    6    HG3  MET   1           3HG      MET   1   0.476   7.015   9.910
    7    HE1  MET   1           3HE      MET   1   2.635   6.325   8.479
    8    HE2  MET   1           1HE      MET   1   4.052   5.500   9.168
    9    HE3  MET   1           2HE      MET   1   2.497   4.645   9.051
   10    H    PHE   2           HN       PHE   2  -2.743   6.127   9.724
   11    HA   PHE   2           HA       PHE   2  -2.826   3.204  10.272
   12    HB2  PHE   2           2HB      PHE   2  -4.970   4.479   9.812
   13    HB3  PHE   2           3HB      PHE   2  -4.356   4.782   8.178
   14    HD1  PHE   2           1HD      PHE   2  -4.119   2.920   6.577
   15    HD2  PHE   2           2HD      PHE   2  -5.779   2.312  10.454
   16    HE1  PHE   2           1HE      PHE   2  -5.019   0.755   5.851
   17    HE2  PHE   2           2HE      PHE   2  -6.685   0.147   9.728
   18    HZ   PHE   2           HZ       PHE   2  -6.311  -0.633   7.423
   19    H    SER   3           HN       SER   3  -1.221   2.086   9.338
   20    HA   SER   3           HA       SER   3   0.110   3.299   6.992
   21    HB2  SER   3           2HB      SER   3   1.921   1.736   7.447
   22    HB3  SER   3           3HB      SER   3   1.485   2.598   8.942
   23    HG   SER   3           HG       SER   3   1.744   0.336   9.262
   24    H    LEU   4           HN       LEU   4   0.985   1.604   5.379
   25    HA   LEU   4           HA       LEU   4  -1.279   0.259   4.214
   26    HB2  LEU   4           2HB      LEU   4   0.633   1.285   2.967
   27    HB3  LEU   4           3HB      LEU   4   1.666  -0.037   3.560
   28    HG   LEU   4           HG       LEU   4   0.256  -1.659   2.369
   29   HD11  LEU   4          1HD1      LEU   4  -1.431  -0.886   0.752
   30   HD12  LEU   4          2HD1      LEU   4  -1.858  -0.418   2.414
   31   HD13  LEU   4          3HD1      LEU   4  -1.180   0.790   1.296
   32   HD21  LEU   4          3HD2      LEU   4   2.246  -0.720   1.283
   33   HD22  LEU   4          1HD2      LEU   4   0.971  -1.063   0.091
   34   HD23  LEU   4          2HD2      LEU   4   1.264   0.609   0.622
   35    H    ARG   5           HN       ARG   5   1.037  -0.580   6.612
   36    HA   ARG   5           HA       ARG   5   0.796  -3.463   6.179
   37    HB2  ARG   5           2HB      ARG   5   2.877  -2.495   7.056
   38    HB3  ARG   5           3HB      ARG   5   1.994  -1.869   8.471
   39    HG2  ARG   5           2HG      ARG   5   3.256  -3.929   8.964
   40    HG3  ARG   5           3HG      ARG   5   1.504  -4.119   9.211
   41    HD2  ARG   5           2HD      ARG   5   1.431  -5.071   6.836
   42    HD3  ARG   5           3HD      ARG   5   3.204  -5.152   6.929
   43    HE   ARG   5           HE       ARG   5   2.912  -6.646   8.892
   44   HH11  ARG   5          2HH1      ARG   5   0.270  -6.229   6.602
   45   HH12  ARG   5          1HH1      ARG   5  -0.488  -7.752   7.005
   46   HH21  ARG   5          2HH2      ARG   5   1.900  -8.622   9.429
   47   HH22  ARG   5          1HH2      ARG   5   0.436  -9.108   8.606
   48    H    ASP   6           HN       ASP   6  -1.013  -0.970   7.678
   49    HA   ASP   6           HA       ASP   6  -2.278  -2.712   9.651
   50    HB2  ASP   6           2HB      ASP   6  -2.855   0.103   8.688
   51    HB3  ASP   6           3HB      ASP   6  -3.889  -0.750   9.855
   52    HD2  ASP   6           2HD      ASP   6  -0.613   0.928  11.151
   53    H    ALA   7           HN       ALA   7  -2.639  -1.919   6.308
   54    HA   ALA   7           HA       ALA   7  -5.451  -2.706   6.184
   55    HB1  ALA   7           1HB      ALA   7  -5.190  -2.356   3.761
   56    HB2  ALA   7           2HB      ALA   7  -4.571  -0.969   4.687
   57    HB3  ALA   7           3HB      ALA   7  -3.438  -2.145   3.981
   58    H    LYS   8           HN       LYS   8  -6.269  -4.521   5.045
   59    HA   LYS   8           HA       LYS   8  -4.308  -6.756   4.866
   60    HB2  LYS   8           2HB      LYS   8  -7.111  -6.647   5.939
   61    HB3  LYS   8           3HB      LYS   8  -6.496  -8.159   5.230
   62    HG2  LYS   8           2HG      LYS   8  -6.172  -8.264   7.596
   63    HG3  LYS   8           3HG      LYS   8  -4.579  -8.046   6.835
   64    HD2  LYS   8           2HD      LYS   8  -4.761  -5.597   7.311
   65    HD3  LYS   8           3HD      LYS   8  -6.259  -5.933   8.213
   66    HE2  LYS   8           2HE      LYS   8  -5.028  -7.397   9.739
   67    HE3  LYS   8           3HE      LYS   8  -3.533  -7.116   8.822
   68    HZ1  LYS   8           3HZ      LYS   8  -5.074  -5.060  10.256
   69    HZ2  LYS   8           1HZ      LYS   8  -3.657  -5.728  10.767
   70    HZ3  LYS   8           2HZ      LYS   8  -3.685  -4.800   9.406
   71    H    CYS   9           HN       CYS   9  -5.313  -8.629   3.512
   72    HA   CYS   9           HA       CYS   9  -5.452  -7.655   0.845
   73    HB2  CYS   9           2HB      CYS   9  -6.133 -10.115   0.419
   74    HB3  CYS   9           3HB      CYS   9  -4.517  -9.758   1.079
   75    HG   CYS   9           HG       CYS   9  -5.441 -11.962   2.132
   76    H    GLY  10           HN       GLY  10  -7.071  -7.366  -0.585
   77    HA2  GLY  10           1HA      GLY  10  -9.292  -7.546  -1.366
   78    HA3  GLY  10           2HA      GLY  10  -9.820  -8.032   0.262
   79    H    GLN  11           HN       GLN  11  -7.984  -5.652   1.170
   80    HA   GLN  11           HA       GLN  11 -10.201  -3.710   1.069
   81    HB2  GLN  11           2HB      GLN  11  -7.674  -3.876   2.733
   82    HB3  GLN  11           3HB      GLN  11  -8.826  -2.522   2.806
   83    HG2  GLN  11           2HG      GLN  11 -10.599  -4.068   3.492
   84    HG3  GLN  11           3HG      GLN  11  -9.449  -5.420   3.417
   85   HE21  GLN  11          1HE2      GLN  11 -11.055  -4.321   5.671
   86   HE22  GLN  11          2HE2      GLN  11  -9.893  -3.944   6.925
   87    H    THR  12           HN       THR  12 -10.209  -2.009  -0.186
   88    HA   THR  12           HA       THR  12  -7.758  -1.320  -1.668
   89    HB   THR  12           HB       THR  12 -10.530  -0.103  -1.945
   90    HG1  THR  12           1HG      THR  12 -10.784  -1.657  -3.638
   91   HG21  THR  12          3HG2      THR  12  -8.181  -0.321  -3.863
   92   HG22  THR  12          1HG2      THR  12  -9.751   0.430  -4.226
   93   HG23  THR  12          2HG2      THR  12  -8.687   1.149  -2.995
   94    H    VAL  13           HN       VAL  13  -6.430   0.175  -0.895
   95    HA   VAL  13           HA       VAL  13  -7.616   2.378   0.714
   96    HB   VAL  13           HB       VAL  13  -5.436   2.578   1.864
   97   HG11  VAL  13          1HG1      VAL  13  -5.619   0.567   3.267
   98   HG12  VAL  13          2HG1      VAL  13  -7.219   1.238   2.878
   99   HG13  VAL  13          3HG1      VAL  13  -6.628  -0.207   2.023
  100   HG21  VAL  13          3HG2      VAL  13  -4.004   1.653   0.105
  101   HG22  VAL  13          1HG2      VAL  13  -3.742   0.809   1.648
  102   HG23  VAL  13          2HG2      VAL  13  -4.709   0.040   0.369
  103    H    LYS  14           HN       LYS  14  -6.302   4.409   0.647
  104    HA   LYS  14           HA       LYS  14  -5.025   4.747  -2.024
  105    HB2  LYS  14           2HB      LYS  14  -7.239   5.815  -1.867
  106    HB3  LYS  14           3HB      LYS  14  -6.695   6.717  -0.432
  107    HG2  LYS  14           2HG      LYS  14  -5.080   7.931  -1.753
  108    HG3  LYS  14           3HG      LYS  14  -5.471   6.957  -3.190
  109    HD2  LYS  14           2HD      LYS  14  -7.450   8.713  -1.703
  110    HD3  LYS  14           3HD      LYS  14  -6.566   9.202  -3.168
  111    HE2  LYS  14           2HE      LYS  14  -7.598   7.402  -4.438
  112    HE3  LYS  14           3HE      LYS  14  -8.409   6.798  -2.976
  113    HZ1  LYS  14           3HZ      LYS  14  -8.878   9.414  -4.237
  114    HZ2  LYS  14           1HZ      LYS  14  -9.881   8.111  -4.330
  115    HZ3  LYS  14           2HZ      LYS  14  -9.630   8.854  -2.881
  116    H    VAL  15           HN       VAL  15  -2.996   5.484  -2.004
  117    HA   VAL  15           HA       VAL  15  -1.631   5.814   0.506
  118    HB   VAL  15           HB       VAL  15  -0.690   6.486  -2.309
  119   HG11  VAL  15          1HG1      VAL  15   1.573   6.236  -1.384
  120   HG12  VAL  15          2HG1      VAL  15   0.673   7.533  -0.567
  121   HG13  VAL  15          3HG1      VAL  15   0.881   5.955   0.229
  122   HG21  VAL  15          3HG2      VAL  15  -1.411   4.154  -2.116
  123   HG22  VAL  15          1HG2      VAL  15   0.355   4.262  -2.289
  124   HG23  VAL  15          2HG2      VAL  15  -0.364   3.941  -0.693
  125    H    VAL  16           HN       VAL  16  -1.321   7.600   1.699
  126    HA   VAL  16           HA       VAL  16  -1.946  10.187   0.377
  127    HB   VAL  16           HB       VAL  16  -2.534  10.955   2.769
  128   HG11  VAL  16          1HG1      VAL  16  -4.850  10.153   2.525
  129   HG12  VAL  16          2HG1      VAL  16  -4.173  10.667   0.963
  130   HG13  VAL  16          3HG1      VAL  16  -4.304   8.935   1.350
  131   HG21  VAL  16          3HG2      VAL  16  -1.624   9.009   3.956
  132   HG22  VAL  16          1HG2      VAL  16  -3.365   9.190   4.271
  133   HG23  VAL  16          2HG2      VAL  16  -2.793   7.952   3.130
  134    H    LYS  17           HN       LYS  17   0.137   8.551   2.788
  135    HA   LYS  17           HA       LYS  17   2.057  10.781   2.350
  136    HB2  LYS  17           2HB      LYS  17   1.329   9.492   4.993
  137    HB3  LYS  17           3HB      LYS  17   2.826  10.423   4.740
  138    HG2  LYS  17           2HG      LYS  17   1.436  11.988   5.700
  139    HG3  LYS  17           3HG      LYS  17   1.212  12.313   3.965
  140    HD2  LYS  17           2HD      LYS  17  -0.871  11.116   3.940
  141    HD3  LYS  17           3HD      LYS  17  -0.614  10.532   5.601
  142    HE2  LYS  17           2HE      LYS  17  -0.730  12.836   6.435
  143    HE3  LYS  17           3HE      LYS  17  -0.963  13.431   4.777
  144    HZ1  LYS  17           3HZ      LYS  17  -2.790  11.631   6.223
  145    HZ2  LYS  17           1HZ      LYS  17  -3.040  13.237   5.951
  146    HZ3  LYS  17           2HZ      LYS  17  -3.005  12.184   4.684
  147    H    LEU  18           HN       LEU  18   4.154  10.209   2.089
  148    HA   LEU  18           HA       LEU  18   4.793   7.304   2.341
  149    HB2  LEU  18           2HB      LEU  18   6.071   9.428   0.586
  150    HB3  LEU  18           3HB      LEU  18   6.559   7.719   0.682
  151    HG   LEU  18           HG       LEU  18   3.864   8.695  -0.298
  152   HD11  LEU  18          1HD1      LEU  18   4.684   8.126  -2.547
  153   HD12  LEU  18          2HD1      LEU  18   5.669   9.405  -1.801
  154   HD13  LEU  18          3HD1      LEU  18   6.280   7.735  -1.864
  155   HD21  LEU  18          3HD2      LEU  18   3.838   6.429   0.637
  156   HD22  LEU  18          1HD2      LEU  18   3.616   6.392  -1.127
  157   HD23  LEU  18          2HD2      LEU  18   5.193   5.970  -0.422
  158    H    HIS  19           HN       HIS  19   5.742   7.087   4.351
  159    HA   HIS  19           HA       HIS  19   7.352   9.315   5.379
  160    HB2  HIS  19           2HB      HIS  19   6.614   6.625   6.580
  161    HB3  HIS  19           3HB      HIS  19   7.540   7.887   7.415
  162    HD1  HIS  19           1HD      HIS  19   6.209   9.424   8.812
  163    HD2  HIS  19           2HD      HIS  19   3.893   7.659   5.814
  164    HE1  HIS  19           1HE      HIS  19   3.830  10.194   9.211
  165    HE2  HIS  19           2HE      HIS  19   2.428   9.122   7.392
  166    H    GLY  20           HN       GLY  20   8.130   5.886   5.850
  167    HA2  GLY  20           1HA      GLY  20  10.039   4.703   5.432
  168    HA3  GLY  20           2HA      GLY  20  10.217   5.694   3.966
  169    H    THR  21           HN       THR  21  12.503   5.448   4.330
  170    HA   THR  21           HA       THR  21  13.473   7.465   6.297
  171    HB   THR  21           HB       THR  21  14.137   5.124   6.889
  172    HG1  THR  21           1HG      THR  21  16.377   5.638   7.097
  173   HG21  THR  21          3HG2      THR  21  15.669   5.234   4.268
  174   HG22  THR  21          1HG2      THR  21  15.796   3.950   5.491
  175   HG23  THR  21          2HG2      THR  21  14.267   4.195   4.616
  176    H    GLY  22           HN       GLY  22  12.566   7.567   3.387
  177    HA2  GLY  22           1HA      GLY  22  13.353   9.283   1.906
  178    HA3  GLY  22           2HA      GLY  22  15.019   8.938   2.423
  179    H    ALA  23           HN       ALA  23  15.643   6.517   1.990
  180    HA   ALA  23           HA       ALA  23  15.782   6.155  -0.791
  181    HB1  ALA  23           1HB      ALA  23  16.622   3.900  -0.271
  182    HB2  ALA  23           2HB      ALA  23  17.330   5.121   0.812
  183    HB3  ALA  23           3HB      ALA  23  16.024   4.062   1.396
  184    H    LEU  24           HN       LEU  24  13.464   4.877   1.569
  185    HA   LEU  24           HA       LEU  24  12.164   3.040  -0.165
  186    HB2  LEU  24           2HB      LEU  24  11.356   4.509   2.332
  187    HB3  LEU  24           3HB      LEU  24  10.165   3.544   1.429
  188    HG   LEU  24           HG       LEU  24  11.013   2.240   3.246
  189   HD11  LEU  24          1HD1      LEU  24  11.896   0.292   2.034
  190   HD12  LEU  24          2HD1      LEU  24  10.567   1.069   1.144
  191   HD13  LEU  24          3HD1      LEU  24  12.252   1.328   0.633
  192   HD21  LEU  24          3HD2      LEU  24  13.125   3.420   3.620
  193   HD22  LEU  24          1HD2      LEU  24  13.392   1.666   3.488
  194   HD23  LEU  24          2HD2      LEU  24  13.785   2.729   2.118
  195    H    LYS  25           HN       LYS  25  11.678   6.518   0.426
  196    HA   LYS  25           HA       LYS  25   9.215   6.853  -0.880
  197    HB2  LYS  25           2HB      LYS  25  11.615   8.699  -0.697
  198    HB3  LYS  25           3HB      LYS  25  10.024   9.193  -1.325
  199    HG2  LYS  25           2HG      LYS  25   9.002   8.742   0.837
  200    HG3  LYS  25           3HG      LYS  25  10.560   8.165   1.474
  201    HD2  LYS  25           2HD      LYS  25  11.548  10.360   1.180
  202    HD3  LYS  25           3HD      LYS  25  10.069  10.957   0.390
  203    HE2  LYS  25           2HE      LYS  25   8.812  10.622   2.462
  204    HE3  LYS  25           3HE      LYS  25  10.267   9.980   3.255
  205    HZ1  LYS  25           3HZ      LYS  25   9.955  12.710   2.200
  206    HZ2  LYS  25           1HZ      LYS  25   9.906  12.283   3.792
  207    HZ3  LYS  25           2HZ      LYS  25  11.305  12.114   2.937
  208    H    ARG  26           HN       ARG  26  12.522   7.144  -2.231
  209    HA   ARG  26           HA       ARG  26  11.725   7.812  -4.856
  210    HB2  ARG  26           2HB      ARG  26  14.001   8.097  -4.014
  211    HB3  ARG  26           3HB      ARG  26  14.189   6.331  -3.884
  212    HG2  ARG  26           2HG      ARG  26  13.826   6.197  -6.362
  213    HG3  ARG  26           3HG      ARG  26  13.887   7.976  -6.405
  214    HD2  ARG  26           2HD      ARG  26  16.144   7.922  -5.438
  215    HD3  ARG  26           3HD      ARG  26  16.084   6.147  -5.389
  216    HE   ARG  26           HE       ARG  26  15.940   7.714  -7.924
  217   HH11  ARG  26          2HH1      ARG  26  17.090   4.990  -6.019
  218   HH12  ARG  26          1HH1      ARG  26  18.014   4.300  -7.333
  219   HH21  ARG  26          2HH2      ARG  26  17.151   6.818  -9.629
  220   HH22  ARG  26          1HH2      ARG  26  18.050   5.336  -9.382
  221    H    ARG  27           HN       ARG  27  12.605   4.615  -3.475
  222    HA   ARG  27           HA       ARG  27  12.336   3.177  -5.890
  223    HB2  ARG  27           2HB      ARG  27  11.978   2.294  -3.012
  224    HB3  ARG  27           3HB      ARG  27  12.088   1.188  -4.401
  225    HG2  ARG  27           2HG      ARG  27  14.329   1.913  -4.878
  226    HG3  ARG  27           3HG      ARG  27  14.228   3.188  -3.641
  227    HD2  ARG  27           2HD      ARG  27  15.501   1.324  -2.774
  228    HD3  ARG  27           3HD      ARG  27  13.956   1.443  -1.906
  229    HE   ARG  27           HE       ARG  27  13.345  -0.362  -3.818
  230   HH11  ARG  27          2HH1      ARG  27  16.180  -0.078  -1.743
  231   HH12  ARG  27          1HH1      ARG  27  16.431  -1.805  -1.632
  232   HH21  ARG  27          2HH2      ARG  27  13.664  -2.620  -3.643
  233   HH22  ARG  27          1HH2      ARG  27  15.004  -3.247  -2.710
  234    H    ILE  28           HN       ILE  28   9.955   3.698  -3.251
  235    HA   ILE  28           HA       ILE  28   7.908   2.146  -4.481
  236    HB   ILE  28           HB       ILE  28   7.661   4.440  -2.491
  237   HG12  ILE  28          2HG1      ILE  28   7.757   1.432  -2.077
  238   HG13  ILE  28          3HG1      ILE  28   9.125   2.541  -1.814
  239   HG21  ILE  28          1HG2      ILE  28   5.485   3.434  -1.926
  240   HG22  ILE  28          2HG2      ILE  28   5.532   3.957  -3.627
  241   HG23  ILE  28          3HG2      ILE  28   5.703   2.233  -3.222
  242   HD11  ILE  28          3HD1      ILE  28   6.494   2.573  -0.319
  243   HD12  ILE  28          1HD1      ILE  28   8.035   1.949   0.308
  244   HD13  ILE  28          2HD1      ILE  28   7.864   3.679  -0.054
  245    H    MET  29           HN       MET  29   8.907   5.520  -4.828
  246    HA   MET  29           HA       MET  29   6.612   6.312  -6.367
  247    HB2  MET  29           2HB      MET  29   9.377   7.463  -6.016
  248    HB3  MET  29           3HB      MET  29   8.219   8.152  -7.179
  249    HG2  MET  29           2HG      MET  29   6.600   8.412  -5.278
  250    HG3  MET  29           3HG      MET  29   7.900   7.923  -4.177
  251    HE1  MET  29           3HE      MET  29  10.447   9.275  -5.588
  252    HE2  MET  29           1HE      MET  29  10.529  10.818  -4.710
  253    HE3  MET  29           2HE      MET  29  10.150   9.319  -3.834
  254    H    ASP  30           HN       ASP  30   9.835   5.047  -7.175
  255    HA   ASP  30           HA       ASP  30   9.633   5.309  -9.990
  256    HB2  ASP  30           2HB      ASP  30  11.232   3.576  -8.128
  257    HB3  ASP  30           3HB      ASP  30  11.239   3.219  -9.869
  258    HD2  ASP  30           2HD      ASP  30  13.711   5.868  -8.747
  259    H    MET  31           HN       MET  31   8.331   2.923  -7.753
  260    HA   MET  31           HA       MET  31   7.711   0.909  -9.694
  261    HB2  MET  31           2HB      MET  31   6.254   1.513  -7.101
  262    HB3  MET  31           3HB      MET  31   6.255  -0.022  -8.001
  263    HG2  MET  31           2HG      MET  31   8.586  -0.372  -7.506
  264    HG3  MET  31           3HG      MET  31   8.713   1.228  -6.757
  265    HE1  MET  31           3HE      MET  31   9.468   0.827  -4.429
  266    HE2  MET  31           1HE      MET  31   9.052  -0.614  -3.472
  267    HE3  MET  31           2HE      MET  31   9.907  -0.793  -5.022
  268    H    GLY  32           HN       GLY  32   6.290   3.980  -8.929
  269    HA2  GLY  32           1HA      GLY  32   4.680   4.888 -10.524
  270    HA3  GLY  32           2HA      GLY  32   3.947   3.271 -10.632
  271    H    ILE  33           HN       ILE  33   4.894   3.839  -7.480
  272    HA   ILE  33           HA       ILE  33   2.084   4.405  -6.751
  273    HB   ILE  33           HB       ILE  33   4.385   3.430  -5.010
  274   HG12  ILE  33          2HG1      ILE  33   3.835   1.764  -6.684
  275   HG13  ILE  33          3HG1      ILE  33   3.245   1.241  -5.088
  276   HG21  ILE  33          1HG2      ILE  33   2.623   2.902  -3.371
  277   HG22  ILE  33          2HG2      ILE  33   2.652   4.639  -3.758
  278   HG23  ILE  33          3HG2      ILE  33   1.400   3.589  -4.466
  279   HD11  ILE  33          3HD1      ILE  33   1.568   2.462  -7.293
  280   HD12  ILE  33          1HD1      ILE  33   1.606   0.742  -6.852
  281   HD13  ILE  33          2HD1      ILE  33   0.978   1.937  -5.698
  282    H    THR  34           HN       THR  34   1.625   6.492  -6.457
  283    HA   THR  34           HA       THR  34   3.570   8.066  -4.849
  284    HB   THR  34           HB       THR  34   2.744  10.100  -6.114
  285    HG1  THR  34           1HG      THR  34   1.793   9.648  -8.169
  286   HG21  THR  34          3HG2      THR  34   4.163   7.969  -7.752
  287   HG22  THR  34          1HG2      THR  34   4.190   9.718  -8.077
  288   HG23  THR  34          2HG2      THR  34   4.932   9.080  -6.593
  289    H    ARG  35           HN       ARG  35   2.404  10.118  -3.970
  290    HA   ARG  35           HA       ARG  35   0.226   9.216  -2.335
  291    HB2  ARG  35           2HB      ARG  35   1.354  11.975  -2.893
  292    HB3  ARG  35           3HB      ARG  35   0.138  11.614  -1.644
  293    HG2  ARG  35           2HG      ARG  35   1.650  10.435  -0.328
  294    HG3  ARG  35           3HG      ARG  35   2.765  10.152  -1.685
  295    HD2  ARG  35           2HD      ARG  35   3.505  11.866   0.044
  296    HD3  ARG  35           3HD      ARG  35   3.539  12.392  -1.653
  297    HE   ARG  35           HE       ARG  35   1.317  13.487  -1.162
  298   HH11  ARG  35          2HH1      ARG  35   3.639  12.865   1.424
  299   HH12  ARG  35          1HH1      ARG  35   3.078  14.201   2.403
  300   HH21  ARG  35          2HH2      ARG  35   0.628  15.216   0.099
  301   HH22  ARG  35          1HH2      ARG  35   1.372  15.531   1.651
  302    H    GLY  36           HN       GLY  36  -1.859   9.061  -2.848
  303    HA2  GLY  36           1HA      GLY  36  -3.857  10.095  -3.758
  304    HA3  GLY  36           2HA      GLY  36  -2.859  10.800  -5.049
  305    H    CYS  37           HN       CYS  37  -1.801   7.669  -4.458
  306    HA   CYS  37           HA       CYS  37  -3.404   6.670  -6.751
  307    HB2  CYS  37           2HB      CYS  37  -0.813   5.692  -5.521
  308    HB3  CYS  37           3HB      CYS  37  -1.671   4.883  -6.856
  309    HG   CYS  37           HG       CYS  37   0.465   6.082  -7.767
  310    H    GLU  38           HN       GLU  38  -4.562   4.761  -6.657
  311    HA   GLU  38           HA       GLU  38  -5.257   3.880  -3.939
  312    HB2  GLU  38           2HB      GLU  38  -6.386   2.902  -6.577
  313    HB3  GLU  38           3HB      GLU  38  -7.079   2.688  -4.953
  314    HG2  GLU  38           2HG      GLU  38  -8.389   4.385  -5.722
  315    HG3  GLU  38           3HG      GLU  38  -7.081   5.325  -4.971
  316    HE2  GLU  38           2HE      GLU  38  -7.475   5.407  -8.912
  317    H    ILE  39           HN       ILE  39  -4.942   1.863  -3.131
  318    HA   ILE  39           HA       ILE  39  -3.605  -0.170  -4.810
  319    HB   ILE  39           HB       ILE  39  -2.566   0.824  -2.121
  320   HG12  ILE  39          2HG1      ILE  39  -1.299   0.756  -4.874
  321   HG13  ILE  39          3HG1      ILE  39  -1.831   2.201  -3.981
  322   HG21  ILE  39          1HG2      ILE  39  -0.871  -0.954  -2.294
  323   HG22  ILE  39          2HG2      ILE  39  -2.516  -1.627  -2.231
  324   HG23  ILE  39          3HG2      ILE  39  -1.646  -1.546  -3.782
  325   HD11  ILE  39          3HD1      ILE  39   0.381   0.307  -3.145
  326   HD12  ILE  39          1HD1      ILE  39   0.610   1.920  -3.850
  327   HD13  ILE  39          2HD1      ILE  39  -0.151   1.752  -2.254
  328    H    TYR  40           HN       TYR  40  -4.594  -2.130  -4.464
  329    HA   TYR  40           HA       TYR  40  -5.841  -2.467  -1.778
  330    HB2  TYR  40           2HB      TYR  40  -7.586  -3.691  -2.634
  331    HB3  TYR  40           3HB      TYR  40  -7.344  -2.484  -3.908
  332    HD1  TYR  40           2HD      TYR  40  -6.218  -3.166  -6.049
  333    HD2  TYR  40           1HD      TYR  40  -7.297  -6.019  -3.072
  334    HE1  TYR  40           2HE      TYR  40  -6.029  -4.972  -7.705
  335    HE2  TYR  40           1HE      TYR  40  -7.108  -7.822  -4.725
  336    HH   TYR  40           HH       TYR  40  -6.192  -7.205  -8.110
  337    H    ILE  41           HN       ILE  41  -5.242  -4.181  -0.566
  338    HA   ILE  41           HA       ILE  41  -2.764  -5.439  -1.292
  339    HB   ILE  41           HB       ILE  41  -4.631  -6.261   0.958
  340   HG12  ILE  41          2HG1      ILE  41  -4.225  -3.849   1.075
  341   HG13  ILE  41          3HG1      ILE  41  -3.402  -4.715   2.395
  342   HG21  ILE  41          1HG2      ILE  41  -2.548  -7.022   2.032
  343   HG22  ILE  41          2HG2      ILE  41  -2.799  -7.821   0.462
  344   HG23  ILE  41          3HG2      ILE  41  -1.623  -6.493   0.608
  345   HD11  ILE  41          3HD1      ILE  41  -2.100  -3.677  -0.137
  346   HD12  ILE  41          1HD1      ILE  41  -1.975  -2.934   1.471
  347   HD13  ILE  41          2HD1      ILE  41  -1.278  -4.542   1.185
  348    H    ARG  42           HN       ARG  42  -2.500  -7.114  -2.578
  349    HA   ARG  42           HA       ARG  42  -4.753  -8.638  -3.561
  350    HB2  ARG  42           2HB      ARG  42  -2.780  -8.069  -4.930
  351    HB3  ARG  42           3HB      ARG  42  -1.759  -9.058  -3.858
  352    HG2  ARG  42           2HG      ARG  42  -2.151 -10.359  -5.780
  353    HG3  ARG  42           3HG      ARG  42  -3.203 -11.030  -4.510
  354    HD2  ARG  42           2HD      ARG  42  -5.137  -9.976  -5.441
  355    HD3  ARG  42           3HD      ARG  42  -4.149  -9.013  -6.562
  356    HE   ARG  42           HE       ARG  42  -3.974 -11.941  -6.817
  357   HH11  ARG  42          2HH1      ARG  42  -5.392  -8.924  -7.947
  358   HH12  ARG  42          1HH1      ARG  42  -5.833  -9.568  -9.512
  359   HH21  ARG  42          2HH2      ARG  42  -4.541 -12.772  -8.871
  360   HH22  ARG  42          1HH2      ARG  42  -5.351 -11.749 -10.035
  361    H    LYS  43           HN       LYS  43  -1.789  -9.531  -1.734
  362    HA   LYS  43           HA       LYS  43  -3.311 -11.407  -0.087
  363    HB2  LYS  43           2HB      LYS  43  -1.186 -12.363  -2.034
  364    HB3  LYS  43           3HB      LYS  43  -1.749 -13.309  -0.635
  365    HG2  LYS  43           2HG      LYS  43  -4.030 -13.290  -1.570
  366    HG3  LYS  43           3HG      LYS  43  -3.423 -12.402  -2.987
  367    HD2  LYS  43           2HD      LYS  43  -1.903 -14.286  -3.489
  368    HD3  LYS  43           3HD      LYS  43  -2.575 -15.177  -2.103
  369    HE2  LYS  43           2HE      LYS  43  -4.818 -15.058  -3.138
  370    HE3  LYS  43           3HE      LYS  43  -4.114 -14.216  -4.536
  371    HZ1  LYS  43           3HZ      LYS  43  -3.436 -16.942  -3.659
  372    HZ2  LYS  43           1HZ      LYS  43  -4.384 -16.557  -4.952
  373    HZ3  LYS  43           2HZ      LYS  43  -2.784 -16.160  -4.957
  374    H    VAL  44           HN       VAL  44  -2.246 -11.887   1.826
  375    HA   VAL  44           HA       VAL  44   0.381 -10.528   2.161
  376    HB   VAL  44           HB       VAL  44  -1.643 -11.309   4.294
  377   HG11  VAL  44          1HG1      VAL  44  -0.249  -9.962   5.805
  378   HG12  VAL  44          2HG1      VAL  44   0.668 -11.312   5.101
  379   HG13  VAL  44          3HG1      VAL  44   0.895  -9.660   4.479
  380   HG21  VAL  44          3HG2      VAL  44  -2.492  -9.496   2.882
  381   HG22  VAL  44          1HG2      VAL  44  -2.096  -8.901   4.509
  382   HG23  VAL  44          2HG2      VAL  44  -0.994  -8.575   3.152
  383    H    ALA  45           HN       ALA  45   2.121 -11.779   2.484
  384    HA   ALA  45           HA       ALA  45   2.017 -14.588   2.366
  385    HB1  ALA  45           1HB      ALA  45   4.366 -14.520   3.097
  386    HB2  ALA  45           2HB      ALA  45   4.033 -13.274   1.871
  387    HB3  ALA  45           3HB      ALA  45   4.164 -12.822   3.588
  388    HA   PRO  46           HA       PRO  46   0.567 -16.002   6.230
  389    HB2  PRO  46           2HB      PRO  46   2.827 -18.009   6.134
  390    HB3  PRO  46           3HB      PRO  46   1.055 -18.250   6.292
  391    HG2  PRO  46           2HG      PRO  46   2.317 -18.734   4.015
  392    HG3  PRO  46           3HG      PRO  46   0.651 -18.068   4.040
  393    HD2  PRO  46           2HD      PRO  46   3.292 -16.741   3.456
  394    HD3  PRO  46           3HD      PRO  46   1.671 -16.414   2.773
  395    H    LEU  47           HN       LEU  47   3.939 -15.127   5.859
  396    HA   LEU  47           HA       LEU  47   4.271 -15.096   8.805
  397    HB2  LEU  47           2HB      LEU  47   6.666 -14.783   8.351
  398    HB3  LEU  47           3HB      LEU  47   6.017 -16.272   7.623
  399    HG   LEU  47           HG       LEU  47   6.344 -13.752   6.003
  400   HD11  LEU  47          1HD1      LEU  47   8.558 -14.576   5.305
  401   HD12  LEU  47          2HD1      LEU  47   8.518 -14.226   7.047
  402   HD13  LEU  47          3HD1      LEU  47   8.430 -15.909   6.476
  403   HD21  LEU  47          3HD2      LEU  47   5.005 -15.583   5.053
  404   HD22  LEU  47          1HD2      LEU  47   6.518 -15.362   4.143
  405   HD23  LEU  47          2HD2      LEU  47   6.364 -16.707   5.296
  406    H    GLY  48           HN       GLY  48   3.098 -13.054   6.534
  407    HA2  GLY  48           1HA      GLY  48   2.530 -10.820   6.974
  408    HA3  GLY  48           2HA      GLY  48   3.794 -10.748   8.223
  409    H    ASP  49           HN       ASP  49   5.728 -11.974   6.211
  410    HA   ASP  49           HA       ASP  49   6.139  -9.523   4.563
  411    HB2  ASP  49           2HB      ASP  49   7.661  -9.492   6.493
  412    HB3  ASP  49           3HB      ASP  49   8.234 -11.122   6.081
  413    HD2  ASP  49           2HD      ASP  49  10.343  -9.899   3.613
  414    HA   PRO  50           HA       PRO  50   6.380  -8.896   3.081
  415    HB2  PRO  50           2HB      PRO  50   6.375  -8.513   0.380
  416    HB3  PRO  50           3HB      PRO  50   7.888  -8.845   1.287
  417    HG2  PRO  50           2HG      PRO  50   6.349 -10.618  -0.491
  418    HG3  PRO  50           3HG      PRO  50   8.108 -10.608  -0.139
  419    HD2  PRO  50           2HD      PRO  50   6.027 -12.273   0.999
  420    HD3  PRO  50           3HD      PRO  50   7.769 -12.249   1.410
  421    H    ILE  51           HN       ILE  51   4.781  -7.630   1.302
  422    HA   ILE  51           HA       ILE  51   2.258  -9.204   1.333
  423    HB   ILE  51           HB       ILE  51   1.082  -6.966   1.317
  424   HG12  ILE  51          2HG1      ILE  51   3.847  -5.967   2.058
  425   HG13  ILE  51          3HG1      ILE  51   2.948  -5.587   0.569
  426   HG21  ILE  51          1HG2      ILE  51   1.312  -6.623   3.741
  427   HG22  ILE  51          2HG2      ILE  51   1.241  -8.352   3.331
  428   HG23  ILE  51          3HG2      ILE  51   2.801  -7.597   3.736
  429   HD11  ILE  51          3HD1      ILE  51   2.128  -4.834   3.383
  430   HD12  ILE  51          1HD1      ILE  51   2.831  -3.734   2.178
  431   HD13  ILE  51          2HD1      ILE  51   1.232  -4.453   1.893
  432    H    GLN  52           HN       GLN  52   1.160  -9.440  -0.511
  433    HA   GLN  52           HA       GLN  52   2.396  -8.290  -2.938
  434    HB2  GLN  52           2HB      GLN  52   0.396 -10.533  -2.529
  435    HB3  GLN  52           3HB      GLN  52   0.898  -9.922  -4.124
  436    HG2  GLN  52           2HG      GLN  52   2.152 -11.881  -3.740
  437    HG3  GLN  52           3HG      GLN  52   3.264 -10.520  -3.482
  438   HE21  GLN  52          1HE2      GLN  52   1.435 -13.116  -1.961
  439   HE22  GLN  52          2HE2      GLN  52   2.292 -13.090  -0.434
  440    H    ILE  53           HN       ILE  53   1.449  -6.684  -4.023
  441    HA   ILE  53           HA       ILE  53  -1.430  -6.155  -3.475
  442    HB   ILE  53           HB       ILE  53  -0.964  -3.739  -3.784
  443   HG12  ILE  53          2HG1      ILE  53   1.955  -4.568  -3.745
  444   HG13  ILE  53          3HG1      ILE  53   1.062  -4.004  -5.177
  445   HG21  ILE  53          1HG2      ILE  53   0.137  -3.355  -1.618
  446   HG22  ILE  53          2HG2      ILE  53  -1.029  -4.695  -1.524
  447   HG23  ILE  53          3HG2      ILE  53   0.715  -5.038  -1.613
  448   HD11  ILE  53          3HD1      ILE  53   1.596  -2.397  -2.666
  449   HD12  ILE  53          1HD1      ILE  53   2.438  -2.204  -4.218
  450   HD13  ILE  53          2HD1      ILE  53   0.705  -1.832  -4.100
  451    H    ASN  54           HN       ASN  54  -2.593  -5.146  -5.271
  452    HA   ASN  54           HA       ASN  54  -1.219  -5.647  -7.873
  453    HB2  ASN  54           2HB      ASN  54  -3.087  -7.248  -7.303
  454    HB3  ASN  54           3HB      ASN  54  -4.198  -5.862  -7.345
  455   HD21  ASN  54          1HD2      ASN  54  -2.153  -8.018  -9.234
  456   HD22  ASN  54          2HD2      ASN  54  -2.771  -7.552 -10.805
  457    H    VAL  55           HN       VAL  55  -0.703  -3.767  -8.752
  458    HA   VAL  55           HA       VAL  55  -2.738  -1.612  -8.737
  459    HB   VAL  55           HB       VAL  55   0.208  -1.117  -8.165
  460   HG11  VAL  55          1HG1      VAL  55  -0.537   1.158  -7.615
  461   HG12  VAL  55          2HG1      VAL  55  -0.958   0.720  -9.286
  462   HG13  VAL  55          3HG1      VAL  55  -2.210   0.706  -8.020
  463   HG21  VAL  55          3HG2      VAL  55  -0.801  -2.288  -6.268
  464   HG22  VAL  55          1HG2      VAL  55  -0.444  -0.596  -5.854
  465   HG23  VAL  55          2HG2      VAL  55  -2.114  -1.087  -6.216
  466    H    ARG  56           HN       ARG  56  -2.915  -0.578 -10.654
  467    HA   ARG  56           HA       ARG  56  -2.473   0.135 -12.775
  468    HB2  ARG  56           2HB      ARG  56   0.409  -0.634 -12.206
  469    HB3  ARG  56           3HB      ARG  56  -0.168   0.377 -13.553
  470    HG2  ARG  56           2HG      ARG  56  -0.318   1.049 -10.602
  471    HG3  ARG  56           3HG      ARG  56   0.800   1.752 -11.795
  472    HD2  ARG  56           2HD      ARG  56  -1.060   2.731 -13.017
  473    HD3  ARG  56           3HD      ARG  56  -2.226   1.945 -11.931
  474    HE   ARG  56           HE       ARG  56  -1.416   3.385 -10.129
  475   HH11  ARG  56          2HH1      ARG  56  -0.441   4.232 -13.406
  476   HH12  ARG  56          1HH1      ARG  56  -0.176   5.920 -13.027
  477   HH21  ARG  56          2HH2      ARG  56  -1.095   5.595  -9.651
  478   HH22  ARG  56          1HH2      ARG  56  -0.548   6.692 -10.899
  479    H    GLY  57           HN       GLY  57  -2.727  -2.883 -11.908
  480    HA2  GLY  57           1HA      GLY  57  -3.228  -4.695 -13.334
  481    HA3  GLY  57           2HA      GLY  57  -2.295  -3.923 -14.637
  482    H    TYR  58           HN       TYR  58  -0.410  -3.583 -11.998
  483    HA   TYR  58           HA       TYR  58   1.066  -6.088 -12.616
  484    HB2  TYR  58           2HB      TYR  58   1.969  -3.381 -11.597
  485    HB3  TYR  58           3HB      TYR  58   3.008  -4.816 -11.569
  486    HD1  TYR  58           1HD      TYR  58   3.856  -5.779 -13.653
  487    HD2  TYR  58           2HD      TYR  58   1.455  -2.259 -13.704
  488    HE1  TYR  58           1HE      TYR  58   4.560  -5.334 -15.959
  489    HE2  TYR  58           2HE      TYR  58   2.157  -1.817 -16.017
  490    HH   TYR  58           HH       TYR  58   3.411  -2.506 -17.784
  491    H    GLU  59           HN       GLU  59   1.594  -7.503 -11.038
  492    HA   GLU  59           HA       GLU  59   0.563  -6.931  -8.339
  493    HB2  GLU  59           2HB      GLU  59   1.339  -9.328  -7.934
  494    HB3  GLU  59           3HB      GLU  59  -0.027  -9.083  -9.049
  495    HG2  GLU  59           2HG      GLU  59   1.416  -9.387 -10.958
  496    HG3  GLU  59           3HG      GLU  59   2.846  -9.483  -9.908
  497    HE2  GLU  59           2HE      GLU  59   0.541 -12.674 -10.284
  498    H    LEU  60           HN       LEU  60   1.815  -5.814  -7.053
  499    HA   LEU  60           HA       LEU  60   4.765  -6.124  -7.287
  500    HB2  LEU  60           2HB      LEU  60   3.136  -3.955  -5.928
  501    HB3  LEU  60           3HB      LEU  60   4.900  -3.975  -6.164
  502    HG   LEU  60           HG       LEU  60   2.840  -3.836  -8.381
  503   HD11  LEU  60          1HD1      LEU  60   3.548  -1.491  -8.628
  504   HD12  LEU  60          2HD1      LEU  60   2.849  -1.796  -7.020
  505   HD13  LEU  60          3HD1      LEU  60   4.614  -1.668  -7.215
  506   HD21  LEU  60          3HD2      LEU  60   4.942  -4.905  -9.056
  507   HD22  LEU  60          1HD2      LEU  60   4.767  -3.306  -9.816
  508   HD23  LEU  60          2HD2      LEU  60   5.857  -3.514  -8.426
  509    H    SER  61           HN       SER  61   6.011  -6.368  -5.351
  510    HA   SER  61           HA       SER  61   4.379  -7.185  -3.004
  511    HB2  SER  61           2HB      SER  61   5.371  -9.120  -4.349
  512    HB3  SER  61           3HB      SER  61   6.965  -8.540  -3.808
  513    HG   SER  61           HG       SER  61   6.086 -10.149  -2.419
  514    H    LEU  62           HN       LEU  62   4.744  -5.815  -1.413
  515    HA   LEU  62           HA       LEU  62   7.449  -4.596  -1.202
  516    HB2  LEU  62           2HB      LEU  62   4.712  -3.707  -0.291
  517    HB3  LEU  62           3HB      LEU  62   6.194  -3.035   0.429
  518    HG   LEU  62           HG       LEU  62   5.410  -1.508  -1.214
  519   HD11  LEU  62          1HD1      LEU  62   7.323  -1.407  -2.755
  520   HD12  LEU  62          2HD1      LEU  62   7.834  -1.825  -1.103
  521   HD13  LEU  62          3HD1      LEU  62   7.733  -3.091  -2.351
  522   HD21  LEU  62          3HD2      LEU  62   3.984  -3.021  -2.501
  523   HD22  LEU  62          1HD2      LEU  62   5.065  -2.104  -3.573
  524   HD23  LEU  62          2HD2      LEU  62   5.425  -3.804  -3.193
  525    H    ARG  63           HN       ARG  63   8.638  -4.798   0.669
  526    HA   ARG  63           HA       ARG  63   7.897  -6.953   2.438
  527    HB2  ARG  63           2HB      ARG  63  10.075  -4.873   2.799
  528    HB3  ARG  63           3HB      ARG  63   9.938  -6.441   3.633
  529    HG2  ARG  63           2HG      ARG  63   9.973  -7.392   1.179
  530    HG3  ARG  63           3HG      ARG  63  10.750  -5.831   0.815
  531    HD2  ARG  63           2HD      ARG  63  12.496  -7.388   1.260
  532    HD3  ARG  63           3HD      ARG  63  12.378  -6.325   2.678
  533    HE   ARG  63           HE       ARG  63  10.747  -8.448   3.310
  534   HH11  ARG  63          2HH1      ARG  63  14.116  -8.064   2.367
  535   HH12  ARG  63          1HH1      ARG  63  14.643  -9.511   3.197
  536   HH21  ARG  63          2HH2      ARG  63  11.426 -10.349   4.351
  537   HH22  ARG  63          1HH2      ARG  63  13.114 -10.809   4.323
  538    H    LYS  64           HN       LYS  64   7.655  -6.768   4.761
  539    HA   LYS  64           HA       LYS  64   5.460  -5.123   5.379
  540    HB2  LYS  64           2HB      LYS  64   5.890  -5.826   7.745
  541    HB3  LYS  64           3HB      LYS  64   5.843  -7.169   6.578
  542    HG2  LYS  64           2HG      LYS  64   8.294  -7.237   6.556
  543    HG3  LYS  64           3HG      LYS  64   8.344  -5.891   7.719
  544    HD2  LYS  64           2HD      LYS  64   7.216  -7.252   9.392
  545    HD3  LYS  64           3HD      LYS  64   7.049  -8.588   8.227
  546    HE2  LYS  64           2HE      LYS  64   9.478  -8.798   8.086
  547    HE3  LYS  64           3HE      LYS  64   9.680  -7.420   9.189
  548    HZ1  LYS  64           3HZ      LYS  64   8.395  -9.981   9.865
  549    HZ2  LYS  64           1HZ      LYS  64   9.905  -9.511  10.331
  550    HZ3  LYS  64           2HZ      LYS  64   8.583  -8.701  10.888
  551    H    SER  65           HN       SER  65   8.924  -4.575   5.860
  552    HA   SER  65           HA       SER  65   8.757  -2.433   7.705
  553    HB2  SER  65           2HB      SER  65  10.828  -2.785   5.511
  554    HB3  SER  65           3HB      SER  65  11.033  -1.970   7.080
  555    HG   SER  65           HG       SER  65  11.887  -4.106   7.069
  556    H    ALA  66           HN       ALA  66   8.615  -2.483   4.132
  557    HA   ALA  66           HA       ALA  66   8.561   0.409   3.951
  558    HB1  ALA  66           1HB      ALA  66   8.027   0.023   1.579
  559    HB2  ALA  66           2HB      ALA  66   9.401  -0.978   2.105
  560    HB3  ALA  66           3HB      ALA  66   7.788  -1.708   1.916
  561    H    ALA  67           HN       ALA  67   6.213  -2.205   4.178
  562    HA   ALA  67           HA       ALA  67   3.907  -0.782   3.369
  563    HB1  ALA  67           1HB      ALA  67   2.666  -2.525   4.587
  564    HB2  ALA  67           2HB      ALA  67   3.994  -3.223   3.631
  565    HB3  ALA  67           3HB      ALA  67   4.169  -3.031   5.392
  566    H    GLU  68           HN       GLU  68   5.447  -1.127   6.573
  567    HA   GLU  68           HA       GLU  68   3.340   0.374   7.891
  568    HB2  GLU  68           2HB      GLU  68   4.836   0.254   9.857
  569    HB3  GLU  68           3HB      GLU  68   4.521  -1.332   9.115
  570    HG2  GLU  68           2HG      GLU  68   6.706  -1.249   8.012
  571    HG3  GLU  68           3HG      GLU  68   7.021   0.334   8.755
  572    HE2  GLU  68           2HE      GLU  68   7.625  -1.116  11.874
  573    H    MET  69           HN       MET  69   6.004   1.230   5.971
  574    HA   MET  69           HA       MET  69   6.358   3.846   7.278
  575    HB2  MET  69           2HB      MET  69   7.651   2.498   4.899
  576    HB3  MET  69           3HB      MET  69   7.945   4.204   5.318
  577    HG2  MET  69           2HG      MET  69   8.819   3.541   7.490
  578    HG3  MET  69           3HG      MET  69   8.467   1.841   7.139
  579    HE1  MET  69           3HE      MET  69  10.957   1.152   7.714
  580    HE2  MET  69           1HE      MET  69  12.394   1.933   7.014
  581    HE3  MET  69           2HE      MET  69  11.326   2.849   8.103
  582    H    ILE  70           HN       ILE  70   4.311   2.395   5.014
  583    HA   ILE  70           HA       ILE  70   3.866   4.941   3.578
  584    HB   ILE  70           HB       ILE  70   2.674   2.184   3.084
  585   HG12  ILE  70          2HG1      ILE  70   5.014   2.119   2.609
  586   HG13  ILE  70          3HG1      ILE  70   4.149   2.245   1.058
  587   HG21  ILE  70          1HG2      ILE  70   1.907   3.135   0.944
  588   HG22  ILE  70          2HG2      ILE  70   1.208   4.007   2.328
  589   HG23  ILE  70          3HG2      ILE  70   2.560   4.721   1.416
  590   HD11  ILE  70          3HD1      ILE  70   5.514   4.518   2.523
  591   HD12  ILE  70          1HD1      ILE  70   6.143   3.686   1.085
  592   HD13  ILE  70          2HD1      ILE  70   4.650   4.641   0.971
  593    H    GLU  71           HN       GLU  71   2.197   6.218   3.989
  594    HA   GLU  71           HA       GLU  71   0.213   5.277   5.988
  595    HB2  GLU  71           2HB      GLU  71   1.476   7.291   6.551
  596    HB3  GLU  71           3HB      GLU  71   0.965   8.053   5.027
  597    HG2  GLU  71           2HG      GLU  71  -1.002   8.689   5.870
  598    HG3  GLU  71           3HG      GLU  71  -1.270   7.129   6.678
  599    HE2  GLU  71           2HE      GLU  71   0.975   9.639   8.793
  600    H    VAL  72           HN       VAL  72  -1.817   4.860   5.381
  601    HA   VAL  72           HA       VAL  72  -2.710   5.919   2.758
  602    HB   VAL  72           HB       VAL  72  -3.772   3.718   2.270
  603   HG11  VAL  72          1HG1      VAL  72  -1.714   2.553   1.588
  604   HG12  VAL  72          2HG1      VAL  72  -1.610   4.301   1.270
  605   HG13  VAL  72          3HG1      VAL  72  -0.766   3.599   2.671
  606   HG21  VAL  72          3HG2      VAL  72  -3.910   2.866   4.566
  607   HG22  VAL  72          1HG2      VAL  72  -3.057   1.716   3.512
  608   HG23  VAL  72          2HG2      VAL  72  -2.136   2.744   4.634
  609    H    GLU  73           HN       GLU  73  -5.109   5.340   2.436
  610    HA   GLU  73           HA       GLU  73  -6.611   5.409   4.989
  611    HB2  GLU  73           2HB      GLU  73  -6.371   7.741   4.321
  612    HB3  GLU  73           3HB      GLU  73  -6.949   7.356   2.682
  613    HG2  GLU  73           2HG      GLU  73  -8.691   8.433   3.996
  614    HG3  GLU  73           3HG      GLU  73  -9.142   6.764   3.586
  615    HE2  GLU  73           2HE      GLU  73  -8.856   7.772   7.370
  616    H    LEU  74           HN       LEU  74  -8.617   4.400   4.875
  617    HA   LEU  74           HA       LEU  74  -8.910   2.471   2.768
  618    HB2  LEU  74           2HB      LEU  74 -10.450   3.267   5.204
  619    HB3  LEU  74           3HB      LEU  74 -11.295   2.333   3.946
  620    HG   LEU  74           HG       LEU  74 -10.454   0.897   5.722
  621   HD11  LEU  74          1HD1      LEU  74  -9.250  -0.724   4.318
  622   HD12  LEU  74          2HD1      LEU  74 -10.608   0.019   3.441
  623   HD13  LEU  74          3HD1      LEU  74  -8.942   0.551   3.115
  624   HD21  LEU  74          3HD2      LEU  74  -8.543   2.251   6.432
  625   HD22  LEU  74          1HD2      LEU  74  -8.042   0.583   6.072
  626   HD23  LEU  74          2HD2      LEU  74  -7.706   1.882   4.905
  627    H    GLU  75           HN       GLU  75 -10.052   2.535   0.917
  628    HA   GLU  75           HA       GLU  75 -11.298   4.992   0.078
  629    HB2  GLU  75           2HB      GLU  75 -10.232   3.243  -1.415
  630    HB3  GLU  75           3HB      GLU  75 -11.677   2.243  -1.134
  631    HG2  GLU  75           2HG      GLU  75 -11.753   5.030  -2.313
  632    HG3  GLU  75           3HG      GLU  75 -11.662   3.544  -3.283
  633    HE2  GLU  75           2HE      GLU  75 -15.007   2.762  -2.583
  634    H    HIS  76           HN       HIS  76 -12.956   5.650   1.287
  635    HA   HIS  76           HA       HIS  76 -15.471   4.272   0.941
  636    HB2  HIS  76           2HB      HIS  76 -14.251   3.197   3.004
  637    HB3  HIS  76           3HB      HIS  76 -14.704   4.706   3.820
  638    HD1  HIS  76           1HD      HIS  76 -16.273   3.294   5.396
  639    HD2  HIS  76           2HD      HIS  76 -17.313   3.242   1.349
  640    HE1  HIS  76           1HE      HIS  76 -18.618   2.334   5.276
  641    HE2  HIS  76           2HE      HIS  76 -19.242   2.314   2.820
  642    H    HIS  77           HN       HIS  77 -15.420   6.333  -0.184
  643    HA   HIS  77           HA       HIS  77 -14.984   8.851   0.844
  644    HB2  HIS  77           2HB      HIS  77 -15.422   8.318  -1.509
  645    HB3  HIS  77           3HB      HIS  77 -17.115   7.956  -1.125
  646    HD1  HIS  77           1HD      HIS  77 -18.744   9.862  -1.120
  647    HD2  HIS  77           2HD      HIS  77 -14.768  11.126  -1.298
  648    HE1  HIS  77           1HE      HIS  77 -18.817  12.344  -1.603
  649    HE2  HIS  77           2HE      HIS  77 -16.400  13.114  -1.719
  650    H    HIS  78           HN       HIS  78 -15.697   9.729   2.654
  651    HA   HIS  78           HA       HIS  78 -18.646   9.746   3.073
  652    HB2  HIS  78           2HB      HIS  78 -16.413   9.300   5.023
  653    HB3  HIS  78           3HB      HIS  78 -17.839  10.208   5.562
  654    HD1  HIS  78           1HD      HIS  78 -16.566   6.894   5.540
  655    HD2  HIS  78           2HD      HIS  78 -20.325   8.581   4.856
  656    HE1  HIS  78           1HE      HIS  78 -18.254   5.041   5.918
  657    HE2  HIS  78           2HE      HIS  78 -20.531   6.073   5.509
  658    H    HIS  79           HN       HIS  79 -19.548  11.658   3.832
  659    HA   HIS  79           HA       HIS  79 -17.701  13.976   4.087
  660    HB2  HIS  79           2HB      HIS  79 -20.265  13.734   2.538
  661    HB3  HIS  79           3HB      HIS  79 -19.839  15.283   3.288
  662    HD1  HIS  79           1HD      HIS  79 -20.001  14.897   0.191
  663    HD2  HIS  79           2HD      HIS  79 -16.510  14.674   2.475
  664    HE1  HIS  79           1HE      HIS  79 -18.086  15.433  -1.383
  665    HE2  HIS  79           2HE      HIS  79 -15.972  15.295   0.012
  666    H    HIS  80           HN       HIS  80 -17.644  14.213   6.239
  667    HA   HIS  80           HA       HIS  80 -20.122  14.998   7.565
  668    HB2  HIS  80           2HB      HIS  80 -20.062  12.488   7.763
  669    HB3  HIS  80           3HB      HIS  80 -18.531  12.647   8.645
  670    HD1  HIS  80           1HD      HIS  80 -18.624  13.422  11.089
  671    HD2  HIS  80           2HD      HIS  80 -22.352  13.314   9.204
  672    HE1  HIS  80           1HE      HIS  80 -20.351  13.685  12.923
  673    HE2  HIS  80           2HE      HIS  80 -22.611  13.617  11.773
  674    H    HIS  81           HN       HIS  81 -19.745  16.357   9.255
  675    HA   HIS  81           HA       HIS  81 -16.887  16.772  10.000
  676    HB2  HIS  81           2HB      HIS  81 -19.152  18.795   9.907
  677    HB3  HIS  81           3HB      HIS  81 -17.516  19.113  10.512
  678    HD1  HIS  81           1HD      HIS  81 -18.924  20.570   8.040
  679    HD2  HIS  81           2HD      HIS  81 -16.097  17.498   7.839
  680    HE1  HIS  81           1HE      HIS  81 -17.836  20.755   5.757
  681    HE2  HIS  81           2HE      HIS  81 -16.120  18.890   5.648
  Start of MODEL   13
    1    H1   MET   1           HN       MET   1  -1.020   3.880  14.093
    2    HA   MET   1           HA       MET   1  -0.758   6.030  12.248
    3    HB2  MET   1           2HB      MET   1   1.099   5.329  10.861
    4    HB3  MET   1           3HB      MET   1   1.671   5.610  12.523
    5    HG2  MET   1           2HG      MET   1   1.507   3.120  12.887
    6    HG3  MET   1           3HG      MET   1   1.204   2.955  11.150
    7    HE1  MET   1           3HE      MET   1   3.102   5.385  10.075
    8    HE2  MET   1           1HE      MET   1   4.574   4.475   9.668
    9    HE3  MET   1           2HE      MET   1   2.977   3.801   9.273
   10    H    PHE   2           HN       PHE   2  -1.342   5.371  10.026
   11    HA   PHE   2           HA       PHE   2  -2.479   2.621   9.947
   12    HB2  PHE   2           2HB      PHE   2  -4.245   4.360  10.386
   13    HB3  PHE   2           3HB      PHE   2  -3.837   5.090   8.824
   14    HD1  PHE   2           1HD      PHE   2  -5.098   1.983  10.425
   15    HD2  PHE   2           2HD      PHE   2  -4.725   4.209   6.813
   16    HE1  PHE   2           1HE      PHE   2  -6.635   0.426   9.308
   17    HE2  PHE   2           2HE      PHE   2  -6.261   2.655   5.693
   18    HZ   PHE   2           HZ       PHE   2  -7.216   0.757   6.939
   19    H    SER   3           HN       SER   3  -0.876   1.803   8.701
   20    HA   SER   3           HA       SER   3  -0.387   3.194   6.119
   21    HB2  SER   3           2HB      SER   3   1.441   1.353   7.704
   22    HB3  SER   3           3HB      SER   3   1.833   2.143   6.158
   23    HG   SER   3           HG       SER   3   2.620   3.309   7.977
   24    H    LEU   4           HN       LEU   4   0.766   1.378   4.624
   25    HA   LEU   4           HA       LEU   4  -1.389  -0.220   3.705
   26    HB2  LEU   4           2HB      LEU   4   0.610   0.707   2.439
   27    HB3  LEU   4           3HB      LEU   4   1.550  -0.640   3.125
   28    HG   LEU   4           HG       LEU   4   0.097  -2.245   2.000
   29   HD11  LEU   4          1HD1      LEU   4  -1.581  -1.482   0.367
   30   HD12  LEU   4          2HD1      LEU   4  -1.974  -0.926   2.010
   31   HD13  LEU   4          3HD1      LEU   4  -1.265   0.205   0.834
   32   HD21  LEU   4          3HD2      LEU   4   2.099  -1.410   0.853
   33   HD22  LEU   4          1HD2      LEU   4   0.799  -1.766  -0.308
   34   HD23  LEU   4          2HD2      LEU   4   1.147  -0.082   0.148
   35    H    ARG   5           HN       ARG   5   1.048  -0.780   6.102
   36    HA   ARG   5           HA       ARG   5   0.888  -3.684   6.019
   37    HB2  ARG   5           2HB      ARG   5   2.370  -3.614   7.899
   38    HB3  ARG   5           3HB      ARG   5   2.887  -2.333   6.776
   39    HG2  ARG   5           2HG      ARG   5   2.948  -1.063   8.628
   40    HG3  ARG   5           3HG      ARG   5   1.187  -0.951   8.387
   41    HD2  ARG   5           2HD      ARG   5   1.151  -3.169   9.798
   42    HD3  ARG   5           3HD      ARG   5   2.751  -2.617  10.341
   43    HE   ARG   5           HE       ARG   5   0.526  -0.698  10.513
   44   HH11  ARG   5          2HH1      ARG   5   2.787  -2.857  12.132
   45   HH12  ARG   5          1HH1      ARG   5   2.390  -2.270  13.731
   46   HH21  ARG   5          2HH2      ARG   5  -0.043   0.001  12.586
   47   HH22  ARG   5          1HH2      ARG   5   0.782  -0.646  13.988
   48    H    ASP   6           HN       ASP   6  -1.147  -1.221   7.166
   49    HA   ASP   6           HA       ASP   6  -2.053  -2.728   9.531
   50    HB2  ASP   6           2HB      ASP   6  -2.793  -0.006   8.407
   51    HB3  ASP   6           3HB      ASP   6  -3.571  -0.728   9.832
   52    HD2  ASP   6           2HD      ASP   6   0.136   0.653  10.208
   53    H    ALA   7           HN       ALA   7  -2.867  -2.382   6.213
   54    HA   ALA   7           HA       ALA   7  -5.739  -2.695   6.614
   55    HB1  ALA   7           1HB      ALA   7  -5.841  -2.673   4.156
   56    HB2  ALA   7           2HB      ALA   7  -4.864  -1.324   4.780
   57    HB3  ALA   7           3HB      ALA   7  -4.066  -2.754   4.083
   58    H    LYS   8           HN       LYS   8  -6.756  -4.360   4.913
   59    HA   LYS   8           HA       LYS   8  -5.680  -7.000   5.771
   60    HB2  LYS   8           2HB      LYS   8  -8.491  -6.298   4.852
   61    HB3  LYS   8           3HB      LYS   8  -7.938  -7.867   5.486
   62    HG2  LYS   8           2HG      LYS   8  -9.051  -6.939   7.294
   63    HG3  LYS   8           3HG      LYS   8  -7.351  -6.533   7.629
   64    HD2  LYS   8           2HD      LYS   8  -7.688  -4.283   6.738
   65    HD3  LYS   8           3HD      LYS   8  -9.372  -4.682   6.323
   66    HE2  LYS   8           2HE      LYS   8  -8.195  -4.666   9.120
   67    HE3  LYS   8           3HE      LYS   8  -9.208  -3.386   8.416
   68    HZ1  LYS   8           3HZ      LYS   8 -10.038  -6.174   8.868
   69    HZ2  LYS   8           1HZ      LYS   8 -10.485  -4.878   9.784
   70    HZ3  LYS   8           2HZ      LYS   8 -10.978  -4.986   8.215
   71    H    CYS   9           HN       CYS   9  -6.772  -8.748   4.101
   72    HA   CYS   9           HA       CYS   9  -5.381  -8.194   1.591
   73    HB2  CYS   9           2HB      CYS   9  -7.045 -10.604   2.373
   74    HB3  CYS   9           3HB      CYS   9  -5.840 -10.498   1.064
   75    HG   CYS   9           HG       CYS   9  -4.947 -12.037   2.974
   76    H    GLY  10           HN       GLY  10  -6.284  -7.903  -0.425
   77    HA2  GLY  10           1HA      GLY  10  -7.952  -7.771  -2.028
   78    HA3  GLY  10           2HA      GLY  10  -9.124  -8.380  -0.839
   79    H    GLN  11           HN       GLN  11  -7.405  -5.813   0.484
   80    HA   GLN  11           HA       GLN  11  -9.796  -4.135   0.239
   81    HB2  GLN  11           2HB      GLN  11  -7.234  -3.803   1.829
   82    HB3  GLN  11           3HB      GLN  11  -8.636  -2.710   1.908
   83    HG2  GLN  11           2HG      GLN  11  -8.638  -5.648   2.639
   84    HG3  GLN  11           3HG      GLN  11  -8.573  -4.291   3.784
   85   HE21  GLN  11          1HE2      GLN  11 -10.431  -2.622   2.211
   86   HE22  GLN  11          2HE2      GLN  11 -12.021  -3.307   2.479
   87    H    THR  12           HN       THR  12  -9.890  -2.087  -0.616
   88    HA   THR  12           HA       THR  12  -7.587  -1.328  -2.330
   89    HB   THR  12           HB       THR  12 -10.443  -0.268  -2.353
   90    HG1  THR  12           1HG      THR  12 -10.598  -1.565  -4.262
   91   HG21  THR  12          3HG2      THR  12  -8.158   0.064  -4.329
   92   HG22  THR  12          1HG2      THR  12  -9.810   0.688  -4.539
   93   HG23  THR  12          2HG2      THR  12  -8.781   1.320  -3.234
   94    H    VAL  13           HN       VAL  13  -6.204  -0.065  -1.237
   95    HA   VAL  13           HA       VAL  13  -7.372   2.032   0.526
   96    HB   VAL  13           HB       VAL  13  -5.183   2.061   1.687
   97   HG11  VAL  13          1HG1      VAL  13  -5.393  -0.092   2.852
   98   HG12  VAL  13          2HG1      VAL  13  -6.983   0.647   2.555
   99   HG13  VAL  13          3HG1      VAL  13  -6.423  -0.702   1.537
  100   HG21  VAL  13          3HG2      VAL  13  -3.785   1.320  -0.183
  101   HG22  VAL  13          1HG2      VAL  13  -3.525   0.299   1.251
  102   HG23  VAL  13          2HG2      VAL  13  -4.518  -0.300  -0.098
  103    H    LYS  14           HN       LYS  14  -6.181   4.082   0.614
  104    HA   LYS  14           HA       LYS  14  -4.814   4.641  -1.972
  105    HB2  LYS  14           2HB      LYS  14  -6.690   6.393  -0.363
  106    HB3  LYS  14           3HB      LYS  14  -5.737   6.949  -1.759
  107    HG2  LYS  14           2HG      LYS  14  -6.867   5.223  -3.150
  108    HG3  LYS  14           3HG      LYS  14  -7.891   4.820  -1.751
  109    HD2  LYS  14           2HD      LYS  14  -9.112   6.310  -3.179
  110    HD3  LYS  14           3HD      LYS  14  -8.652   7.196  -1.705
  111    HE2  LYS  14           2HE      LYS  14  -6.783   8.233  -2.893
  112    HE3  LYS  14           3HE      LYS  14  -7.192   7.319  -4.361
  113    HZ1  LYS  14           3HZ      LYS  14  -8.921   9.306  -3.043
  114    HZ2  LYS  14           1HZ      LYS  14  -8.063   9.548  -4.430
  115    HZ3  LYS  14           2HZ      LYS  14  -9.300   8.458  -4.406
  116    H    VAL  15           HN       VAL  15  -3.026   5.927  -1.966
  117    HA   VAL  15           HA       VAL  15  -1.577   5.898   0.559
  118    HB   VAL  15           HB       VAL  15  -0.755   6.963  -2.169
  119   HG11  VAL  15          1HG1      VAL  15   1.546   6.799  -1.317
  120   HG12  VAL  15          2HG1      VAL  15   0.572   7.927  -0.349
  121   HG13  VAL  15          3HG1      VAL  15   0.921   6.296   0.270
  122   HG21  VAL  15          3HG2      VAL  15  -1.293   4.574  -2.212
  123   HG22  VAL  15          1HG2      VAL  15   0.456   4.838  -2.403
  124   HG23  VAL  15          2HG2      VAL  15  -0.194   4.296  -0.839
  125    H    VAL  16           HN       VAL  16  -1.175   7.558   1.926
  126    HA   VAL  16           HA       VAL  16  -2.026  10.243   0.978
  127    HB   VAL  16           HB       VAL  16  -2.466  10.796   3.401
  128   HG11  VAL  16          1HG1      VAL  16  -4.685   9.730   3.425
  129   HG12  VAL  16          2HG1      VAL  16  -4.269  10.335   1.804
  130   HG13  VAL  16          3HG1      VAL  16  -4.150   8.595   2.163
  131   HG21  VAL  16          3HG2      VAL  16  -1.196   8.973   4.431
  132   HG22  VAL  16          1HG2      VAL  16  -2.894   8.940   4.957
  133   HG23  VAL  16          2HG2      VAL  16  -2.321   7.785   3.732
  134    H    LYS  17           HN       LYS  17   0.286   8.487   3.065
  135    HA   LYS  17           HA       LYS  17   2.181  10.714   2.551
  136    HB2  LYS  17           2HB      LYS  17   1.562   9.452   5.233
  137    HB3  LYS  17           3HB      LYS  17   3.052  10.368   4.908
  138    HG2  LYS  17           2HG      LYS  17   1.619  12.326   4.280
  139    HG3  LYS  17           3HG      LYS  17   0.204  11.396   4.829
  140    HD2  LYS  17           2HD      LYS  17   2.617  12.012   6.562
  141    HD3  LYS  17           3HD      LYS  17   1.132  12.992   6.532
  142    HE2  LYS  17           2HE      LYS  17  -0.181  11.091   7.284
  143    HE3  LYS  17           3HE      LYS  17   1.247  10.037   7.208
  144    HZ1  LYS  17           3HZ      LYS  17   0.925  12.362   8.986
  145    HZ2  LYS  17           1HZ      LYS  17   0.809  10.781   9.440
  146    HZ3  LYS  17           2HZ      LYS  17   2.251  11.383   8.916
  147    H    LEU  18           HN       LEU  18   4.466  10.068   2.963
  148    HA   LEU  18           HA       LEU  18   4.842   7.147   2.612
  149    HB2  LEU  18           2HB      LEU  18   5.883   9.345   0.817
  150    HB3  LEU  18           3HB      LEU  18   6.587   7.711   0.861
  151    HG   LEU  18           HG       LEU  18   3.739   8.417   0.087
  152   HD11  LEU  18          1HD1      LEU  18   4.431   7.686  -2.160
  153   HD12  LEU  18          2HD1      LEU  18   5.406   9.063  -1.597
  154   HD13  LEU  18          3HD1      LEU  18   6.085   7.418  -1.562
  155   HD21  LEU  18          3HD2      LEU  18   3.890   6.237   1.215
  156   HD22  LEU  18          1HD2      LEU  18   3.545   6.036  -0.519
  157   HD23  LEU  18          2HD2      LEU  18   5.188   5.746   0.099
  158    H    HIS  19           HN       HIS  19   6.043   6.515   4.224
  159    HA   HIS  19           HA       HIS  19   8.018   8.319   5.452
  160    HB2  HIS  19           2HB      HIS  19   7.239   5.453   6.116
  161    HB3  HIS  19           3HB      HIS  19   8.303   6.491   7.084
  162    HD1  HIS  19           1HD      HIS  19   7.222   7.740   8.919
  163    HD2  HIS  19           2HD      HIS  19   4.476   6.554   6.003
  164    HE1  HIS  19           1HE      HIS  19   4.932   8.348   9.816
  165    HE2  HIS  19           2HE      HIS  19   3.267   7.624   8.042
  166    H    GLY  20           HN       GLY  20  10.186   7.132   6.089
  167    HA2  GLY  20           1HA      GLY  20  11.503   5.114   5.287
  168    HA3  GLY  20           2HA      GLY  20  11.123   5.699   3.651
  169    H    THR  21           HN       THR  21  13.656   5.339   4.003
  170    HA   THR  21           HA       THR  21  14.961   7.692   5.170
  171    HB   THR  21           HB       THR  21  17.046   6.449   4.331
  172    HG1  THR  21           1HG      THR  21  16.631   4.243   3.767
  173   HG21  THR  21          3HG2      THR  21  15.163   4.968   6.203
  174   HG22  THR  21          1HG2      THR  21  16.924   4.738   6.104
  175   HG23  THR  21          2HG2      THR  21  16.262   6.292   6.659
  176    H    GLY  22           HN       GLY  22  13.208   7.922   2.715
  177    HA2  GLY  22           1HA      GLY  22  13.390   9.435   0.932
  178    HA3  GLY  22           2HA      GLY  22  15.162   9.405   1.094
  179    H    ALA  23           HN       ALA  23  15.951   6.923   0.796
  180    HA   ALA  23           HA       ALA  23  15.671   6.368  -1.962
  181    HB1  ALA  23           1HB      ALA  23  16.858   4.270  -1.455
  182    HB2  ALA  23           2HB      ALA  23  17.600   5.654  -0.617
  183    HB3  ALA  23           3HB      ALA  23  16.560   4.523   0.281
  184    H    LEU  24           HN       LEU  24  14.080   4.954   0.907
  185    HA   LEU  24           HA       LEU  24  12.597   2.977  -0.515
  186    HB2  LEU  24           2HB      LEU  24  12.318   4.330   2.150
  187    HB3  LEU  24           3HB      LEU  24  10.999   3.306   1.535
  188    HG   LEU  24           HG       LEU  24  12.390   2.034   3.031
  189   HD11  LEU  24          1HD1      LEU  24  12.999   0.162   1.554
  190   HD12  LEU  24          2HD1      LEU  24  11.434   0.874   1.097
  191   HD13  LEU  24          3HD1      LEU  24  12.891   1.243   0.145
  192   HD21  LEU  24          3HD2      LEU  24  14.457   3.329   2.833
  193   HD22  LEU  24          1HD2      LEU  24  14.764   1.597   2.573
  194   HD23  LEU  24          2HD2      LEU  24  14.698   2.704   1.183
  195    H    LYS  25           HN       LYS  25  11.781   6.311   0.510
  196    HA   LYS  25           HA       LYS  25   9.152   6.446  -0.443
  197    HB2  LYS  25           2HB      LYS  25  11.301   8.593  -0.515
  198    HB3  LYS  25           3HB      LYS  25   9.551   8.873  -0.680
  199    HG2  LYS  25           2HG      LYS  25   9.172   8.121   1.585
  200    HG3  LYS  25           3HG      LYS  25  10.889   7.683   1.761
  201    HD2  LYS  25           2HD      LYS  25  11.544  10.014   1.513
  202    HD3  LYS  25           3HD      LYS  25   9.852  10.485   1.222
  203    HE2  LYS  25           2HE      LYS  25   9.245   9.761   3.476
  204    HE3  LYS  25           3HE      LYS  25  10.912   9.223   3.771
  205    HZ1  LYS  25           3HZ      LYS  25  10.075  11.995   3.239
  206    HZ2  LYS  25           1HZ      LYS  25  10.496  11.385   4.711
  207    HZ3  LYS  25           2HZ      LYS  25  11.623  11.495   3.513
  208    H    ARG  26           HN       ARG  26  12.209   7.163  -2.145
  209    HA   ARG  26           HA       ARG  26  11.080   7.853  -4.641
  210    HB2  ARG  26           2HB      ARG  26  13.469   8.166  -3.869
  211    HB3  ARG  26           3HB      ARG  26  13.721   6.435  -4.197
  212    HG2  ARG  26           2HG      ARG  26  13.250   6.748  -6.534
  213    HG3  ARG  26           3HG      ARG  26  12.774   8.440  -6.259
  214    HD2  ARG  26           2HD      ARG  26  15.538   7.257  -5.855
  215    HD3  ARG  26           3HD      ARG  26  15.028   8.312  -7.192
  216    HE   ARG  26           HE       ARG  26  14.664   9.402  -4.495
  217   HH11  ARG  26          2HH1      ARG  26  16.670   9.207  -7.387
  218   HH12  ARG  26          1HH1      ARG  26  17.581  10.648  -6.999
  219   HH21  ARG  26          2HH2      ARG  26  15.862  11.255  -3.991
  220   HH22  ARG  26          1HH2      ARG  26  17.122  11.811  -5.070
  221    H    ARG  27           HN       ARG  27  12.397   4.740  -3.467
  222    HA   ARG  27           HA       ARG  27  11.940   3.221  -5.777
  223    HB2  ARG  27           2HB      ARG  27  13.252   2.367  -3.955
  224    HB3  ARG  27           3HB      ARG  27  11.866   2.466  -2.842
  225    HG2  ARG  27           2HG      ARG  27  10.715   0.792  -4.386
  226    HG3  ARG  27           3HG      ARG  27  12.316   0.544  -5.122
  227    HD2  ARG  27           2HD      ARG  27  11.913   0.362  -2.142
  228    HD3  ARG  27           3HD      ARG  27  11.574  -1.022  -3.203
  229    HE   ARG  27           HE       ARG  27  14.245   0.292  -3.183
  230   HH11  ARG  27          2HH1      ARG  27  12.189  -2.568  -3.054
  231   HH12  ARG  27          1HH1      ARG  27  13.526  -3.679  -2.876
  232   HH21  ARG  27          2HH2      ARG  27  15.985  -1.175  -2.868
  233   HH22  ARG  27          1HH2      ARG  27  15.671  -2.892  -2.770
  234    H    ILE  28           HN       ILE  28   9.791   3.759  -2.969
  235    HA   ILE  28           HA       ILE  28   7.616   2.216  -3.872
  236    HB   ILE  28           HB       ILE  28   7.742   4.685  -2.102
  237   HG12  ILE  28          2HG1      ILE  28   7.346   1.754  -1.423
  238   HG13  ILE  28          3HG1      ILE  28   8.913   2.597  -1.369
  239   HG21  ILE  28          1HG2      ILE  28   5.482   4.104  -1.328
  240   HG22  ILE  28          2HG2      ILE  28   5.494   4.501  -3.062
  241   HG23  ILE  28          3HG2      ILE  28   5.403   2.802  -2.538
  242   HD11  ILE  28          3HD1      ILE  28   6.469   3.275   0.288
  243   HD12  ILE  28          1HD1      ILE  28   7.915   2.426   0.873
  244   HD13  ILE  28          2HD1      ILE  28   8.037   4.116   0.342
  245    H    MET  29           HN       MET  29   8.282   5.725  -4.341
  246    HA   MET  29           HA       MET  29   5.961   6.248  -5.902
  247    HB2  MET  29           2HB      MET  29   8.687   7.583  -5.918
  248    HB3  MET  29           3HB      MET  29   7.237   8.223  -6.729
  249    HG2  MET  29           2HG      MET  29   6.110   8.428  -4.569
  250    HG3  MET  29           3HG      MET  29   7.533   7.763  -3.750
  251    HE1  MET  29           3HE      MET  29   7.787   9.791  -2.121
  252    HE2  MET  29           1HE      MET  29   7.741  11.494  -2.629
  253    HE3  MET  29           2HE      MET  29   6.293  10.478  -2.803
  254    H    ASP  30           HN       ASP  30   9.250   5.249  -6.770
  255    HA   ASP  30           HA       ASP  30   9.015   5.510  -9.583
  256    HB2  ASP  30           2HB      ASP  30  11.163   5.318  -8.463
  257    HB3  ASP  30           3HB      ASP  30  10.746   3.697  -7.866
  258    HD2  ASP  30           2HD      ASP  30  11.678   2.221 -10.839
  259    H    MET  31           HN       MET  31   8.003   2.968  -7.363
  260    HA   MET  31           HA       MET  31   7.577   1.016  -9.476
  261    HB2  MET  31           2HB      MET  31   6.727   1.122  -6.567
  262    HB3  MET  31           3HB      MET  31   6.375  -0.242  -7.654
  263    HG2  MET  31           2HG      MET  31   8.791  -0.572  -8.001
  264    HG3  MET  31           3HG      MET  31   9.129   0.769  -6.894
  265    HE1  MET  31           3HE      MET  31   6.780   0.275  -4.717
  266    HE2  MET  31           1HE      MET  31   7.672  -0.664  -3.497
  267    HE3  MET  31           2HE      MET  31   8.448   0.726  -4.289
  268    H    GLY  32           HN       GLY  32   5.964   3.826  -8.587
  269    HA2  GLY  32           1HA      GLY  32   4.099   4.471  -9.990
  270    HA3  GLY  32           2HA      GLY  32   3.520   2.790  -9.933
  271    H    ILE  33           HN       ILE  33   4.649   3.646  -6.894
  272    HA   ILE  33           HA       ILE  33   1.858   3.984  -5.996
  273    HB   ILE  33           HB       ILE  33   4.366   3.497  -4.346
  274   HG12  ILE  33          2HG1      ILE  33   2.244   1.525  -5.257
  275   HG13  ILE  33          3HG1      ILE  33   3.872   1.672  -5.962
  276   HG21  ILE  33          1HG2      ILE  33   2.774   2.849  -2.585
  277   HG22  ILE  33          2HG2      ILE  33   2.520   4.532  -3.103
  278   HG23  ILE  33          3HG2      ILE  33   1.418   3.252  -3.663
  279   HD11  ILE  33          3HD1      ILE  33   3.236   0.912  -3.100
  280   HD12  ILE  33          1HD1      ILE  33   3.755  -0.207  -4.377
  281   HD13  ILE  33          2HD1      ILE  33   4.863   1.058  -3.806
  282    H    THR  34           HN       THR  34   1.362   6.092  -6.342
  283    HA   THR  34           HA       THR  34   3.073   8.101  -4.962
  284    HB   THR  34           HB       THR  34   1.790   9.724  -6.511
  285    HG1  THR  34           1HG      THR  34   1.021   8.685  -8.430
  286   HG21  THR  34          3HG2      THR  34   3.700   7.705  -7.741
  287   HG22  THR  34          1HG2      THR  34   3.340   9.322  -8.389
  288   HG23  THR  34          2HG2      THR  34   4.165   9.155  -6.822
  289    H    ARG  35           HN       ARG  35   1.685  10.115  -4.324
  290    HA   ARG  35           HA       ARG  35  -0.237   9.120  -2.411
  291    HB2  ARG  35           2HB      ARG  35   0.404  11.975  -3.206
  292    HB3  ARG  35           3HB      ARG  35  -0.496  11.458  -1.761
  293    HG2  ARG  35           2HG      ARG  35   1.547  10.258  -0.990
  294    HG3  ARG  35           3HG      ARG  35   2.424  10.951  -2.375
  295    HD2  ARG  35           2HD      ARG  35   1.751  13.229  -1.550
  296    HD3  ARG  35           3HD      ARG  35   1.106  12.446  -0.092
  297    HE   ARG  35           HE       ARG  35   3.955  12.080  -0.857
  298   HH11  ARG  35          2HH1      ARG  35   1.480  13.098   1.429
  299   HH12  ARG  35          1HH1      ARG  35   2.621  13.435   2.710
  300   HH21  ARG  35          2HH2      ARG  35   5.444  12.563   0.812
  301   HH22  ARG  35          1HH2      ARG  35   4.866  13.133   2.361
  302    H    GLY  36           HN       GLY  36  -2.275   8.628  -2.833
  303    HA2  GLY  36           1HA      GLY  36  -4.446   9.568  -3.455
  304    HA3  GLY  36           2HA      GLY  36  -3.663  10.280  -4.885
  305    H    CYS  37           HN       CYS  37  -2.119   7.514  -4.975
  306    HA   CYS  37           HA       CYS  37  -3.893   6.429  -6.969
  307    HB2  CYS  37           2HB      CYS  37  -2.254   4.671  -7.234
  308    HB3  CYS  37           3HB      CYS  37  -1.449   6.258  -7.141
  309    HG   CYS  37           HG       CYS  37   0.055   4.431  -6.037
  310    H    GLU  38           HN       GLU  38  -5.098   4.569  -6.970
  311    HA   GLU  38           HA       GLU  38  -5.914   3.600  -4.301
  312    HB2  GLU  38           2HB      GLU  38  -7.040   3.122  -7.080
  313    HB3  GLU  38           3HB      GLU  38  -7.751   2.525  -5.561
  314    HG2  GLU  38           2HG      GLU  38  -8.348   4.677  -4.858
  315    HG3  GLU  38           3HG      GLU  38  -7.253   5.460  -6.018
  316    HE2  GLU  38           2HE      GLU  38 -10.808   4.255  -7.310
  317    H    ILE  39           HN       ILE  39  -4.889   1.916  -3.476
  318    HA   ILE  39           HA       ILE  39  -3.566   0.038  -5.348
  319    HB   ILE  39           HB       ILE  39  -3.059   0.575  -2.393
  320   HG12  ILE  39          2HG1      ILE  39  -1.421   1.218  -4.865
  321   HG13  ILE  39          3HG1      ILE  39  -2.310   2.386  -3.857
  322   HG21  ILE  39          1HG2      ILE  39  -1.122  -0.923  -2.649
  323   HG22  ILE  39          2HG2      ILE  39  -2.649  -1.775  -2.981
  324   HG23  ILE  39          3HG2      ILE  39  -1.604  -1.261  -4.328
  325   HD11  ILE  39          3HD1      ILE  39   0.027   0.679  -2.960
  326   HD12  ILE  39          1HD1      ILE  39   0.096   2.413  -3.339
  327   HD13  ILE  39          2HD1      ILE  39  -0.862   1.848  -1.954
  328    H    TYR  40           HN       TYR  40  -4.668  -1.728  -5.737
  329    HA   TYR  40           HA       TYR  40  -6.431  -2.928  -3.739
  330    HB2  TYR  40           2HB      TYR  40  -7.056  -3.074  -6.073
  331    HB3  TYR  40           3HB      TYR  40  -5.499  -3.810  -6.490
  332    HD1  TYR  40           1HD      TYR  40  -8.707  -4.396  -4.702
  333    HD2  TYR  40           2HD      TYR  40  -5.154  -6.159  -6.258
  334    HE1  TYR  40           1HE      TYR  40  -9.665  -6.632  -4.361
  335    HE2  TYR  40           2HE      TYR  40  -6.108  -8.391  -5.918
  336    HH   TYR  40           HH       TYR  40  -7.885  -9.604  -5.199
  337    H    ILE  41           HN       ILE  41  -5.586  -3.999  -2.066
  338    HA   ILE  41           HA       ILE  41  -2.921  -5.144  -2.220
  339    HB   ILE  41           HB       ILE  41  -5.027  -5.473  -0.047
  340   HG12  ILE  41          2HG1      ILE  41  -2.765  -3.464  -0.293
  341   HG13  ILE  41          3HG1      ILE  41  -4.498  -3.107  -0.489
  342   HG21  ILE  41          1HG2      ILE  41  -3.094  -6.011   1.383
  343   HG22  ILE  41          2HG2      ILE  41  -3.225  -7.147   0.019
  344   HG23  ILE  41          3HG2      ILE  41  -2.011  -5.846  -0.018
  345   HD11  ILE  41          3HD1      ILE  41  -3.161  -4.103   2.039
  346   HD12  ILE  41          1HD1      ILE  41  -3.697  -2.436   1.737
  347   HD13  ILE  41          2HD1      ILE  41  -4.893  -3.745   1.843
  348    H    ARG  42           HN       ARG  42  -2.437  -7.090  -3.005
  349    HA   ARG  42           HA       ARG  42  -4.595  -8.845  -3.849
  350    HB2  ARG  42           2HB      ARG  42  -2.565  -8.489  -5.221
  351    HB3  ARG  42           3HB      ARG  42  -1.578  -9.223  -3.933
  352    HG2  ARG  42           2HG      ARG  42  -1.863 -10.947  -5.482
  353    HG3  ARG  42           3HG      ARG  42  -3.079 -11.292  -4.228
  354    HD2  ARG  42           2HD      ARG  42  -4.241 -11.589  -6.242
  355    HD3  ARG  42           3HD      ARG  42  -4.707  -9.958  -5.712
  356    HE   ARG  42           HE       ARG  42  -2.403 -10.030  -7.492
  357   HH11  ARG  42          2HH1      ARG  42  -5.918  -9.854  -7.273
  358   HH12  ARG  42          1HH1      ARG  42  -6.102  -9.123  -8.850
  359   HH21  ARG  42          2HH2      ARG  42  -2.658  -9.093  -9.547
  360   HH22  ARG  42          1HH2      ARG  42  -4.255  -8.692 -10.138
  361    H    LYS  43           HN       LYS  43  -1.722  -9.243  -1.713
  362    HA   LYS  43           HA       LYS  43  -3.255 -11.213  -0.127
  363    HB2  LYS  43           2HB      LYS  43  -0.559 -11.800  -1.409
  364    HB3  LYS  43           3HB      LYS  43  -1.403 -12.843  -0.239
  365    HG2  LYS  43           2HG      LYS  43  -2.480 -12.101  -2.970
  366    HG3  LYS  43           3HG      LYS  43  -1.594 -13.600  -2.601
  367    HD2  LYS  43           2HD      LYS  43  -3.309 -14.273  -1.022
  368    HD3  LYS  43           3HD      LYS  43  -4.168 -12.731  -1.252
  369    HE2  LYS  43           2HE      LYS  43  -4.579 -13.287  -3.597
  370    HE3  LYS  43           3HE      LYS  43  -3.666 -14.800  -3.416
  371    HZ1  LYS  43           3HZ      LYS  43  -6.152 -14.120  -1.995
  372    HZ2  LYS  43           1HZ      LYS  43  -6.027 -15.163  -3.265
  373    HZ3  LYS  43           2HZ      LYS  43  -5.304 -15.525  -1.827
  374    H    VAL  44           HN       VAL  44  -2.838 -11.039   1.989
  375    HA   VAL  44           HA       VAL  44  -0.240  -9.808   2.784
  376    HB   VAL  44           HB       VAL  44  -2.879  -9.684   4.299
  377   HG11  VAL  44          1HG1      VAL  44  -1.682  -8.187   5.842
  378   HG12  VAL  44          2HG1      VAL  44  -0.927  -9.796   5.781
  379   HG13  VAL  44          3HG1      VAL  44  -0.184  -8.430   4.914
  380   HG21  VAL  44          3HG2      VAL  44  -2.884  -8.225   2.332
  381   HG22  VAL  44          1HG2      VAL  44  -2.822  -7.272   3.833
  382   HG23  VAL  44          2HG2      VAL  44  -1.349  -7.496   2.863
  383    H    ALA  45           HN       ALA  45   1.063 -11.142   3.895
  384    HA   ALA  45           HA       ALA  45   0.187 -13.827   4.458
  385    HB1  ALA  45           1HB      ALA  45   2.469 -14.136   5.319
  386    HB2  ALA  45           2HB      ALA  45   2.474 -13.309   3.744
  387    HB3  ALA  45           3HB      ALA  45   2.735 -12.378   5.238
  388    HA   PRO  46           HA       PRO  46  -1.371 -13.395   8.569
  389    HB2  PRO  46           2HB      PRO  46  -0.605 -15.885   9.587
  390    HB3  PRO  46           3HB      PRO  46  -2.008 -15.604   8.505
  391    HG2  PRO  46           2HG      PRO  46   0.736 -16.522   7.797
  392    HG3  PRO  46           3HG      PRO  46  -0.841 -17.180   7.254
  393    HD2  PRO  46           2HD      PRO  46   0.629 -15.545   5.695
  394    HD3  PRO  46           3HD      PRO  46  -1.152 -15.385   5.764
  395    H    LEU  47           HN       LEU  47   1.970 -14.203   7.905
  396    HA   LEU  47           HA       LEU  47   2.810 -13.512  10.650
  397    HB2  LEU  47           2HB      LEU  47   5.065 -14.105   9.860
  398    HB3  LEU  47           3HB      LEU  47   3.889 -15.420   9.624
  399    HG   LEU  47           HG       LEU  47   4.521 -13.557   7.355
  400   HD11  LEU  47          1HD1      LEU  47   6.352 -15.054   6.663
  401   HD12  LEU  47          2HD1      LEU  47   6.702 -14.281   8.227
  402   HD13  LEU  47          3HD1      LEU  47   6.165 -15.977   8.172
  403   HD21  LEU  47          3HD2      LEU  47   2.680 -15.175   7.134
  404   HD22  LEU  47          1HD2      LEU  47   4.013 -15.571   6.025
  405   HD23  LEU  47          2HD2      LEU  47   3.797 -16.504   7.524
  406    H    GLY  48           HN       GLY  48   1.749 -11.732   8.235
  407    HA2  GLY  48           1HA      GLY  48   1.999  -9.350   8.340
  408    HA3  GLY  48           2HA      GLY  48   3.696  -9.570   8.824
  409    H    ASP  49           HN       ASP  49   5.192 -10.443   7.223
  410    HA   ASP  49           HA       ASP  49   4.412  -9.485   4.517
  411    HB2  ASP  49           2HB      ASP  49   6.701  -8.999   4.108
  412    HB3  ASP  49           3HB      ASP  49   6.337  -8.366   5.729
  413    HD2  ASP  49           2HD      ASP  49   9.073 -11.162   5.348
  414    HA   PRO  50           HA       PRO  50   5.931  -9.546   2.720
  415    HB2  PRO  50           2HB      PRO  50   5.638 -10.397   0.148
  416    HB3  PRO  50           3HB      PRO  50   7.084 -10.810   1.126
  417    HG2  PRO  50           2HG      PRO  50   4.673 -12.473   0.572
  418    HG3  PRO  50           3HG      PRO  50   6.402 -12.941   0.479
  419    HD2  PRO  50           2HD      PRO  50   4.733 -13.471   2.623
  420    HD3  PRO  50           3HD      PRO  50   6.506 -13.268   2.769
  421    H    ILE  51           HN       ILE  51   4.607  -8.012   1.732
  422    HA   ILE  51           HA       ILE  51   1.746  -8.793   1.544
  423    HB   ILE  51           HB       ILE  51   2.998  -6.057   2.001
  424   HG12  ILE  51          2HG1      ILE  51   1.360  -7.883   3.788
  425   HG13  ILE  51          3HG1      ILE  51   3.092  -7.510   3.956
  426   HG21  ILE  51          1HG2      ILE  51   0.686  -5.247   2.255
  427   HG22  ILE  51          2HG2      ILE  51   0.969  -5.900   0.625
  428   HG23  ILE  51          3HG2      ILE  51   0.073  -6.861   1.827
  429   HD11  ILE  51          3HD1      ILE  51   0.814  -5.538   4.243
  430   HD12  ILE  51          1HD1      ILE  51   1.748  -6.242   5.579
  431   HD13  ILE  51          2HD1      ILE  51   2.546  -5.167   4.412
  432    H    GLN  52           HN       GLN  52   1.017  -9.066  -0.426
  433    HA   GLN  52           HA       GLN  52   2.509  -7.850  -2.678
  434    HB2  GLN  52           2HB      GLN  52   0.488 -10.109  -2.513
  435    HB3  GLN  52           3HB      GLN  52   1.182  -9.496  -4.033
  436    HG2  GLN  52           2HG      GLN  52   3.338 -10.257  -3.483
  437    HG3  GLN  52           3HG      GLN  52   2.911 -10.494  -1.774
  438   HE21  GLN  52          1HE2      GLN  52   1.778 -12.328  -1.132
  439   HE22  GLN  52          2HE2      GLN  52   1.592 -13.719  -2.178
  440    H    ILE  53           HN       ILE  53   1.736  -6.107  -3.641
  441    HA   ILE  53           HA       ILE  53  -1.199  -5.623  -3.493
  442    HB   ILE  53           HB       ILE  53  -0.644  -3.179  -3.619
  443   HG12  ILE  53          2HG1      ILE  53   2.180  -4.142  -3.062
  444   HG13  ILE  53          3HG1      ILE  53   1.607  -3.439  -4.593
  445   HG21  ILE  53          1HG2      ILE  53  -0.002  -2.959  -1.254
  446   HG22  ILE  53          2HG2      ILE  53  -1.202  -4.253  -1.483
  447   HG23  ILE  53          3HG2      ILE  53   0.512  -4.663  -1.234
  448   HD11  ILE  53          3HD1      ILE  53   1.694  -2.032  -1.914
  449   HD12  ILE  53          1HD1      ILE  53   2.830  -1.778  -3.254
  450   HD13  ILE  53          2HD1      ILE  53   1.122  -1.331  -3.446
  451    H    ASN  54           HN       ASN  54  -2.172  -4.652  -5.330
  452    HA   ASN  54           HA       ASN  54  -0.546  -5.006  -7.803
  453    HB2  ASN  54           2HB      ASN  54  -2.482  -6.515  -7.603
  454    HB3  ASN  54           3HB      ASN  54  -3.557  -5.113  -7.412
  455   HD21  ASN  54          1HD2      ASN  54  -4.116  -3.860  -9.193
  456   HD22  ASN  54          2HD2      ASN  54  -3.772  -4.361 -10.835
  457    H    VAL  55           HN       VAL  55   0.213  -3.121  -8.501
  458    HA   VAL  55           HA       VAL  55  -1.573  -0.746  -8.301
  459    HB   VAL  55           HB       VAL  55   1.461  -0.826  -8.556
  460   HG11  VAL  55          1HG1      VAL  55   1.343   1.600  -8.159
  461   HG12  VAL  55          2HG1      VAL  55   0.458   1.139  -9.631
  462   HG13  VAL  55          3HG1      VAL  55  -0.432   1.509  -8.136
  463   HG21  VAL  55          3HG2      VAL  55   0.700  -1.577  -6.348
  464   HG22  VAL  55          1HG2      VAL  55   1.485   0.016  -6.243
  465   HG23  VAL  55          2HG2      VAL  55  -0.288  -0.106  -6.181
  466    H    ARG  56           HN       ARG  56  -2.259   0.181 -10.114
  467    HA   ARG  56           HA       ARG  56  -2.658   0.556 -12.325
  468    HB2  ARG  56           2HB      ARG  56   0.142  -0.478 -12.865
  469    HB3  ARG  56           3HB      ARG  56  -0.872   0.508 -13.947
  470    HG2  ARG  56           2HG      ARG  56   0.356   1.371 -11.319
  471    HG3  ARG  56           3HG      ARG  56   0.852   1.875 -12.952
  472    HD2  ARG  56           2HD      ARG  56  -1.494   2.799 -13.240
  473    HD3  ARG  56           3HD      ARG  56  -1.722   2.521 -11.500
  474    HE   ARG  56           HE       ARG  56   0.475   4.237 -12.550
  475   HH11  ARG  56          2HH1      ARG  56  -2.201   3.647 -10.335
  476   HH12  ARG  56          1HH1      ARG  56  -2.019   5.179  -9.512
  477   HH21  ARG  56          2HH2      ARG  56   0.675   6.244 -11.508
  478   HH22  ARG  56          1HH2      ARG  56  -0.386   6.652 -10.179
  479    H    GLY  57           HN       GLY  57  -0.384  -2.089 -12.925
  480    HA2  GLY  57           1HA      GLY  57  -2.515  -4.087 -13.041
  481    HA3  GLY  57           2HA      GLY  57  -1.785  -3.671 -14.607
  482    H    TYR  58           HN       TYR  58   0.180  -3.326 -11.816
  483    HA   TYR  58           HA       TYR  58   1.626  -5.850 -12.492
  484    HB2  TYR  58           2HB      TYR  58   2.658  -3.684 -13.353
  485    HB3  TYR  58           3HB      TYR  58   2.880  -3.216 -11.659
  486    HD1  TYR  58           1HD      TYR  58   3.895  -5.672 -14.249
  487    HD2  TYR  58           2HD      TYR  58   4.694  -4.093 -10.373
  488    HE1  TYR  58           1HE      TYR  58   6.053  -6.841 -14.221
  489    HE2  TYR  58           2HE      TYR  58   6.849  -5.272 -10.336
  490    HH   TYR  58           HH       TYR  58   8.296  -6.626 -11.458
  491    H    GLU  59           HN       GLU  59   2.152  -7.107 -10.773
  492    HA   GLU  59           HA       GLU  59   1.194  -6.146  -8.162
  493    HB2  GLU  59           2HB      GLU  59   1.950  -8.859  -9.238
  494    HB3  GLU  59           3HB      GLU  59   1.671  -8.567  -7.505
  495    HG2  GLU  59           2HG      GLU  59  -0.586  -7.807  -7.968
  496    HG3  GLU  59           3HG      GLU  59  -0.315  -7.996  -9.714
  497    HE2  GLU  59           2HE      GLU  59  -0.818 -11.309  -7.565
  498    H    LEU  60           HN       LEU  60   2.387  -5.632  -6.513
  499    HA   LEU  60           HA       LEU  60   5.333  -5.980  -6.765
  500    HB2  LEU  60           2HB      LEU  60   3.732  -3.792  -5.398
  501    HB3  LEU  60           3HB      LEU  60   5.507  -3.926  -5.411
  502    HG   LEU  60           HG       LEU  60   3.836  -3.616  -7.913
  503   HD11  LEU  60          1HD1      LEU  60   4.479  -1.239  -7.888
  504   HD12  LEU  60          2HD1      LEU  60   3.499  -1.663  -6.466
  505   HD13  LEU  60          3HD1      LEU  60   5.261  -1.470  -6.307
  506   HD21  LEU  60          3HD2      LEU  60   6.074  -4.578  -8.222
  507   HD22  LEU  60          1HD2      LEU  60   5.984  -2.942  -8.913
  508   HD23  LEU  60          2HD2      LEU  60   6.792  -3.203  -7.351
  509    H    SER  61           HN       SER  61   6.252  -7.207  -5.270
  510    HA   SER  61           HA       SER  61   4.704  -7.881  -2.839
  511    HB2  SER  61           2HB      SER  61   5.615  -9.735  -4.187
  512    HB3  SER  61           3HB      SER  61   7.256  -9.071  -3.994
  513    HG   SER  61           HG       SER  61   6.790 -10.749  -2.489
  514    H    LEU  62           HN       LEU  62   4.984  -6.434  -1.252
  515    HA   LEU  62           HA       LEU  62   7.736  -5.386  -0.838
  516    HB2  LEU  62           2HB      LEU  62   5.028  -4.245  -0.102
  517    HB3  LEU  62           3HB      LEU  62   6.573  -3.589   0.493
  518    HG   LEU  62           HG       LEU  62   5.671  -3.733  -2.399
  519   HD11  LEU  62          1HD1      LEU  62   5.631  -1.276  -2.252
  520   HD12  LEU  62          2HD1      LEU  62   4.507  -2.014  -1.088
  521   HD13  LEU  62          3HD1      LEU  62   6.072  -1.373  -0.532
  522   HD21  LEU  62          3HD2      LEU  62   8.096  -4.049  -2.164
  523   HD22  LEU  62          1HD2      LEU  62   7.725  -2.463  -2.879
  524   HD23  LEU  62          2HD2      LEU  62   8.195  -2.577  -1.167
  525    H    ARG  63           HN       ARG  63   8.717  -5.529   1.125
  526    HA   ARG  63           HA       ARG  63   7.662  -7.541   2.936
  527    HB2  ARG  63           2HB      ARG  63  10.126  -5.778   3.030
  528    HB3  ARG  63           3HB      ARG  63   9.732  -7.012   4.251
  529    HG2  ARG  63           2HG      ARG  63  10.172  -7.538   1.298
  530    HG3  ARG  63           3HG      ARG  63  11.369  -7.811   2.587
  531    HD2  ARG  63           2HD      ARG  63   9.889  -9.447   3.643
  532    HD3  ARG  63           3HD      ARG  63   8.648  -9.146   2.408
  533    HE   ARG  63           HE       ARG  63  10.977  -9.880   1.041
  534   HH11  ARG  63          2HH1      ARG  63   8.839 -11.331   3.450
  535   HH12  ARG  63          1HH1      ARG  63   9.080 -12.960   2.862
  536   HH21  ARG  63          2HH2      ARG  63  11.257 -11.999   0.267
  537   HH22  ARG  63          1HH2      ARG  63  10.453 -13.338   1.056
  538    H    LYS  64           HN       LYS  64   7.893  -6.989   5.388
  539    HA   LYS  64           HA       LYS  64   5.634  -5.405   5.959
  540    HB2  LYS  64           2HB      LYS  64   6.619  -7.306   7.296
  541    HB3  LYS  64           3HB      LYS  64   7.858  -6.166   7.877
  542    HG2  LYS  64           2HG      LYS  64   4.953  -5.518   8.237
  543    HG3  LYS  64           3HG      LYS  64   5.742  -6.691   9.319
  544    HD2  LYS  64           2HD      LYS  64   6.575  -3.813   8.844
  545    HD3  LYS  64           3HD      LYS  64   5.803  -4.472  10.307
  546    HE2  LYS  64           2HE      LYS  64   7.781  -5.985  10.587
  547    HE3  LYS  64           3HE      LYS  64   8.557  -5.151   9.223
  548    HZ1  LYS  64           3HZ      LYS  64   7.712  -3.891  11.745
  549    HZ2  LYS  64           1HZ      LYS  64   9.263  -4.260  11.327
  550    HZ3  LYS  64           2HZ      LYS  64   8.431  -3.117  10.478
  551    H    SER  65           HN       SER  65   9.088  -4.623   5.999
  552    HA   SER  65           HA       SER  65   8.949  -2.218   7.471
  553    HB2  SER  65           2HB      SER  65  10.864  -2.917   5.216
  554    HB3  SER  65           3HB      SER  65  11.134  -1.735   6.519
  555    HG   SER  65           HG       SER  65  12.115  -3.773   6.948
  556    H    ALA  66           HN       ALA  66   8.648  -2.751   3.916
  557    HA   ALA  66           HA       ALA  66   8.471   0.100   3.422
  558    HB1  ALA  66           1HB      ALA  66   7.927  -0.553   1.113
  559    HB2  ALA  66           2HB      ALA  66   9.342  -1.440   1.723
  560    HB3  ALA  66           3HB      ALA  66   7.757  -2.245   1.634
  561    H    ALA  67           HN       ALA  67   6.214  -2.522   4.038
  562    HA   ALA  67           HA       ALA  67   3.878  -1.166   3.103
  563    HB1  ALA  67           1HB      ALA  67   2.646  -2.873   4.374
  564    HB2  ALA  67           2HB      ALA  67   3.970  -3.594   3.430
  565    HB3  ALA  67           3HB      ALA  67   4.154  -3.356   5.184
  566    H    GLU  68           HN       GLU  68   5.640  -1.136   6.177
  567    HA   GLU  68           HA       GLU  68   3.535   0.479   7.442
  568    HB2  GLU  68           2HB      GLU  68   5.128   0.552   9.370
  569    HB3  GLU  68           3HB      GLU  68   4.628  -1.085   8.880
  570    HG2  GLU  68           2HG      GLU  68   6.712  -1.550   7.909
  571    HG3  GLU  68           3HG      GLU  68   7.189   0.162   7.906
  572    HE2  GLU  68           2HE      GLU  68   7.464  -1.811  11.353
  573    H    MET  69           HN       MET  69   5.814   1.114   5.176
  574    HA   MET  69           HA       MET  69   6.430   3.796   6.270
  575    HB2  MET  69           2HB      MET  69   7.429   2.310   3.830
  576    HB3  MET  69           3HB      MET  69   7.806   4.015   4.168
  577    HG2  MET  69           2HG      MET  69   8.854   3.347   6.294
  578    HG3  MET  69           3HG      MET  69   8.504   1.650   5.926
  579    HE1  MET  69           3HE      MET  69  11.017   0.976   6.257
  580    HE2  MET  69           1HE      MET  69  12.384   1.802   5.474
  581    HE3  MET  69           2HE      MET  69  11.397   2.663   6.679
  582    H    ILE  70           HN       ILE  70   4.452   2.110   3.930
  583    HA   ILE  70           HA       ILE  70   3.695   4.607   2.601
  584    HB   ILE  70           HB       ILE  70   2.503   1.822   2.294
  585   HG12  ILE  70          2HG1      ILE  70   4.605   3.238   0.624
  586   HG13  ILE  70          3HG1      ILE  70   4.914   1.902   1.758
  587   HG21  ILE  70          1HG2      ILE  70   1.640   2.698   0.160
  588   HG22  ILE  70          2HG2      ILE  70   1.027   3.638   1.541
  589   HG23  ILE  70          3HG2      ILE  70   2.339   4.292   0.532
  590   HD11  ILE  70          3HD1      ILE  70   3.199   1.759  -0.733
  591   HD12  ILE  70          1HD1      ILE  70   4.839   1.098  -0.565
  592   HD13  ILE  70          2HD1      ILE  70   3.511   0.423   0.402
  593    H    GLU  71           HN       GLU  71   2.649   5.920   4.019
  594    HA   GLU  71           HA       GLU  71   0.591   4.974   5.831
  595    HB2  GLU  71           2HB      GLU  71   2.077   7.053   6.050
  596    HB3  GLU  71           3HB      GLU  71   1.011   7.803   4.838
  597    HG2  GLU  71           2HG      GLU  71   0.005   8.564   6.723
  598    HG3  GLU  71           3HG      GLU  71  -0.865   7.024   6.545
  599    HE2  GLU  71           2HE      GLU  71   0.195   6.143   9.690
  600    H    VAL  72           HN       VAL  72  -1.518   4.581   5.328
  601    HA   VAL  72           HA       VAL  72  -2.461   5.674   2.734
  602    HB   VAL  72           HB       VAL  72  -3.577   3.547   2.223
  603   HG11  VAL  72          1HG1      VAL  72  -1.590   2.217   1.658
  604   HG12  VAL  72          2HG1      VAL  72  -1.333   3.946   1.334
  605   HG13  VAL  72          3HG1      VAL  72  -0.618   3.196   2.781
  606   HG21  VAL  72          3HG2      VAL  72  -3.916   2.739   4.509
  607   HG22  VAL  72          1HG2      VAL  72  -3.100   1.510   3.514
  608   HG23  VAL  72          2HG2      VAL  72  -2.165   2.471   4.682
  609    H    GLU  73           HN       GLU  73  -4.886   4.903   2.494
  610    HA   GLU  73           HA       GLU  73  -6.350   5.113   5.042
  611    HB2  GLU  73           2HB      GLU  73  -6.187   7.420   4.297
  612    HB3  GLU  73           3HB      GLU  73  -6.748   6.965   2.671
  613    HG2  GLU  73           2HG      GLU  73  -8.928   6.429   3.493
  614    HG3  GLU  73           3HG      GLU  73  -8.396   6.602   5.180
  615    HE2  GLU  73           2HE      GLU  73  -9.447   9.825   3.173
  616    H    LEU  74           HN       LEU  74  -8.045   3.767   5.060
  617    HA   LEU  74           HA       LEU  74  -8.633   2.358   2.515
  618    HB2  LEU  74           2HB      LEU  74  -7.817   0.955   4.321
  619    HB3  LEU  74           3HB      LEU  74  -9.078   1.579   5.410
  620    HG   LEU  74           HG       LEU  74 -10.798   0.472   4.147
  621   HD11  LEU  74          1HD1      LEU  74 -10.293  -0.966   2.215
  622   HD12  LEU  74          2HD1      LEU  74  -9.850   0.726   1.899
  623   HD13  LEU  74          3HD1      LEU  74  -8.588  -0.467   2.292
  624   HD21  LEU  74          3HD2      LEU  74  -9.617  -0.834   5.856
  625   HD22  LEU  74          1HD2      LEU  74 -10.155  -1.875   4.517
  626   HD23  LEU  74          2HD2      LEU  74  -8.449  -1.386   4.632
  627    H    GLU  75           HN       GLU  75 -10.589   2.425   1.606
  628    HA   GLU  75           HA       GLU  75 -12.501   4.364   2.457
  629    HB2  GLU  75           2HB      GLU  75 -12.202   3.645   0.115
  630    HB3  GLU  75           3HB      GLU  75 -12.821   2.031   0.539
  631    HG2  GLU  75           2HG      GLU  75 -14.544   3.356  -0.547
  632    HG3  GLU  75           3HG      GLU  75 -14.983   3.018   1.141
  633    HE2  GLU  75           2HE      GLU  75 -14.689   6.405   2.003
  634    H    HIS  76           HN       HIS  76 -14.442   4.185   3.493
  635    HA   HIS  76           HA       HIS  76 -14.997   1.539   4.741
  636    HB2  HIS  76           2HB      HIS  76 -15.093   4.313   5.949
  637    HB3  HIS  76           3HB      HIS  76 -15.957   2.937   6.658
  638    HD1  HIS  76           1HD      HIS  76 -12.589   4.479   6.357
  639    HD2  HIS  76           2HD      HIS  76 -14.259   0.898   7.710
  640    HE1  HIS  76           1HE      HIS  76 -10.795   3.341   7.743
  641    HE2  HIS  76           2HE      HIS  76 -11.817   1.165   8.561
  642    H    HIS  77           HN       HIS  77 -17.056   0.819   4.682
  643    HA   HIS  77           HA       HIS  77 -18.919   2.124   2.918
  644    HB2  HIS  77           2HB      HIS  77 -18.745  -0.364   3.365
  645    HB3  HIS  77           3HB      HIS  77 -19.509  -0.062   4.937
  646    HD1  HIS  77           1HD      HIS  77 -22.033   0.628   4.934
  647    HD2  HIS  77           2HD      HIS  77 -20.462  -0.275   1.170
  648    HE1  HIS  77           1HE      HIS  77 -24.017   0.347   3.387
  649    HE2  HIS  77           2HE      HIS  77 -23.058  -0.192   1.104
  650    H    HIS  78           HN       HIS  78 -18.318   2.087   6.363
  651    HA   HIS  78           HA       HIS  78 -20.272   4.294   6.650
  652    HB2  HIS  78           2HB      HIS  78 -21.371   2.181   7.398
  653    HB3  HIS  78           3HB      HIS  78 -20.063   1.951   8.572
  654    HD1  HIS  78           1HD      HIS  78 -23.106   4.051   7.876
  655    HD2  HIS  78           2HD      HIS  78 -20.212   3.571  10.851
  656    HE1  HIS  78           1HE      HIS  78 -23.938   5.349   9.887
  657    HE2  HIS  78           2HE      HIS  78 -22.179   5.050  11.689
  658    H    HIS  79           HN       HIS  79 -18.683   5.824   6.866
  659    HA   HIS  79           HA       HIS  79 -16.700   5.361   9.037
  660    HB2  HIS  79           2HB      HIS  79 -15.807   5.773   6.726
  661    HB3  HIS  79           3HB      HIS  79 -16.566   7.375   6.771
  662    HD1  HIS  79           1HD      HIS  79 -15.444   9.199   8.213
  663    HD2  HIS  79           2HD      HIS  79 -13.545   5.485   8.393
  664    HE1  HIS  79           1HE      HIS  79 -13.222   9.597   9.362
  665    HE2  HIS  79           2HE      HIS  79 -12.077   7.334   9.483
  666    H    HIS  80           HN       HIS  80 -18.489   5.884  10.512
  667    HA   HIS  80           HA       HIS  80 -18.312   8.615  11.367
  668    HB2  HIS  80           2HB      HIS  80 -19.911   8.878   9.462
  669    HB3  HIS  80           3HB      HIS  80 -21.002   7.731  10.262
  670    HD1  HIS  80           1HD      HIS  80 -22.851   8.898  11.388
  671    HD2  HIS  80           2HD      HIS  80 -19.315  11.116  11.523
  672    HE1  HIS  80           1HE      HIS  80 -23.404  11.034  12.632
  673    HE2  HIS  80           2HE      HIS  80 -21.253  12.374  12.714
  674    H    HIS  81           HN       HIS  81 -18.568   8.591  13.519
  675    HA   HIS  81           HA       HIS  81 -19.543   6.124  14.765
  676    HB2  HIS  81           2HB      HIS  81 -18.358   8.677  15.899
  677    HB3  HIS  81           3HB      HIS  81 -18.882   7.302  16.888
  678    HD1  HIS  81           1HD      HIS  81 -16.678   6.479  17.758
  679    HD2  HIS  81           2HD      HIS  81 -16.678   6.985  13.612
  680    HE1  HIS  81           1HE      HIS  81 -14.480   5.526  16.928
  681    HE2  HIS  81           2HE      HIS  81 -14.492   5.831  14.410
  Start of MODEL   14
    1    H1   MET   1           HN       MET   1  -3.636   6.137  13.002
    2    HA   MET   1           HA       MET   1  -2.438   7.229  10.669
    3    HB2  MET   1           2HB      MET   1  -0.419   7.527  11.969
    4    HB3  MET   1           3HB      MET   1  -0.506   5.851  12.564
    5    HG2  MET   1           2HG      MET   1  -0.156   5.037  10.262
    6    HG3  MET   1           3HG      MET   1  -0.027   6.711   9.697
    7    HE1  MET   1           3HE      MET   1   2.321   5.930   8.573
    8    HE2  MET   1           1HE      MET   1   3.665   5.231   9.504
    9    HE3  MET   1           2HE      MET   1   2.159   4.310   9.293
   10    H    PHE   2           HN       PHE   2  -2.986   5.878   9.069
   11    HA   PHE   2           HA       PHE   2  -3.294   3.000   9.771
   12    HB2  PHE   2           2HB      PHE   2  -5.333   4.226   8.930
   13    HB3  PHE   2           3HB      PHE   2  -4.485   4.463   7.393
   14    HD1  PHE   2           2HD      PHE   2  -5.983   1.957   9.649
   15    HD2  PHE   2           1HD      PHE   2  -4.227   2.642   5.831
   16    HE1  PHE   2           2HE      PHE   2  -6.754  -0.251   8.902
   17    HE2  PHE   2           1HE      PHE   2  -4.993   0.430   5.081
   18    HZ   PHE   2           HZ       PHE   2  -6.249  -1.026   6.620
   19    H    SER   3           HN       SER   3  -1.875   1.616   8.945
   20    HA   SER   3           HA       SER   3  -0.019   2.676   6.878
   21    HB2  SER   3           2HB      SER   3   0.369   0.318   8.757
   22    HB3  SER   3           3HB      SER   3   1.600   1.110   7.743
   23    HG   SER   3           HG       SER   3   1.665   1.811   9.933
   24    H    LEU   4           HN       LEU   4   0.534   1.440   5.078
   25    HA   LEU   4           HA       LEU   4  -1.475  -0.272   3.997
   26    HB2  LEU   4           2HB      LEU   4   0.187   1.044   2.690
   27    HB3  LEU   4           3HB      LEU   4   1.453  -0.081   3.235
   28    HG   LEU   4           HG       LEU   4   0.293  -1.923   2.085
   29   HD11  LEU   4          1HD1      LEU   4  -1.547  -1.432   0.525
   30   HD12  LEU   4          2HD1      LEU   4  -1.995  -1.043   2.203
   31   HD13  LEU   4          3HD1      LEU   4  -1.557   0.261   1.073
   32   HD21  LEU   4          3HD2      LEU   4   2.063  -0.659   0.946
   33   HD22  LEU   4          1HD2      LEU   4   0.825  -1.207  -0.208
   34   HD23  LEU   4          2HD2      LEU   4   0.851   0.489   0.327
   35    H    ARG   5           HN       ARG   5   1.300  -0.786   6.021
   36    HA   ARG   5           HA       ARG   5   1.687  -3.570   5.807
   37    HB2  ARG   5           2HB      ARG   5   3.078  -1.917   7.070
   38    HB3  ARG   5           3HB      ARG   5   1.783  -1.814   8.286
   39    HG2  ARG   5           2HG      ARG   5   2.133  -4.406   8.443
   40    HG3  ARG   5           3HG      ARG   5   3.723  -4.026   7.738
   41    HD2  ARG   5           2HD      ARG   5   3.892  -2.228   9.575
   42    HD3  ARG   5           3HD      ARG   5   2.530  -3.071  10.345
   43    HE   ARG   5           HE       ARG   5   5.296  -3.902  10.262
   44   HH11  ARG   5          2HH1      ARG   5   1.971  -5.064  10.457
   45   HH12  ARG   5          1HH1      ARG   5   2.406  -6.539  11.288
   46   HH21  ARG   5          2HH2      ARG   5   5.844  -5.814  11.363
   47   HH22  ARG   5          1HH2      ARG   5   4.600  -6.964  11.801
   48    H    ASP   6           HN       ASP   6  -0.976  -1.750   7.115
   49    HA   ASP   6           HA       ASP   6  -1.888  -4.151   8.632
   50    HB2  ASP   6           2HB      ASP   6  -1.298  -1.976   9.870
   51    HB3  ASP   6           3HB      ASP   6  -2.764  -1.301   9.125
   52    HD2  ASP   6           2HD      ASP   6  -3.277  -4.206  11.807
   53    H    ALA   7           HN       ALA   7  -2.294  -2.768   5.771
   54    HA   ALA   7           HA       ALA   7  -5.168  -2.564   5.613
   55    HB1  ALA   7           1HB      ALA   7  -4.799  -2.545   3.179
   56    HB2  ALA   7           2HB      ALA   7  -3.690  -1.430   4.011
   57    HB3  ALA   7           3HB      ALA   7  -3.099  -3.006   3.435
   58    H    LYS   8           HN       LYS   8  -6.645  -4.119   5.407
   59    HA   LYS   8           HA       LYS   8  -5.729  -6.860   5.666
   60    HB2  LYS   8           2HB      LYS   8  -8.419  -5.501   5.666
   61    HB3  LYS   8           3HB      LYS   8  -8.292  -7.275   5.571
   62    HG2  LYS   8           2HG      LYS   8  -8.634  -6.655   7.862
   63    HG3  LYS   8           3HG      LYS   8  -6.961  -7.236   7.680
   64    HD2  LYS   8           2HD      LYS   8  -6.254  -4.820   7.478
   65    HD3  LYS   8           3HD      LYS   8  -7.915  -4.372   7.937
   66    HE2  LYS   8           2HE      LYS   8  -7.677  -5.601  10.043
   67    HE3  LYS   8           3HE      LYS   8  -6.032  -6.092   9.583
   68    HZ1  LYS   8           3HZ      LYS   8  -6.937  -3.324  10.016
   69    HZ2  LYS   8           1HZ      LYS   8  -6.018  -4.207  11.060
   70    HZ3  LYS   8           2HZ      LYS   8  -5.410  -3.779   9.590
   71    H    CYS   9           HN       CYS   9  -6.471  -8.637   4.343
   72    HA   CYS   9           HA       CYS   9  -5.980  -8.110   1.568
   73    HB2  CYS   9           2HB      CYS   9  -6.572 -10.544   1.316
   74    HB3  CYS   9           3HB      CYS   9  -5.248 -10.178   2.450
   75    HG   CYS   9           HG       CYS   9  -6.621 -12.228   3.316
   76    H    GLY  10           HN       GLY  10  -7.326  -7.724  -0.088
   77    HA2  GLY  10           1HA      GLY  10  -9.377  -7.930  -1.260
   78    HA3  GLY  10           2HA      GLY  10 -10.199  -8.337   0.264
   79    H    GLN  11           HN       GLN  11  -8.135  -5.766   0.833
   80    HA   GLN  11           HA       GLN  11 -10.423  -3.900   0.738
   81    HB2  GLN  11           2HB      GLN  11  -7.678  -3.644   2.012
   82    HB3  GLN  11           3HB      GLN  11  -8.981  -2.436   2.116
   83    HG2  GLN  11           2HG      GLN  11  -9.033  -5.252   3.226
   84    HG3  GLN  11           3HG      GLN  11  -8.860  -3.747   4.155
   85   HE21  GLN  11          1HE2      GLN  11 -10.890  -5.852   4.382
   86   HE22  GLN  11          2HE2      GLN  11 -12.431  -5.067   4.113
   87    H    THR  12           HN       THR  12 -10.216  -1.787  -0.102
   88    HA   THR  12           HA       THR  12  -8.004  -1.440  -2.069
   89    HB   THR  12           HB       THR  12 -10.795  -0.229  -2.192
   90    HG1  THR  12           1HG      THR  12 -11.072  -1.748  -3.913
   91   HG21  THR  12          3HG2      THR  12  -8.531  -0.310  -4.221
   92   HG22  THR  12          1HG2      THR  12 -10.142   0.393  -4.491
   93   HG23  THR  12          2HG2      THR  12  -9.048   1.116  -3.289
   94    H    VAL  13           HN       VAL  13  -6.583   0.048  -1.374
   95    HA   VAL  13           HA       VAL  13  -7.625   2.114   0.496
   96    HB   VAL  13           HB       VAL  13  -5.344   2.213   1.455
   97   HG11  VAL  13          1HG1      VAL  13  -5.431   0.076   2.670
   98   HG12  VAL  13          2HG1      VAL  13  -7.049   0.791   2.491
   99   HG13  VAL  13          3HG1      VAL  13  -6.556  -0.569   1.453
  100   HG21  VAL  13          3HG2      VAL  13  -4.087   1.457  -0.505
  101   HG22  VAL  13          1HG2      VAL  13  -3.699   0.466   0.921
  102   HG23  VAL  13          2HG2      VAL  13  -4.787  -0.171  -0.334
  103    H    LYS  14           HN       LYS  14  -6.408   4.141   0.552
  104    HA   LYS  14           HA       LYS  14  -5.386   4.880  -2.151
  105    HB2  LYS  14           2HB      LYS  14  -7.622   5.816  -1.558
  106    HB3  LYS  14           3HB      LYS  14  -6.885   6.586  -0.133
  107    HG2  LYS  14           2HG      LYS  14  -6.352   8.351  -1.361
  108    HG3  LYS  14           3HG      LYS  14  -5.356   7.322  -2.420
  109    HD2  LYS  14           2HD      LYS  14  -8.356   7.645  -2.712
  110    HD3  LYS  14           3HD      LYS  14  -7.162   8.628  -3.593
  111    HE2  LYS  14           2HE      LYS  14  -6.238   6.631  -4.631
  112    HE3  LYS  14           3HE      LYS  14  -7.341   5.602  -3.692
  113    HZ1  LYS  14           3HZ      LYS  14  -8.150   7.597  -5.699
  114    HZ2  LYS  14           1HZ      LYS  14  -8.141   5.963  -5.918
  115    HZ3  LYS  14           2HZ      LYS  14  -9.174   6.642  -4.827
  116    H    VAL  15           HN       VAL  15  -3.284   5.412  -2.128
  117    HA   VAL  15           HA       VAL  15  -1.832   5.618   0.344
  118    HB   VAL  15           HB       VAL  15  -0.948   6.399  -2.460
  119   HG11  VAL  15          1HG1      VAL  15   1.335   6.028  -1.613
  120   HG12  VAL  15          2HG1      VAL  15   0.503   7.309  -0.703
  121   HG13  VAL  15          3HG1      VAL  15   0.677   5.684   0.003
  122   HG21  VAL  15          3HG2      VAL  15  -1.741   4.085  -2.366
  123   HG22  VAL  15          1HG2      VAL  15   0.024   4.144  -2.581
  124   HG23  VAL  15          2HG2      VAL  15  -0.664   3.765  -0.985
  125    H    VAL  16           HN       VAL  16  -1.454   7.349   1.606
  126    HA   VAL  16           HA       VAL  16  -2.039   9.995   0.389
  127    HB   VAL  16           HB       VAL  16  -2.713  10.717   2.736
  128   HG11  VAL  16          1HG1      VAL  16  -4.999   9.830   2.504
  129   HG12  VAL  16          2HG1      VAL  16  -4.334  10.334   0.933
  130   HG13  VAL  16          3HG1      VAL  16  -4.406   8.607   1.359
  131   HG21  VAL  16          3HG2      VAL  16  -1.748   8.831   3.970
  132   HG22  VAL  16          1HG2      VAL  16  -3.496   8.960   4.271
  133   HG23  VAL  16          2HG2      VAL  16  -2.876   7.718   3.161
  134    H    LYS  17           HN       LYS  17  -0.072   8.242   2.815
  135    HA   LYS  17           HA       LYS  17   1.866  10.488   2.593
  136    HB2  LYS  17           2HB      LYS  17   1.067   9.049   5.144
  137    HB3  LYS  17           3HB      LYS  17   2.379  10.242   4.994
  138    HG2  LYS  17           2HG      LYS  17   0.737  11.961   4.373
  139    HG3  LYS  17           3HG      LYS  17  -0.571  10.766   4.543
  140    HD2  LYS  17           2HD      LYS  17   0.058  10.452   6.917
  141    HD3  LYS  17           3HD      LYS  17   1.310  11.703   6.732
  142    HE2  LYS  17           2HE      LYS  17  -0.696  12.636   7.762
  143    HE3  LYS  17           3HE      LYS  17  -0.422  13.351   6.158
  144    HZ1  LYS  17           3HZ      LYS  17  -2.327  11.189   6.767
  145    HZ2  LYS  17           1HZ      LYS  17  -2.720  12.766   6.489
  146    HZ3  LYS  17           2HZ      LYS  17  -2.072  11.853   5.279
  147    H    LEU  18           HN       LEU  18   4.049   9.941   2.841
  148    HA   LEU  18           HA       LEU  18   4.622   7.016   2.860
  149    HB2  LEU  18           2HB      LEU  18   5.888   9.164   1.133
  150    HB3  LEU  18           3HB      LEU  18   6.485   7.493   1.283
  151    HG   LEU  18           HG       LEU  18   3.784   8.307   0.170
  152   HD11  LEU  18          1HD1      LEU  18   4.725   7.635  -2.004
  153   HD12  LEU  18          2HD1      LEU  18   5.642   8.981  -1.286
  154   HD13  LEU  18          3HD1      LEU  18   6.297   7.326  -1.227
  155   HD21  LEU  18          3HD2      LEU  18   3.771   6.094   1.241
  156   HD22  LEU  18          1HD2      LEU  18   3.629   5.949  -0.526
  157   HD23  LEU  18          2HD2      LEU  18   5.184   5.613   0.270
  158    H    HIS  19           HN       HIS  19   5.332   6.863   4.948
  159    HA   HIS  19           HA       HIS  19   6.936   9.036   6.090
  160    HB2  HIS  19           2HB      HIS  19   5.877   6.436   7.236
  161    HB3  HIS  19           3HB      HIS  19   6.820   7.620   8.161
  162    HD1  HIS  19           1HD      HIS  19   5.627   9.724   8.975
  163    HD2  HIS  19           2HD      HIS  19   3.259   7.284   6.555
  164    HE1  HIS  19           1HE      HIS  19   3.264  10.612   9.174
  165    HE2  HIS  19           2HE      HIS  19   1.827   9.123   7.707
  166    H    GLY  20           HN       GLY  20   7.697   6.503   4.150
  167    HA2  GLY  20           1HA      GLY  20   9.970   5.385   5.461
  168    HA3  GLY  20           2HA      GLY  20   9.671   5.420   3.707
  169    H    THR  21           HN       THR  21   9.611   8.080   3.154
  170    HA   THR  21           HA       THR  21  10.757  10.039   2.996
  171    HB   THR  21           HB       THR  21  12.573   9.118   5.252
  172    HG1  THR  21           1HG      THR  21  11.049  10.236   6.590
  173   HG21  THR  21          3HG2      THR  21  11.745  11.874   4.274
  174   HG22  THR  21          1HG2      THR  21  12.817  11.541   5.652
  175   HG23  THR  21          2HG2      THR  21  13.327  11.103   4.005
  176    H    GLY  22           HN       GLY  22  12.166  10.634   1.493
  177    HA2  GLY  22           1HA      GLY  22  13.935  10.596   0.054
  178    HA3  GLY  22           2HA      GLY  22  14.868   9.920   1.409
  179    H    ALA  23           HN       ALA  23  15.592   7.910   1.303
  180    HA   ALA  23           HA       ALA  23  15.741   6.603  -1.169
  181    HB1  ALA  23           1HB      ALA  23  16.703   4.728   0.102
  182    HB2  ALA  23           2HB      ALA  23  17.337   6.291   0.671
  183    HB3  ALA  23           3HB      ALA  23  16.089   5.439   1.613
  184    H    LEU  24           HN       LEU  24  13.517   6.090   1.543
  185    HA   LEU  24           HA       LEU  24  12.330   3.717   0.438
  186    HB2  LEU  24           2HB      LEU  24  11.595   5.668   2.602
  187    HB3  LEU  24           3HB      LEU  24  10.421   4.446   2.053
  188    HG   LEU  24           HG       LEU  24  11.550   3.696   4.050
  189   HD11  LEU  24          1HD1      LEU  24  12.377   1.531   3.234
  190   HD12  LEU  24          2HD1      LEU  24  10.907   2.036   2.370
  191   HD13  LEU  24          3HD1      LEU  24  12.498   2.199   1.590
  192   HD21  LEU  24          3HD2      LEU  24  13.629   4.975   3.836
  193   HD22  LEU  24          1HD2      LEU  24  13.968   3.249   4.098
  194   HD23  LEU  24          2HD2      LEU  24  14.127   3.947   2.470
  195    H    LYS  25           HN       LYS  25  11.446   7.188   0.450
  196    HA   LYS  25           HA       LYS  25   8.951   6.915  -0.834
  197    HB2  LYS  25           2HB      LYS  25  10.987   9.144  -0.764
  198    HB3  LYS  25           3HB      LYS  25   9.454   9.295  -1.656
  199    HG2  LYS  25           2HG      LYS  25   8.222   8.871   0.443
  200    HG3  LYS  25           3HG      LYS  25   9.772   8.805   1.316
  201    HD2  LYS  25           2HD      LYS  25  10.261  11.114   0.622
  202    HD3  LYS  25           3HD      LYS  25   8.714  11.179  -0.255
  203    HE2  LYS  25           2HE      LYS  25   7.491  10.869   1.830
  204    HE3  LYS  25           3HE      LYS  25   9.017  10.713   2.726
  205    HZ1  LYS  25           3HZ      LYS  25   8.117  13.114   1.279
  206    HZ2  LYS  25           1HZ      LYS  25   8.096  12.915   2.916
  207    HZ3  LYS  25           2HZ      LYS  25   9.534  12.969   2.112
  208    H    ARG  26           HN       ARG  26  12.218   7.423  -2.210
  209    HA   ARG  26           HA       ARG  26  11.407   7.786  -4.881
  210    HB2  ARG  26           2HB      ARG  26  13.957   6.497  -3.856
  211    HB3  ARG  26           3HB      ARG  26  13.701   7.176  -5.482
  212    HG2  ARG  26           2HG      ARG  26  13.756   8.684  -2.861
  213    HG3  ARG  26           3HG      ARG  26  14.976   8.726  -4.157
  214    HD2  ARG  26           2HD      ARG  26  12.128   9.746  -4.269
  215    HD3  ARG  26           3HD      ARG  26  13.622  10.706  -4.314
  216    HE   ARG  26           HE       ARG  26  12.573   8.978  -6.491
  217   HH11  ARG  26          2HH1      ARG  26  14.972  11.287  -5.335
  218   HH12  ARG  26          1HH1      ARG  26  15.454  11.777  -6.943
  219   HH21  ARG  26          2HH2      ARG  26  13.152   9.668  -8.571
  220   HH22  ARG  26          1HH2      ARG  26  14.420  10.856  -8.781
  221    H    ARG  27           HN       ARG  27  12.569   4.777  -3.291
  222    HA   ARG  27           HA       ARG  27  12.339   3.155  -5.585
  223    HB2  ARG  27           2HB      ARG  27  13.519   2.583  -3.442
  224    HB3  ARG  27           3HB      ARG  27  11.925   2.261  -2.719
  225    HG2  ARG  27           2HG      ARG  27  11.519   0.540  -4.449
  226    HG3  ARG  27           3HG      ARG  27  13.152   0.832  -5.094
  227    HD2  ARG  27           2HD      ARG  27  14.065   0.244  -2.834
  228    HD3  ARG  27           3HD      ARG  27  12.419  -0.218  -2.348
  229    HE   ARG  27           HE       ARG  27  13.686  -1.492  -4.715
  230   HH11  ARG  27          2HH1      ARG  27  12.263  -1.713  -1.504
  231   HH12  ARG  27          1HH1      ARG  27  12.246  -3.462  -1.494
  232   HH21  ARG  27          2HH2      ARG  27  13.698  -3.771  -4.677
  233   HH22  ARG  27          1HH2      ARG  27  13.059  -4.627  -3.292
  234    H    ILE  28           HN       ILE  28   9.985   3.816  -2.977
  235    HA   ILE  28           HA       ILE  28   7.972   2.064  -3.965
  236    HB   ILE  28           HB       ILE  28   7.760   4.563  -2.243
  237   HG12  ILE  28          2HG1      ILE  28   7.727   1.619  -1.506
  238   HG13  ILE  28          3HG1      ILE  28   9.142   2.689  -1.361
  239   HG21  ILE  28          1HG2      ILE  28   5.554   3.709  -1.566
  240   HG22  ILE  28          2HG2      ILE  28   5.608   4.055  -3.310
  241   HG23  ILE  28          3HG2      ILE  28   5.715   2.375  -2.731
  242   HD11  ILE  28          3HD1      ILE  28   6.509   3.012   0.104
  243   HD12  ILE  28          1HD1      ILE  28   8.019   2.397   0.810
  244   HD13  ILE  28          2HD1      ILE  28   7.927   4.080   0.250
  245    H    MET  29           HN       MET  29   8.553   5.568  -4.476
  246    HA   MET  29           HA       MET  29   6.213   5.940  -6.085
  247    HB2  MET  29           2HB      MET  29   8.770   7.544  -5.845
  248    HB3  MET  29           3HB      MET  29   7.363   8.052  -6.809
  249    HG2  MET  29           2HG      MET  29   5.983   7.988  -4.747
  250    HG3  MET  29           3HG      MET  29   7.438   7.594  -3.816
  251    HE1  MET  29           3HE      MET  29   9.599   9.391  -5.451
  252    HE2  MET  29           1HE      MET  29   9.626  10.850  -4.435
  253    HE3  MET  29           2HE      MET  29   9.575   9.243  -3.678
  254    H    ASP  30           HN       ASP  30   9.538   5.003  -6.783
  255    HA   ASP  30           HA       ASP  30   9.457   5.423  -9.604
  256    HB2  ASP  30           2HB      ASP  30  11.528   5.139  -8.277
  257    HB3  ASP  30           3HB      ASP  30  11.097   3.438  -7.991
  258    HD2  ASP  30           2HD      ASP  30  12.298   4.431 -11.660
  259    H    MET  31           HN       MET  31   8.346   2.810  -7.522
  260    HA   MET  31           HA       MET  31   7.901   0.973  -9.746
  261    HB2  MET  31           2HB      MET  31   7.049   0.917  -6.836
  262    HB3  MET  31           3HB      MET  31   6.706  -0.379  -8.005
  263    HG2  MET  31           2HG      MET  31   9.094  -0.749  -8.326
  264    HG3  MET  31           3HG      MET  31   9.468   0.581  -7.217
  265    HE1  MET  31           3HE      MET  31   7.170   0.137  -5.004
  266    HE2  MET  31           1HE      MET  31   8.063  -0.829  -3.807
  267    HE3  MET  31           2HE      MET  31   8.859   0.541  -4.614
  268    H    GLY  32           HN       GLY  32   6.434   3.799  -8.927
  269    HA2  GLY  32           1HA      GLY  32   4.567   4.550 -10.200
  270    HA3  GLY  32           2HA      GLY  32   3.954   2.882 -10.264
  271    H    ILE  33           HN       ILE  33   4.916   3.164  -7.176
  272    HA   ILE  33           HA       ILE  33   2.169   3.682  -6.288
  273    HB   ILE  33           HB       ILE  33   4.591   3.007  -4.577
  274   HG12  ILE  33          2HG1      ILE  33   2.591   1.105  -5.840
  275   HG13  ILE  33          3HG1      ILE  33   4.271   1.335  -6.382
  276   HG21  ILE  33          1HG2      ILE  33   2.886   2.163  -3.012
  277   HG22  ILE  33          2HG2      ILE  33   2.630   3.884  -3.382
  278   HG23  ILE  33          3HG2      ILE  33   1.605   2.646  -4.147
  279   HD11  ILE  33          3HD1      ILE  33   3.401   0.301  -3.671
  280   HD12  ILE  33          1HD1      ILE  33   4.050  -0.687  -4.997
  281   HD13  ILE  33          2HD1      ILE  33   5.081   0.530  -4.215
  282    H    THR  34           HN       THR  34   1.781   5.850  -6.453
  283    HA   THR  34           HA       THR  34   3.615   7.615  -4.904
  284    HB   THR  34           HB       THR  34   2.603   9.436  -6.457
  285    HG1  THR  34           1HG      THR  34   1.959   8.570  -8.505
  286   HG21  THR  34          3HG2      THR  34   4.471   7.338  -7.611
  287   HG22  THR  34          1HG2      THR  34   4.303   9.010  -8.192
  288   HG23  THR  34          2HG2      THR  34   4.945   8.696  -6.563
  289    H    ARG  35           HN       ARG  35   2.628   9.375  -3.730
  290    HA   ARG  35           HA       ARG  35   0.240   8.624  -2.394
  291    HB2  ARG  35           2HB      ARG  35   0.287  10.881  -1.428
  292    HB3  ARG  35           3HB      ARG  35   1.875  10.078  -1.361
  293    HG2  ARG  35           2HG      ARG  35   2.499  11.382  -3.429
  294    HG3  ARG  35           3HG      ARG  35   0.994  12.307  -3.205
  295    HD2  ARG  35           2HD      ARG  35   1.747  12.947  -0.939
  296    HD3  ARG  35           3HD      ARG  35   3.262  12.056  -1.202
  297    HE   ARG  35           HE       ARG  35   2.442  14.590  -2.497
  298   HH11  ARG  35          2HH1      ARG  35   4.823  12.036  -2.052
  299   HH12  ARG  35          1HH1      ARG  35   6.141  12.973  -2.718
  300   HH21  ARG  35          2HH2      ARG  35   4.166  15.815  -3.346
  301   HH22  ARG  35          1HH2      ARG  35   5.768  15.119  -3.453
  302    H    GLY  36           HN       GLY  36  -1.813   8.725  -2.964
  303    HA2  GLY  36           1HA      GLY  36  -3.597  10.140  -3.950
  304    HA3  GLY  36           2HA      GLY  36  -2.471  10.478  -5.284
  305    H    CYS  37           HN       CYS  37  -1.579   7.501  -4.974
  306    HA   CYS  37           HA       CYS  37  -3.534   6.532  -6.931
  307    HB2  CYS  37           2HB      CYS  37  -2.044   4.675  -7.255
  308    HB3  CYS  37           3HB      CYS  37  -1.095   6.183  -7.229
  309    HG   CYS  37           HG       CYS  37   0.291   4.240  -6.171
  310    H    GLU  38           HN       GLU  38  -4.304   4.231  -6.745
  311    HA   GLU  38           HA       GLU  38  -5.066   3.651  -3.926
  312    HB2  GLU  38           2HB      GLU  38  -7.084   2.542  -4.966
  313    HB3  GLU  38           3HB      GLU  38  -7.030   4.318  -5.056
  314    HG2  GLU  38           2HG      GLU  38  -6.146   4.083  -7.392
  315    HG3  GLU  38           3HG      GLU  38  -6.459   2.338  -7.269
  316    HE2  GLU  38           2HE      GLU  38  -9.806   2.789  -7.901
  317    H    ILE  39           HN       ILE  39  -4.954   1.564  -3.205
  318    HA   ILE  39           HA       ILE  39  -3.543  -0.307  -5.029
  319    HB   ILE  39           HB       ILE  39  -3.009   0.143  -2.063
  320   HG12  ILE  39          2HG1      ILE  39  -1.325   0.756  -4.510
  321   HG13  ILE  39          3HG1      ILE  39  -2.101   1.941  -3.434
  322   HG21  ILE  39          1HG2      ILE  39  -1.187  -1.485  -2.356
  323   HG22  ILE  39          2HG2      ILE  39  -2.770  -2.208  -2.724
  324   HG23  ILE  39          3HG2      ILE  39  -1.679  -1.730  -4.047
  325   HD11  ILE  39          3HD1      ILE  39   0.091  -0.000  -2.657
  326   HD12  ILE  39          1HD1      ILE  39   0.304   1.739  -2.950
  327   HD13  ILE  39          2HD1      ILE  39  -0.684   1.187  -1.581
  328    H    TYR  40           HN       TYR  40  -4.438  -2.235  -5.203
  329    HA   TYR  40           HA       TYR  40  -6.466  -3.037  -3.195
  330    HB2  TYR  40           2HB      TYR  40  -7.041  -3.071  -5.638
  331    HB3  TYR  40           3HB      TYR  40  -5.798  -4.312  -5.867
  332    HD1  TYR  40           2HD      TYR  40  -9.051  -3.589  -4.244
  333    HD2  TYR  40           1HD      TYR  40  -6.219  -6.603  -5.275
  334    HE1  TYR  40           2HE      TYR  40 -10.684  -5.324  -3.657
  335    HE2  TYR  40           1HE      TYR  40  -7.854  -8.338  -4.686
  336    HH   TYR  40           HH       TYR  40 -11.119  -7.546  -3.509
  337    H    ILE  41           HN       ILE  41  -5.907  -4.400  -1.634
  338    HA   ILE  41           HA       ILE  41  -3.300  -5.774  -1.861
  339    HB   ILE  41           HB       ILE  41  -5.138  -5.509   0.558
  340   HG12  ILE  41          2HG1      ILE  41  -3.220  -3.945   1.329
  341   HG13  ILE  41          3HG1      ILE  41  -2.825  -3.829  -0.404
  342   HG21  ILE  41          1HG2      ILE  41  -3.160  -6.207   1.849
  343   HG22  ILE  41          2HG2      ILE  41  -3.626  -7.442   0.657
  344   HG23  ILE  41          3HG2      ILE  41  -2.236  -6.376   0.339
  345   HD11  ILE  41          3HD1      ILE  41  -5.468  -3.083   0.874
  346   HD12  ILE  41          1HD1      ILE  41  -4.227  -1.940   0.320
  347   HD13  ILE  41          2HD1      ILE  41  -5.072  -2.965  -0.858
  348    H    ARG  42           HN       ARG  42  -3.156  -7.909  -2.288
  349    HA   ARG  42           HA       ARG  42  -5.684  -9.450  -2.280
  350    HB2  ARG  42           2HB      ARG  42  -2.983  -9.915  -3.555
  351    HB3  ARG  42           3HB      ARG  42  -4.218 -11.193  -3.450
  352    HG2  ARG  42           2HG      ARG  42  -4.492 -10.329  -5.586
  353    HG3  ARG  42           3HG      ARG  42  -5.763  -9.518  -4.640
  354    HD2  ARG  42           2HD      ARG  42  -4.671  -7.477  -4.672
  355    HD3  ARG  42           3HD      ARG  42  -3.076  -8.214  -4.939
  356    HE   ARG  42           HE       ARG  42  -5.166  -7.709  -6.971
  357   HH11  ARG  42          2HH1      ARG  42  -1.959  -8.886  -6.119
  358   HH12  ARG  42          1HH1      ARG  42  -1.384  -8.905  -7.770
  359   HH21  ARG  42          2HH2      ARG  42  -4.405  -7.749  -9.133
  360   HH22  ARG  42          1HH2      ARG  42  -2.769  -8.262  -9.476
  361    H    LYS  43           HN       LYS  43  -2.253  -9.856  -1.287
  362    HA   LYS  43           HA       LYS  43  -3.231 -11.900   0.642
  363    HB2  LYS  43           2HB      LYS  43  -0.930 -11.932  -1.283
  364    HB3  LYS  43           3HB      LYS  43  -0.794 -12.817   0.256
  365    HG2  LYS  43           2HG      LYS  43  -3.009 -13.208  -1.772
  366    HG3  LYS  43           3HG      LYS  43  -1.555 -14.224  -1.642
  367    HD2  LYS  43           2HD      LYS  43  -2.178 -14.704   0.732
  368    HD3  LYS  43           3HD      LYS  43  -3.698 -13.816   0.464
  369    HE2  LYS  43           2HE      LYS  43  -4.329 -15.385  -1.295
  370    HE3  LYS  43           3HE      LYS  43  -2.791 -16.252  -1.096
  371    HZ1  LYS  43           3HZ      LYS  43  -4.881 -15.981   0.959
  372    HZ2  LYS  43           1HZ      LYS  43  -4.578 -17.335   0.070
  373    HZ3  LYS  43           2HZ      LYS  43  -3.454 -16.785   1.142
  374    H    VAL  44           HN       VAL  44  -2.764 -11.615   2.661
  375    HA   VAL  44           HA       VAL  44  -0.336 -10.041   3.371
  376    HB   VAL  44           HB       VAL  44  -2.891 -10.315   5.006
  377   HG11  VAL  44          1HG1      VAL  44  -1.859  -8.635   6.477
  378   HG12  VAL  44          2HG1      VAL  44  -0.862 -10.103   6.366
  379   HG13  VAL  44          3HG1      VAL  44  -0.400  -8.643   5.459
  380   HG21  VAL  44          3HG2      VAL  44  -3.247  -8.892   3.041
  381   HG22  VAL  44          1HG2      VAL  44  -3.252  -7.928   4.536
  382   HG23  VAL  44          2HG2      VAL  44  -1.821  -7.921   3.480
  383    H    ALA  45           HN       ALA  45   1.171 -11.229   4.397
  384    HA   ALA  45           HA       ALA  45   0.658 -14.027   4.874
  385    HB1  ALA  45           1HB      ALA  45   3.009 -14.091   5.601
  386    HB2  ALA  45           2HB      ALA  45   2.827 -13.208   4.067
  387    HB3  ALA  45           3HB      ALA  45   3.060 -12.313   5.588
  388    HA   PRO  46           HA       PRO  46  -0.690 -14.053   9.052
  389    HB2  PRO  46           2HB      PRO  46   0.652 -16.312  10.015
  390    HB3  PRO  46           3HB      PRO  46  -0.809 -16.346   8.974
  391    HG2  PRO  46           2HG      PRO  46   2.054 -16.592   8.173
  392    HG3  PRO  46           3HG      PRO  46   0.659 -17.605   7.673
  393    HD2  PRO  46           2HD      PRO  46   1.633 -15.671   6.079
  394    HD3  PRO  46           3HD      PRO  46  -0.134 -15.913   6.231
  395    H    LEU  47           HN       LEU  47   2.693 -13.888   8.271
  396    HA   LEU  47           HA       LEU  47   3.257 -12.914  11.027
  397    HB2  LEU  47           2HB      LEU  47   5.587 -13.374  10.623
  398    HB3  LEU  47           3HB      LEU  47   4.620 -14.835  10.310
  399    HG   LEU  47           HG       LEU  47   5.548 -13.009   8.092
  400   HD11  LEU  47          1HD1      LEU  47   7.443 -14.549   7.766
  401   HD12  LEU  47          2HD1      LEU  47   7.519 -13.754   9.355
  402   HD13  LEU  47          3HD1      LEU  47   6.966 -15.442   9.229
  403   HD21  LEU  47          3HD2      LEU  47   3.747 -14.594   7.555
  404   HD22  LEU  47          1HD2      LEU  47   5.251 -15.033   6.714
  405   HD23  LEU  47          2HD2      LEU  47   4.745 -15.939   8.158
  406    H    GLY  48           HN       GLY  48   2.266 -11.744   8.195
  407    HA2  GLY  48           1HA      GLY  48   2.197  -9.344   7.943
  408    HA3  GLY  48           2HA      GLY  48   3.865  -9.266   8.555
  409    H    ASP  49           HN       ASP  49   5.565 -10.250   7.202
  410    HA   ASP  49           HA       ASP  49   5.069  -9.386   4.430
  411    HB2  ASP  49           2HB      ASP  49   7.500  -9.405   4.207
  412    HB3  ASP  49           3HB      ASP  49   7.019  -8.498   5.657
  413    HD2  ASP  49           2HD      ASP  49   8.387 -10.973   7.760
  414    HA   PRO  50           HA       PRO  50   5.946  -9.465   2.699
  415    HB2  PRO  50           2HB      PRO  50   5.805 -10.504   0.077
  416    HB3  PRO  50           3HB      PRO  50   7.300 -10.294   1.046
  417    HG2  PRO  50           2HG      PRO  50   6.066 -12.725   0.230
  418    HG3  PRO  50           3HG      PRO  50   7.578 -12.513   1.173
  419    HD2  PRO  50           2HD      PRO  50   4.798 -13.148   2.064
  420    HD3  PRO  50           3HD      PRO  50   6.362 -13.462   2.877
  421    H    ILE  51           HN       ILE  51   4.534  -8.145   1.418
  422    HA   ILE  51           HA       ILE  51   1.750  -9.189   1.431
  423    HB   ILE  51           HB       ILE  51   2.762  -6.313   1.428
  424   HG12  ILE  51          2HG1      ILE  51   1.498  -7.981   3.629
  425   HG13  ILE  51          3HG1      ILE  51   3.210  -7.505   3.531
  426   HG21  ILE  51          1HG2      ILE  51   0.413  -5.708   1.850
  427   HG22  ILE  51          2HG2      ILE  51   0.595  -6.555   0.297
  428   HG23  ILE  51          3HG2      ILE  51  -0.053  -7.419   1.712
  429   HD11  ILE  51          3HD1      ILE  51   0.855  -5.622   3.824
  430   HD12  ILE  51          1HD1      ILE  51   1.980  -6.083   5.119
  431   HD13  ILE  51          2HD1      ILE  51   2.568  -5.149   3.728
  432    H    GLN  52           HN       GLN  52   0.659  -9.445  -0.423
  433    HA   GLN  52           HA       GLN  52   1.989  -8.553  -2.919
  434    HB2  GLN  52           2HB      GLN  52  -0.135 -10.630  -2.346
  435    HB3  GLN  52           3HB      GLN  52   0.229 -10.064  -3.994
  436    HG2  GLN  52           2HG      GLN  52   1.442 -12.043  -3.773
  437    HG3  GLN  52           3HG      GLN  52   2.642 -10.756  -3.517
  438   HE21  GLN  52          1HE2      GLN  52   3.571 -10.466  -1.484
  439   HE22  GLN  52          2HE2      GLN  52   3.418 -11.663  -0.214
  440    H    ILE  53           HN       ILE  53   1.350  -6.668  -3.705
  441    HA   ILE  53           HA       ILE  53  -1.540  -5.987  -3.503
  442    HB   ILE  53           HB       ILE  53  -0.850  -3.584  -3.367
  443   HG12  ILE  53          2HG1      ILE  53   1.918  -4.733  -2.876
  444   HG13  ILE  53          3HG1      ILE  53   1.405  -3.869  -4.346
  445   HG21  ILE  53          1HG2      ILE  53  -0.218  -3.632  -0.987
  446   HG22  ILE  53          2HG2      ILE  53  -1.480  -4.833  -1.348
  447   HG23  ILE  53          3HG2      ILE  53   0.210  -5.353  -1.136
  448   HD11  ILE  53          3HD1      ILE  53   1.515  -2.711  -1.549
  449   HD12  ILE  53          1HD1      ILE  53   2.685  -2.396  -2.848
  450   HD13  ILE  53          2HD1      ILE  53   1.005  -1.848  -3.020
  451    H    ASN  54           HN       ASN  54  -2.252  -4.401  -5.159
  452    HA   ASN  54           HA       ASN  54  -0.647  -4.670  -7.662
  453    HB2  ASN  54           2HB      ASN  54  -2.719  -5.993  -7.772
  454    HB3  ASN  54           3HB      ASN  54  -3.670  -4.550  -7.360
  455   HD21  ASN  54          1HD2      ASN  54  -1.827  -6.210  -9.850
  456   HD22  ASN  54          2HD2      ASN  54  -2.327  -5.189 -11.183
  457    H    VAL  55           HN       VAL  55   0.088  -2.809  -8.437
  458    HA   VAL  55           HA       VAL  55  -1.494  -0.352  -7.894
  459    HB   VAL  55           HB       VAL  55   1.543  -0.508  -7.772
  460   HG11  VAL  55          1HG1      VAL  55   1.391   1.802  -6.940
  461   HG12  VAL  55          2HG1      VAL  55   0.670   1.643  -8.559
  462   HG13  VAL  55          3HG1      VAL  55  -0.377   1.749  -7.124
  463   HG21  VAL  55          3HG2      VAL  55   0.553  -1.639  -5.841
  464   HG22  VAL  55          1HG2      VAL  55   1.324  -0.111  -5.358
  465   HG23  VAL  55          2HG2      VAL  55  -0.446  -0.204  -5.506
  466    H    ARG  56           HN       ARG  56  -1.882   0.813  -9.673
  467    HA   ARG  56           HA       ARG  56  -1.749   1.635 -11.796
  468    HB2  ARG  56           2HB      ARG  56   1.099   0.581 -11.773
  469    HB3  ARG  56           3HB      ARG  56   0.409   1.713 -12.959
  470    HG2  ARG  56           2HG      ARG  56   0.791   2.229  -9.999
  471    HG3  ARG  56           3HG      ARG  56   1.777   2.891 -11.324
  472    HD2  ARG  56           2HD      ARG  56  -0.167   4.058 -12.218
  473    HD3  ARG  56           3HD      ARG  56  -1.195   3.355 -10.952
  474    HE   ARG  56           HE       ARG  56   0.967   4.741  -9.736
  475   HH11  ARG  56          2HH1      ARG  56  -1.993   5.310 -11.559
  476   HH12  ARG  56          1HH1      ARG  56  -2.271   6.891 -10.864
  477   HH21  ARG  56          2HH2      ARG  56   0.604   6.809  -8.837
  478   HH22  ARG  56          1HH2      ARG  56  -0.796   7.742  -9.318
  479    H    GLY  57           HN       GLY  57  -2.073  -1.423 -11.044
  480    HA2  GLY  57           1HA      GLY  57  -3.049  -3.043 -12.486
  481    HA3  GLY  57           2HA      GLY  57  -2.209  -2.304 -13.869
  482    H    TYR  58           HN       TYR  58   0.204  -2.182 -11.893
  483    HA   TYR  58           HA       TYR  58   1.319  -4.730 -12.823
  484    HB2  TYR  58           2HB      TYR  58   2.569  -2.425 -11.285
  485    HB3  TYR  58           3HB      TYR  58   3.444  -3.826 -11.926
  486    HD1  TYR  58           1HD      TYR  58   3.811  -4.059 -14.352
  487    HD2  TYR  58           2HD      TYR  58   1.835  -0.637 -12.756
  488    HE1  TYR  58           1HE      TYR  58   4.171  -2.864 -16.469
  489    HE2  TYR  58           2HE      TYR  58   2.183   0.553 -14.874
  490    HH   TYR  58           HH       TYR  58   3.044   0.481 -16.973
  491    H    GLU  59           HN       GLU  59   2.350  -6.245 -11.472
  492    HA   GLU  59           HA       GLU  59   1.079  -6.536  -8.845
  493    HB2  GLU  59           2HB      GLU  59   3.117  -8.274 -10.280
  494    HB3  GLU  59           3HB      GLU  59   2.218  -8.706  -8.806
  495    HG2  GLU  59           2HG      GLU  59   0.981  -8.153 -11.513
  496    HG3  GLU  59           3HG      GLU  59   1.307  -9.764 -10.840
  497    HE2  GLU  59           2HE      GLU  59  -1.349  -9.447  -8.561
  498    H    LEU  60           HN       LEU  60   1.948  -5.788  -7.019
  499    HA   LEU  60           HA       LEU  60   4.899  -5.395  -6.973
  500    HB2  LEU  60           2HB      LEU  60   2.656  -3.694  -5.959
  501    HB3  LEU  60           3HB      LEU  60   4.190  -3.722  -5.055
  502    HG   LEU  60           HG       LEU  60   4.229  -1.831  -6.484
  503   HD11  LEU  60          1HD1      LEU  60   6.181  -2.290  -7.905
  504   HD12  LEU  60          2HD1      LEU  60   6.327  -3.079  -6.318
  505   HD13  LEU  60          3HD1      LEU  60   5.880  -4.036  -7.751
  506   HD21  LEU  60          3HD2      LEU  60   2.481  -2.489  -8.060
  507   HD22  LEU  60          1HD2      LEU  60   3.936  -1.941  -8.920
  508   HD23  LEU  60          2HD2      LEU  60   3.583  -3.678  -8.797
  509    H    SER  61           HN       SER  61   6.005  -6.412  -5.453
  510    HA   SER  61           HA       SER  61   4.493  -7.498  -3.126
  511    HB2  SER  61           2HB      SER  61   6.258  -9.323  -3.132
  512    HB3  SER  61           3HB      SER  61   5.097  -9.370  -4.481
  513    HG   SER  61           HG       SER  61   7.274  -9.651  -5.170
  514    H    LEU  62           HN       LEU  62   4.989  -6.209  -1.455
  515    HA   LEU  62           HA       LEU  62   7.801  -5.249  -1.278
  516    HB2  LEU  62           2HB      LEU  62   5.227  -4.101  -0.171
  517    HB3  LEU  62           3HB      LEU  62   6.850  -3.497   0.241
  518    HG   LEU  62           HG       LEU  62   5.565  -3.494  -2.503
  519   HD11  LEU  62          1HD1      LEU  62   5.608  -1.047  -2.245
  520   HD12  LEU  62          2HD1      LEU  62   4.638  -1.819  -0.969
  521   HD13  LEU  62          3HD1      LEU  62   6.281  -1.234  -0.608
  522   HD21  LEU  62          3HD2      LEU  62   7.988  -3.870  -2.625
  523   HD22  LEU  62          1HD2      LEU  62   7.564  -2.246  -3.212
  524   HD23  LEU  62          2HD2      LEU  62   8.266  -2.450  -1.590
  525    H    ARG  63           HN       ARG  63   8.905  -5.326   0.676
  526    HA   ARG  63           HA       ARG  63   8.182  -7.494   2.438
  527    HB2  ARG  63           2HB      ARG  63  10.531  -6.730   1.853
  528    HB3  ARG  63           3HB      ARG  63  10.248  -5.323   2.906
  529    HG2  ARG  63           2HG      ARG  63  11.446  -6.917   4.186
  530    HG3  ARG  63           3HG      ARG  63   9.764  -6.944   4.770
  531    HD2  ARG  63           2HD      ARG  63  10.174  -9.201   4.593
  532    HD3  ARG  63           3HD      ARG  63   9.518  -8.870   2.976
  533    HE   ARG  63           HE       ARG  63  12.449  -8.876   3.465
  534   HH11  ARG  63          2HH1      ARG  63   9.615 -10.086   1.756
  535   HH12  ARG  63          1HH1      ARG  63  10.554 -11.034   0.626
  536   HH21  ARG  63          2HH2      ARG  63  13.654 -10.129   2.019
  537   HH22  ARG  63          1HH2      ARG  63  12.846 -11.058   0.775
  538    H    LYS  64           HN       LYS  64   8.003  -7.238   4.763
  539    HA   LYS  64           HA       LYS  64   5.923  -5.715   5.726
  540    HB2  LYS  64           2HB      LYS  64   6.918  -7.569   6.905
  541    HB3  LYS  64           3HB      LYS  64   8.459  -6.694   7.068
  542    HG2  LYS  64           2HG      LYS  64   7.167  -4.996   8.458
  543    HG3  LYS  64           3HG      LYS  64   5.854  -6.197   8.499
  544    HD2  LYS  64           2HD      LYS  64   8.718  -6.748   9.338
  545    HD3  LYS  64           3HD      LYS  64   7.405  -6.319  10.461
  546    HE2  LYS  64           2HE      LYS  64   6.209  -8.319   9.969
  547    HE3  LYS  64           3HE      LYS  64   7.255  -8.687   8.581
  548    HZ1  LYS  64           3HZ      LYS  64   8.095  -8.666  11.402
  549    HZ2  LYS  64           1HZ      LYS  64   7.817 -10.012  10.493
  550    HZ3  LYS  64           2HZ      LYS  64   9.068  -9.006  10.115
  551    H    SER  65           HN       SER  65   9.380  -4.843   5.670
  552    HA   SER  65           HA       SER  65   9.265  -2.526   7.248
  553    HB2  SER  65           2HB      SER  65  11.346  -1.911   5.828
  554    HB3  SER  65           3HB      SER  65  11.389  -3.419   6.772
  555    HG   SER  65           HG       SER  65  12.098  -3.708   4.598
  556    H    ALA  66           HN       ALA  66   8.999  -2.795   3.666
  557    HA   ALA  66           HA       ALA  66   8.829   0.020   3.246
  558    HB1  ALA  66           1HB      ALA  66   8.089  -0.578   0.977
  559    HB2  ALA  66           2HB      ALA  66   9.478  -1.564   1.488
  560    HB3  ALA  66           3HB      ALA  66   7.840  -2.259   1.502
  561    H    ALA  67           HN       ALA  67   6.288  -2.512   3.307
  562    HA   ALA  67           HA       ALA  67   4.085  -0.810   2.839
  563    HB1  ALA  67           1HB      ALA  67   2.745  -2.617   3.847
  564    HB2  ALA  67           2HB      ALA  67   3.984  -3.270   2.750
  565    HB3  ALA  67           3HB      ALA  67   4.227  -3.343   4.512
  566    H    GLU  68           HN       GLU  68   5.961  -1.461   5.667
  567    HA   GLU  68           HA       GLU  68   4.043  -0.653   7.634
  568    HB2  GLU  68           2HB      GLU  68   6.050  -2.168   7.879
  569    HB3  GLU  68           3HB      GLU  68   7.064  -0.707   7.808
  570    HG2  GLU  68           2HG      GLU  68   5.989   0.150   9.809
  571    HG3  GLU  68           3HG      GLU  68   4.939  -1.283   9.872
  572    HE2  GLU  68           2HE      GLU  68   8.644  -1.573  11.184
  573    H    MET  69           HN       MET  69   6.337   1.047   5.605
  574    HA   MET  69           HA       MET  69   6.104   3.470   7.287
  575    HB2  MET  69           2HB      MET  69   7.839   2.797   4.894
  576    HB3  MET  69           3HB      MET  69   7.820   4.380   5.709
  577    HG2  MET  69           2HG      MET  69   8.558   3.335   7.789
  578    HG3  MET  69           3HG      MET  69   8.531   1.740   7.016
  579    HE1  MET  69           3HE      MET  69  11.023   1.384   7.892
  580    HE2  MET  69           1HE      MET  69  12.361   2.504   7.547
  581    HE3  MET  69           2HE      MET  69  11.022   3.019   8.598
  582    H    ILE  70           HN       ILE  70   4.434   2.018   4.816
  583    HA   ILE  70           HA       ILE  70   3.810   4.533   3.416
  584    HB   ILE  70           HB       ILE  70   2.776   1.704   2.970
  585   HG12  ILE  70          2HG1      ILE  70   4.802   3.343   1.416
  586   HG13  ILE  70          3HG1      ILE  70   5.181   1.983   2.500
  587   HG21  ILE  70          1HG2      ILE  70   1.896   2.581   0.841
  588   HG22  ILE  70          2HG2      ILE  70   1.173   3.416   2.234
  589   HG23  ILE  70          3HG2      ILE  70   2.451   4.211   1.285
  590   HD11  ILE  70          3HD1      ILE  70   3.545   1.826  -0.046
  591   HD12  ILE  70          1HD1      ILE  70   5.224   1.280   0.141
  592   HD13  ILE  70          2HD1      ILE  70   3.926   0.467   1.038
  593    H    GLU  71           HN       GLU  71   2.245   5.823   4.090
  594    HA   GLU  71           HA       GLU  71   0.155   4.712   5.868
  595    HB2  GLU  71           2HB      GLU  71   1.178   6.667   6.764
  596    HB3  GLU  71           3HB      GLU  71   1.041   7.533   5.214
  597    HG2  GLU  71           2HG      GLU  71  -1.057   8.198   5.636
  598    HG3  GLU  71           3HG      GLU  71  -1.532   6.615   6.287
  599    HE2  GLU  71           2HE      GLU  71  -1.658   8.227   9.329
  600    H    VAL  72           HN       VAL  72  -1.689   4.116   5.030
  601    HA   VAL  72           HA       VAL  72  -2.616   5.508   2.576
  602    HB   VAL  72           HB       VAL  72  -3.703   3.390   1.875
  603   HG11  VAL  72          1HG1      VAL  72  -1.666   2.254   1.095
  604   HG12  VAL  72          2HG1      VAL  72  -1.524   4.021   0.950
  605   HG13  VAL  72          3HG1      VAL  72  -0.705   3.168   2.280
  606   HG21  VAL  72          3HG2      VAL  72  -3.877   2.322   4.074
  607   HG22  VAL  72          1HG2      VAL  72  -3.040   1.262   2.916
  608   HG23  VAL  72          2HG2      VAL  72  -2.106   2.154   4.140
  609    H    GLU  73           HN       GLU  73  -4.971   5.331   2.264
  610    HA   GLU  73           HA       GLU  73  -6.377   5.377   4.894
  611    HB2  GLU  73           2HB      GLU  73  -6.179   7.602   3.910
  612    HB3  GLU  73           3HB      GLU  73  -6.851   7.006   2.374
  613    HG2  GLU  73           2HG      GLU  73  -8.558   8.203   3.529
  614    HG3  GLU  73           3HG      GLU  73  -8.961   6.472   3.569
  615    HE2  GLU  73           2HE      GLU  73  -8.487   8.384   6.951
  616    H    LEU  74           HN       LEU  74  -8.565   4.573   4.889
  617    HA   LEU  74           HA       LEU  74  -8.905   2.344   3.043
  618    HB2  LEU  74           2HB      LEU  74  -9.729   2.943   5.639
  619    HB3  LEU  74           3HB      LEU  74 -11.226   2.992   4.678
  620    HG   LEU  74           HG       LEU  74 -10.914   0.789   5.631
  621   HD11  LEU  74          1HD1      LEU  74 -11.014  -0.572   3.584
  622   HD12  LEU  74          2HD1      LEU  74 -11.943   0.934   3.411
  623   HD13  LEU  74          3HD1      LEU  74 -10.340   0.783   2.652
  624   HD21  LEU  74          3HD2      LEU  74  -8.474   0.845   5.891
  625   HD22  LEU  74          1HD2      LEU  74  -8.989  -0.624   5.031
  626   HD23  LEU  74          2HD2      LEU  74  -8.279   0.732   4.125
  627    H    GLU  75           HN       GLU  75  -8.781   4.314   1.391
  628    HA   GLU  75           HA       GLU  75  -9.786   5.374  -0.339
  629    HB2  GLU  75           2HB      GLU  75 -10.933   3.197  -0.603
  630    HB3  GLU  75           3HB      GLU  75 -12.256   3.795   0.424
  631    HG2  GLU  75           2HG      GLU  75 -12.606   5.633  -1.241
  632    HG3  GLU  75           3HG      GLU  75 -11.421   4.827  -2.292
  633    HE2  GLU  75           2HE      GLU  75 -13.763   2.550  -3.352
  634    H    HIS  76           HN       HIS  76  -9.522   7.337   0.874
  635    HA   HIS  76           HA       HIS  76 -12.090   8.467   1.876
  636    HB2  HIS  76           2HB      HIS  76  -9.510   8.613   2.894
  637    HB3  HIS  76           3HB      HIS  76  -9.688  10.153   2.030
  638    HD1  HIS  76           1HD      HIS  76  -9.793   9.226   5.291
  639    HD2  HIS  76           2HD      HIS  76 -12.715  10.954   2.853
  640    HE1  HIS  76           1HE      HIS  76 -11.432  10.368   6.851
  641    HE2  HIS  76           2HE      HIS  76 -13.205  11.415   5.365
  642    H    HIS  77           HN       HIS  77 -13.231   9.610   0.462
  643    HA   HIS  77           HA       HIS  77 -13.797  10.938  -1.304
  644    HB2  HIS  77           2HB      HIS  77 -10.838  11.596  -1.383
  645    HB3  HIS  77           3HB      HIS  77 -12.027  12.290  -2.500
  646    HD1  HIS  77           1HD      HIS  77 -12.846  14.502  -1.817
  647    HD2  HIS  77           2HD      HIS  77 -11.718  12.187   1.467
  648    HE1  HIS  77           1HE      HIS  77 -13.145  15.977   0.215
  649    HE2  HIS  77           2HE      HIS  77 -12.455  14.568   2.212
  650    H    HIS  78           HN       HIS  78 -14.139  10.647  -3.487
  651    HA   HIS  78           HA       HIS  78 -12.606   8.389  -4.688
  652    HB2  HIS  78           2HB      HIS  78 -15.430   9.369  -5.212
  653    HB3  HIS  78           3HB      HIS  78 -14.611   8.106  -6.149
  654    HD1  HIS  78           1HD      HIS  78 -16.595   8.672  -3.103
  655    HD2  HIS  78           2HD      HIS  78 -14.049   5.717  -4.596
  656    HE1  HIS  78           1HE      HIS  78 -17.020   6.603  -1.707
  657    HE2  HIS  78           2HE      HIS  78 -15.470   4.810  -2.615
  658    H    HIS  79           HN       HIS  79 -14.092  11.553  -5.267
  659    HA   HIS  79           HA       HIS  79 -11.954  12.252  -7.108
  660    HB2  HIS  79           2HB      HIS  79 -13.423  12.849  -8.989
  661    HB3  HIS  79           3HB      HIS  79 -13.407  11.102  -8.680
  662    HD1  HIS  79           1HD      HIS  79 -15.662  13.830  -9.335
  663    HD2  HIS  79           2HD      HIS  79 -15.833  10.301  -7.107
  664    HE1  HIS  79           1HE      HIS  79 -18.121  13.334  -8.982
  665    HE2  HIS  79           2HE      HIS  79 -18.222  11.188  -7.629
  666    H    HIS  80           HN       HIS  80 -11.905  14.542  -7.520
  667    HA   HIS  80           HA       HIS  80 -12.729  15.946  -5.161
  668    HB2  HIS  80           2HB      HIS  80 -10.650  16.444  -6.407
  669    HB3  HIS  80           3HB      HIS  80 -11.620  17.044  -7.764
  670    HD1  HIS  80           1HD      HIS  80 -10.405  17.954  -4.340
  671    HD2  HIS  80           2HD      HIS  80 -12.833  19.568  -7.333
  672    HE1  HIS  80           1HE      HIS  80 -10.791  20.377  -3.709
  673    HE2  HIS  80           2HE      HIS  80 -12.261  21.353  -5.534
  674    H    HIS  81           HN       HIS  81 -14.675  16.659  -4.727
  675    HA   HIS  81           HA       HIS  81 -15.958  18.464  -6.616
  676    HB2  HIS  81           2HB      HIS  81 -16.855  16.229  -7.297
  677    HB3  HIS  81           3HB      HIS  81 -17.491  16.025  -5.654
  678    HD1  HIS  81           1HD      HIS  81 -18.066  17.892  -8.864
  679    HD2  HIS  81           2HD      HIS  81 -19.762  17.597  -5.055
  680    HE1  HIS  81           1HE      HIS  81 -20.301  19.082  -8.989
  681    HE2  HIS  81           2HE      HIS  81 -21.322  18.900  -6.674
  Start of MODEL   15
    1    H1   MET   1           HN       MET   1  -2.176   6.321  13.427
    2    HA   MET   1           HA       MET   1  -2.003   7.560  10.879
    3    HB2  MET   1           2HB      MET   1   0.150   6.803  10.058
    4    HB3  MET   1           3HB      MET   1   0.372   7.879  11.458
    5    HG2  MET   1           2HG      MET   1   1.899   6.238  11.932
    6    HG3  MET   1           3HG      MET   1   0.480   5.626  12.798
    7    HE1  MET   1           3HE      MET   1   2.819   5.250   9.679
    8    HE2  MET   1           1HE      MET   1   1.984   4.009   8.717
    9    HE3  MET   1           2HE      MET   1   1.258   5.622   8.909
   10    H    PHE   2           HN       PHE   2  -2.241   6.053   9.143
   11    HA   PHE   2           HA       PHE   2  -2.821   3.270  10.061
   12    HB2  PHE   2           2HB      PHE   2  -4.859   4.587   9.477
   13    HB3  PHE   2           3HB      PHE   2  -4.202   4.832   7.850
   14    HD1  PHE   2           2HD      PHE   2  -5.529   2.314  10.206
   15    HD2  PHE   2           1HD      PHE   2  -4.326   3.109   6.200
   16    HE1  PHE   2           2HE      PHE   2  -6.555   0.205   9.481
   17    HE2  PHE   2           1HE      PHE   2  -5.353   1.001   5.471
   18    HZ   PHE   2           HZ       PHE   2  -6.471  -0.454   7.112
   19    H    SER   3           HN       SER   3  -1.303   1.942   9.301
   20    HA   SER   3           HA       SER   3   0.356   2.832   7.059
   21    HB2  SER   3           2HB      SER   3   1.628   0.705   7.656
   22    HB3  SER   3           3HB      SER   3   1.539   1.951   8.925
   23    HG   SER   3           HG       SER   3   1.062  -0.155   9.713
   24    H    LEU   4           HN       LEU   4   0.961   1.375   5.307
   25    HA   LEU   4           HA       LEU   4  -1.350   0.346   3.959
   26    HB2  LEU   4           2HB      LEU   4   0.622   1.314   2.828
   27    HB3  LEU   4           3HB      LEU   4   1.594  -0.075   3.365
   28    HG   LEU   4           HG       LEU   4   0.191  -1.573   2.019
   29   HD11  LEU   4          1HD1      LEU   4  -1.423  -0.646   0.407
   30   HD12  LEU   4          2HD1      LEU   4  -1.895  -0.282   2.083
   31   HD13  LEU   4          3HD1      LEU   4  -1.150   0.981   1.074
   32   HD21  LEU   4          3HD2      LEU   4   2.233  -0.603   1.060
   33   HD22  LEU   4          1HD2      LEU   4   0.987  -0.833  -0.190
   34   HD23  LEU   4          2HD2      LEU   4   1.297   0.791   0.468
   35    H    ARG   5           HN       ARG   5   1.158  -1.089   5.971
   36    HA   ARG   5           HA       ARG   5   0.548  -3.831   5.275
   37    HB2  ARG   5           2HB      ARG   5   1.957  -4.379   7.216
   38    HB3  ARG   5           3HB      ARG   5   2.734  -3.179   6.154
   39    HG2  ARG   5           2HG      ARG   5   3.164  -2.165   8.126
   40    HG3  ARG   5           3HG      ARG   5   1.527  -1.512   7.875
   41    HD2  ARG   5           2HD      ARG   5   0.882  -3.793   9.135
   42    HD3  ARG   5           3HD      ARG   5   2.504  -3.546   9.819
   43    HE   ARG   5           HE       ARG   5   0.459  -1.388   9.888
   44   HH11  ARG   5          2HH1      ARG   5   2.934  -3.318  11.465
   45   HH12  ARG   5          1HH1      ARG   5   2.660  -2.607  13.039
   46   HH21  ARG   5          2HH2      ARG   5   0.033  -0.540  11.956
   47   HH22  ARG   5          1HH2      ARG   5   1.015  -1.032  13.317
   48    H    ASP   6           HN       ASP   6  -1.181  -1.512   6.916
   49    HA   ASP   6           HA       ASP   6  -2.313  -3.370   8.929
   50    HB2  ASP   6           2HB      ASP   6  -1.574  -0.959   9.403
   51    HB3  ASP   6           3HB      ASP   6  -2.994  -0.457   8.460
   52    HD2  ASP   6           2HD      ASP   6  -4.333  -0.462  11.684
   53    H    ALA   7           HN       ALA   7  -2.718  -2.688   5.745
   54    HA   ALA   7           HA       ALA   7  -5.653  -2.667   5.754
   55    HB1  ALA   7           1HB      ALA   7  -5.425  -2.552   3.308
   56    HB2  ALA   7           2HB      ALA   7  -4.443  -1.306   4.111
   57    HB3  ALA   7           3HB      ALA   7  -3.667  -2.771   3.461
   58    H    LYS   8           HN       LYS   8  -6.950  -4.366   5.395
   59    HA   LYS   8           HA       LYS   8  -5.737  -7.001   5.549
   60    HB2  LYS   8           2HB      LYS   8  -8.595  -6.021   5.397
   61    HB3  LYS   8           3HB      LYS   8  -8.165  -7.748   5.416
   62    HG2  LYS   8           2HG      LYS   8  -7.560  -5.715   7.576
   63    HG3  LYS   8           3HG      LYS   8  -8.792  -6.999   7.638
   64    HD2  LYS   8           2HD      LYS   8  -6.840  -8.631   7.240
   65    HD3  LYS   8           3HD      LYS   8  -5.782  -7.263   7.659
   66    HE2  LYS   8           2HE      LYS   8  -6.175  -8.589   9.642
   67    HE3  LYS   8           3HE      LYS   8  -7.009  -7.029   9.813
   68    HZ1  LYS   8           3HZ      LYS   8  -8.271  -9.567   9.012
   69    HZ2  LYS   8           1HZ      LYS   8  -8.395  -8.857  10.495
   70    HZ3  LYS   8           2HZ      LYS   8  -9.044  -8.118   9.171
   71    H    CYS   9           HN       CYS   9  -6.379  -8.774   4.150
   72    HA   CYS   9           HA       CYS   9  -5.786  -8.219   1.414
   73    HB2  CYS   9           2HB      CYS   9  -5.180 -10.315   2.418
   74    HB3  CYS   9           3HB      CYS   9  -6.873 -10.654   2.854
   75    HG   CYS   9           HG       CYS   9  -6.082 -12.314   0.997
   76    H    GLY  10           HN       GLY  10  -7.051  -7.773  -0.291
   77    HA2  GLY  10           1HA      GLY  10  -8.985  -8.077  -1.614
   78    HA3  GLY  10           2HA      GLY  10  -9.897  -8.547  -0.161
   79    H    GLN  11           HN       GLN  11  -8.086  -5.843   0.598
   80    HA   GLN  11           HA       GLN  11 -10.452  -4.121   0.061
   81    HB2  GLN  11           2HB      GLN  11  -8.273  -3.866   2.156
   82    HB3  GLN  11           3HB      GLN  11  -9.625  -2.732   1.925
   83    HG2  GLN  11           2HG      GLN  11 -11.208  -4.557   2.441
   84    HG3  GLN  11           3HG      GLN  11  -9.832  -5.644   2.733
   85   HE21  GLN  11          1HE2      GLN  11  -8.208  -3.462   3.937
   86   HE22  GLN  11          2HE2      GLN  11  -8.866  -3.225   5.542
   87    H    THR  12           HN       THR  12 -10.209  -2.080  -0.799
   88    HA   THR  12           HA       THR  12  -7.549  -1.535  -1.994
   89    HB   THR  12           HB       THR  12 -10.266  -0.350  -2.693
   90    HG1  THR  12           1HG      THR  12 -10.027  -1.688  -4.565
   91   HG21  THR  12          3HG2      THR  12  -7.574  -0.149  -4.088
   92   HG22  THR  12          1HG2      THR  12  -9.106   0.527  -4.686
   93   HG23  THR  12          2HG2      THR  12  -8.384   1.155  -3.188
   94    H    VAL  13           HN       VAL  13  -6.326  -0.169  -0.892
   95    HA   VAL  13           HA       VAL  13  -7.677   2.029   0.595
   96    HB   VAL  13           HB       VAL  13  -5.604   2.103   2.000
   97   HG11  VAL  13          1HG1      VAL  13  -6.146   0.115   3.348
   98   HG12  VAL  13          2HG1      VAL  13  -7.618   0.934   2.775
   99   HG13  VAL  13          3HG1      VAL  13  -7.063  -0.559   1.981
  100   HG21  VAL  13          3HG2      VAL  13  -4.065   1.039   0.412
  101   HG22  VAL  13          1HG2      VAL  13  -4.072   0.177   1.967
  102   HG23  VAL  13          2HG2      VAL  13  -4.950  -0.497   0.575
  103    H    LYS  14           HN       LYS  14  -6.586   4.103   0.610
  104    HA   LYS  14           HA       LYS  14  -5.057   4.475  -1.917
  105    HB2  LYS  14           2HB      LYS  14  -7.210   5.571  -1.920
  106    HB3  LYS  14           3HB      LYS  14  -6.858   6.344  -0.355
  107    HG2  LYS  14           2HG      LYS  14  -5.161   7.724  -1.348
  108    HG3  LYS  14           3HG      LYS  14  -5.288   6.852  -2.894
  109    HD2  LYS  14           2HD      LYS  14  -6.472   9.038  -2.905
  110    HD3  LYS  14           3HD      LYS  14  -7.548   7.656  -3.218
  111    HE2  LYS  14           2HE      LYS  14  -8.190   7.687  -0.802
  112    HE3  LYS  14           3HE      LYS  14  -7.222   9.164  -0.606
  113    HZ1  LYS  14           3HZ      LYS  14  -9.527   8.853  -2.408
  114    HZ2  LYS  14           1HZ      LYS  14  -9.533   9.658  -0.970
  115    HZ3  LYS  14           2HZ      LYS  14  -8.628  10.224  -2.226
  116    H    VAL  15           HN       VAL  15  -3.041   5.207  -1.853
  117    HA   VAL  15           HA       VAL  15  -1.723   5.538   0.681
  118    HB   VAL  15           HB       VAL  15  -0.730   6.173  -2.124
  119   HG11  VAL  15          1HG1      VAL  15   1.522   5.995  -1.156
  120   HG12  VAL  15          2HG1      VAL  15   0.586   7.300  -0.392
  121   HG13  VAL  15          3HG1      VAL  15   0.810   5.750   0.455
  122   HG21  VAL  15          3HG2      VAL  15  -1.414   3.839  -1.871
  123   HG22  VAL  15          1HG2      VAL  15   0.354   3.974  -2.017
  124   HG23  VAL  15          2HG2      VAL  15  -0.387   3.687  -0.426
  125    H    VAL  16           HN       VAL  16  -1.354   7.323   1.853
  126    HA   VAL  16           HA       VAL  16  -2.155   9.877   0.575
  127    HB   VAL  16           HB       VAL  16  -2.563  10.661   2.977
  128   HG11  VAL  16          1HG1      VAL  16  -4.821   9.687   3.013
  129   HG12  VAL  16          2HG1      VAL  16  -4.352  10.179   1.370
  130   HG13  VAL  16          3HG1      VAL  16  -4.310   8.460   1.830
  131   HG21  VAL  16          3HG2      VAL  16  -1.392   8.841   4.128
  132   HG22  VAL  16          1HG2      VAL  16  -3.101   8.911   4.621
  133   HG23  VAL  16          2HG2      VAL  16  -2.559   7.667   3.471
  134    H    LYS  17           HN       LYS  17   0.207   8.391   2.822
  135    HA   LYS  17           HA       LYS  17   2.044  10.562   2.037
  136    HB2  LYS  17           2HB      LYS  17   0.743  10.414   4.588
  137    HB3  LYS  17           3HB      LYS  17   2.485  10.113   4.798
  138    HG2  LYS  17           2HG      LYS  17   2.965  12.206   3.578
  139    HG3  LYS  17           3HG      LYS  17   1.216  12.514   3.458
  140    HD2  LYS  17           2HD      LYS  17   2.831  12.274   6.017
  141    HD3  LYS  17           3HD      LYS  17   2.192  13.777   5.309
  142    HE2  LYS  17           2HE      LYS  17  -0.107  12.870   5.558
  143    HE3  LYS  17           3HE      LYS  17   0.572  11.436   6.355
  144    HZ1  LYS  17           3HZ      LYS  17   0.812  14.207   7.323
  145    HZ2  LYS  17           1HZ      LYS  17  -0.192  13.057   7.945
  146    HZ3  LYS  17           2HZ      LYS  17   1.442  12.874   8.062
  147    H    LEU  18           HN       LEU  18   4.248  10.107   2.412
  148    HA   LEU  18           HA       LEU  18   4.793   7.199   2.784
  149    HB2  LEU  18           2HB      LEU  18   6.087   9.134   0.836
  150    HB3  LEU  18           3HB      LEU  18   6.529   7.425   1.062
  151    HG   LEU  18           HG       LEU  18   3.815   8.369   0.098
  152   HD11  LEU  18          1HD1      LEU  18   4.573   7.675  -2.142
  153   HD12  LEU  18          2HD1      LEU  18   5.575   8.996  -1.499
  154   HD13  LEU  18          3HD1      LEU  18   6.189   7.325  -1.485
  155   HD21  LEU  18          3HD2      LEU  18   3.838   6.153   1.161
  156   HD22  LEU  18          1HD2      LEU  18   3.556   6.018  -0.590
  157   HD23  LEU  18          2HD2      LEU  18   5.160   5.646   0.083
  158    H    HIS  19           HN       HIS  19   6.147   6.816   4.423
  159    HA   HIS  19           HA       HIS  19   7.845   9.020   5.415
  160    HB2  HIS  19           2HB      HIS  19   7.325   6.226   6.493
  161    HB3  HIS  19           3HB      HIS  19   8.359   7.439   7.268
  162    HD1  HIS  19           1HD      HIS  19   7.256   9.113   8.765
  163    HD2  HIS  19           2HD      HIS  19   4.505   6.982   6.459
  164    HE1  HIS  19           1HE      HIS  19   4.965   9.777   9.603
  165    HE2  HIS  19           2HE      HIS  19   3.294   8.482   8.205
  166    H    GLY  20           HN       GLY  20  10.140   8.767   5.682
  167    HA2  GLY  20           1HA      GLY  20  11.840   6.785   5.258
  168    HA3  GLY  20           2HA      GLY  20  11.278   7.024   3.587
  169    H    THR  21           HN       THR  21  13.958   7.299   4.336
  170    HA   THR  21           HA       THR  21  14.432  10.186   4.631
  171    HB   THR  21           HB       THR  21  15.772   8.631   5.970
  172    HG1  THR  21           1HG      THR  21  17.833   9.472   5.374
  173   HG21  THR  21          3HG2      THR  21  16.845   7.593   3.326
  174   HG22  THR  21          1HG2      THR  21  17.443   7.140   4.938
  175   HG23  THR  21          2HG2      THR  21  15.791   6.703   4.452
  176    H    GLY  22           HN       GLY  22  13.128   9.999   2.359
  177    HA2  GLY  22           1HA      GLY  22  13.346  10.855   0.228
  178    HA3  GLY  22           2HA      GLY  22  15.108  10.920   0.458
  179    H    ALA  23           HN       ALA  23  16.104   8.579   0.600
  180    HA   ALA  23           HA       ALA  23  15.862   7.565  -2.033
  181    HB1  ALA  23           1HB      ALA  23  17.397   5.794  -1.277
  182    HB2  ALA  23           2HB      ALA  23  17.916   7.394  -0.700
  183    HB3  ALA  23           3HB      ALA  23  17.106   6.265   0.413
  184    H    LEU  24           HN       LEU  24  14.603   6.373   1.080
  185    HA   LEU  24           HA       LEU  24  13.480   3.966   0.075
  186    HB2  LEU  24           2HB      LEU  24  13.825   4.471   2.465
  187    HB3  LEU  24           3HB      LEU  24  12.542   5.703   2.376
  188    HG   LEU  24           HG       LEU  24  10.904   3.949   1.847
  189   HD11  LEU  24          1HD1      LEU  24  11.516   1.574   2.084
  190   HD12  LEU  24          2HD1      LEU  24  12.415   2.348   0.758
  191   HD13  LEU  24          3HD1      LEU  24  13.218   2.038   2.317
  192   HD21  LEU  24          3HD2      LEU  24  11.278   4.636   4.172
  193   HD22  LEU  24          1HD2      LEU  24  10.852   2.911   4.077
  194   HD23  LEU  24          2HD2      LEU  24  12.544   3.396   4.340
  195    H    LYS  25           HN       LYS  25  12.147   7.281   0.408
  196    HA   LYS  25           HA       LYS  25   9.513   6.673  -0.430
  197    HB2  LYS  25           2HB      LYS  25  11.116   9.216  -0.845
  198    HB3  LYS  25           3HB      LYS  25   9.357   9.061  -1.060
  199    HG2  LYS  25           2HG      LYS  25   9.206   8.415   1.362
  200    HG3  LYS  25           3HG      LYS  25  10.930   8.829   1.513
  201    HD2  LYS  25           2HD      LYS  25  10.428  11.113   0.691
  202    HD3  LYS  25           3HD      LYS  25   8.701  10.689   0.625
  203    HE2  LYS  25           2HE      LYS  25   8.750  10.234   3.061
  204    HE3  LYS  25           3HE      LYS  25  10.452  10.743   3.101
  205    HZ1  LYS  25           3HZ      LYS  25   8.178  12.431   2.297
  206    HZ2  LYS  25           1HZ      LYS  25   8.977  12.520   3.736
  207    HZ3  LYS  25           2HZ      LYS  25   9.757  12.905   2.335
  208    H    ARG  26           HN       ARG  26  12.403   7.682  -2.287
  209    HA   ARG  26           HA       ARG  26  11.143   7.841  -4.808
  210    HB2  ARG  26           2HB      ARG  26  13.379   8.733  -4.381
  211    HB3  ARG  26           3HB      ARG  26  14.005   7.083  -4.142
  212    HG2  ARG  26           2HG      ARG  26  13.430   6.541  -6.475
  213    HG3  ARG  26           3HG      ARG  26  12.847   8.207  -6.708
  214    HD2  ARG  26           2HD      ARG  26  15.099   9.056  -6.187
  215    HD3  ARG  26           3HD      ARG  26  15.674   7.387  -5.983
  216    HE   ARG  26           HE       ARG  26  14.491   7.545  -8.524
  217   HH11  ARG  26          2HH1      ARG  26  17.214   8.963  -6.798
  218   HH12  ARG  26          1HH1      ARG  26  18.181   9.169  -8.241
  219   HH21  ARG  26          2HH2      ARG  26  15.759   7.806 -10.395
  220   HH22  ARG  26          1HH2      ARG  26  17.356   8.513 -10.281
  221    H    ARG  27           HN       ARG  27  12.793   5.087  -3.202
  222    HA   ARG  27           HA       ARG  27  12.548   3.226  -5.285
  223    HB2  ARG  27           2HB      ARG  27  12.557   2.963  -2.282
  224    HB3  ARG  27           3HB      ARG  27  12.351   1.538  -3.328
  225    HG2  ARG  27           2HG      ARG  27  14.490   2.094  -4.443
  226    HG3  ARG  27           3HG      ARG  27  14.703   3.443  -3.302
  227    HD2  ARG  27           2HD      ARG  27  14.967   2.006  -1.464
  228    HD3  ARG  27           3HD      ARG  27  14.246   0.627  -2.322
  229    HE   ARG  27           HE       ARG  27  16.726   1.651  -3.484
  230   HH11  ARG  27          2HH1      ARG  27  15.326  -0.521  -1.087
  231   HH12  ARG  27          1HH1      ARG  27  16.658  -1.653  -1.149
  232   HH21  ARG  27          2HH2      ARG  27  18.425   0.132  -3.606
  233   HH22  ARG  27          1HH2      ARG  27  18.413  -1.281  -2.576
  234    H    ILE  28           HN       ILE  28  10.271   3.902  -2.609
  235    HA   ILE  28           HA       ILE  28   8.295   2.039  -3.335
  236    HB   ILE  28           HB       ILE  28   7.997   4.757  -1.992
  237   HG12  ILE  28          2HG1      ILE  28   8.264   1.976  -0.809
  238   HG13  ILE  28          3HG1      ILE  28   9.569   3.182  -0.898
  239   HG21  ILE  28          1HG2      ILE  28   5.901   3.869  -1.066
  240   HG22  ILE  28          2HG2      ILE  28   5.851   3.932  -2.843
  241   HG23  ILE  28          3HG2      ILE  28   6.113   2.379  -2.015
  242   HD11  ILE  28          3HD1      ILE  28   6.972   3.481   0.631
  243   HD12  ILE  28          1HD1      ILE  28   8.559   3.128   1.345
  244   HD13  ILE  28          2HD1      ILE  28   8.278   4.686   0.542
  245    H    MET  29           HN       MET  29   8.718   5.445  -4.328
  246    HA   MET  29           HA       MET  29   6.298   5.516  -5.878
  247    HB2  MET  29           2HB      MET  29   8.754   7.290  -5.950
  248    HB3  MET  29           3HB      MET  29   7.224   7.624  -6.796
  249    HG2  MET  29           2HG      MET  29   6.062   7.653  -4.611
  250    HG3  MET  29           3HG      MET  29   7.617   7.404  -3.801
  251    HE1  MET  29           3HE      MET  29   9.496   9.182  -5.768
  252    HE2  MET  29           1HE      MET  29   9.540  10.709  -4.857
  253    HE3  MET  29           2HE      MET  29   9.658   9.157  -3.996
  254    H    ASP  30           HN       ASP  30   9.609   4.550  -6.535
  255    HA   ASP  30           HA       ASP  30   9.532   4.704  -9.368
  256    HB2  ASP  30           2HB      ASP  30  11.612   4.389  -8.123
  257    HB3  ASP  30           3HB      ASP  30  11.059   2.795  -7.567
  258    HD2  ASP  30           2HD      ASP  30  12.326   3.149 -11.322
  259    H    MET  31           HN       MET  31   8.514   2.142  -7.090
  260    HA   MET  31           HA       MET  31   7.780   0.288  -9.165
  261    HB2  MET  31           2HB      MET  31   7.222   0.523  -6.229
  262    HB3  MET  31           3HB      MET  31   6.230  -0.580  -7.212
  263    HG2  MET  31           2HG      MET  31   7.892  -1.984  -6.458
  264    HG3  MET  31           3HG      MET  31   8.521  -1.496  -8.040
  265    HE1  MET  31           3HE      MET  31   8.837  -1.215  -4.165
  266    HE2  MET  31           1HE      MET  31  10.025   0.093  -3.958
  267    HE3  MET  31           2HE      MET  31   8.403   0.458  -4.592
  268    H    GLY  32           HN       GLY  32   6.353   3.189  -7.975
  269    HA2  GLY  32           1HA      GLY  32   4.610   4.070  -9.499
  270    HA3  GLY  32           2HA      GLY  32   3.845   2.466  -9.419
  271    H    ILE  33           HN       ILE  33   4.993   2.870  -6.410
  272    HA   ILE  33           HA       ILE  33   2.326   3.525  -5.422
  273    HB   ILE  33           HB       ILE  33   4.822   3.045  -3.762
  274   HG12  ILE  33          2HG1      ILE  33   4.628   1.215  -5.364
  275   HG13  ILE  33          3HG1      ILE  33   4.237   0.670  -3.715
  276   HG21  ILE  33          1HG2      ILE  33   3.200   2.248  -2.090
  277   HG22  ILE  33          2HG2      ILE  33   2.857   3.923  -2.582
  278   HG23  ILE  33          3HG2      ILE  33   1.869   2.586  -3.220
  279   HD11  ILE  33          3HD1      ILE  33   2.240   1.322  -5.895
  280   HD12  ILE  33          1HD1      ILE  33   2.701  -0.310  -5.366
  281   HD13  ILE  33          2HD1      ILE  33   1.849   0.774  -4.246
  282    H    THR  34           HN       THR  34   1.750   5.622  -5.307
  283    HA   THR  34           HA       THR  34   3.642   7.448  -3.969
  284    HB   THR  34           HB       THR  34   4.122   7.730  -6.350
  285    HG1  THR  34           1HG      THR  34   3.671   9.988  -6.456
  286   HG21  THR  34          3HG2      THR  34   1.177   8.406  -6.642
  287   HG22  THR  34          1HG2      THR  34   2.407   8.543  -7.919
  288   HG23  THR  34          2HG2      THR  34   1.985   6.946  -7.262
  289    H    ARG  35           HN       ARG  35   2.355   9.782  -3.958
  290    HA   ARG  35           HA       ARG  35   0.176   9.122  -2.167
  291    HB2  ARG  35           2HB      ARG  35   1.153  11.832  -3.125
  292    HB3  ARG  35           3HB      ARG  35   0.042  11.533  -1.767
  293    HG2  ARG  35           2HG      ARG  35   2.029  11.855  -0.662
  294    HG3  ARG  35           3HG      ARG  35   2.024  10.085  -0.849
  295    HD2  ARG  35           2HD      ARG  35   4.215  10.928  -1.417
  296    HD3  ARG  35           3HD      ARG  35   3.421  10.342  -2.894
  297    HE   ARG  35           HE       ARG  35   3.054  13.186  -2.390
  298   HH11  ARG  35          2HH1      ARG  35   5.063  10.729  -3.921
  299   HH12  ARG  35          1HH1      ARG  35   5.804  11.858  -5.032
  300   HH21  ARG  35          2HH2      ARG  35   4.045  14.639  -3.814
  301   HH22  ARG  35          1HH2      ARG  35   5.228  14.070  -4.971
  302    H    GLY  36           HN       GLY  36  -1.916   8.969  -2.621
  303    HA2  GLY  36           1HA      GLY  36  -3.907   9.897  -3.543
  304    HA3  GLY  36           2HA      GLY  36  -2.956  10.570  -4.886
  305    H    CYS  37           HN       CYS  37  -1.970   7.390  -4.267
  306    HA   CYS  37           HA       CYS  37  -3.631   6.477  -6.552
  307    HB2  CYS  37           2HB      CYS  37  -1.981   4.764  -6.902
  308    HB3  CYS  37           3HB      CYS  37  -1.168   6.345  -6.772
  309    HG   CYS  37           HG       CYS  37   0.351   4.475  -5.760
  310    H    GLU  38           HN       GLU  38  -4.974   4.732  -6.422
  311    HA   GLU  38           HA       GLU  38  -5.498   3.685  -3.719
  312    HB2  GLU  38           2HB      GLU  38  -6.907   3.276  -6.373
  313    HB3  GLU  38           3HB      GLU  38  -7.386   2.486  -4.851
  314    HG2  GLU  38           2HG      GLU  38  -8.852   4.275  -5.026
  315    HG3  GLU  38           3HG      GLU  38  -7.600   4.869  -3.914
  316    HE2  GLU  38           2HE      GLU  38  -6.968   6.366  -7.505
  317    H    ILE  39           HN       ILE  39  -4.857   1.741  -3.024
  318    HA   ILE  39           HA       ILE  39  -3.663  -0.082  -5.045
  319    HB   ILE  39           HB       ILE  39  -2.834   0.331  -2.146
  320   HG12  ILE  39          2HG1      ILE  39  -1.416   0.937  -4.757
  321   HG13  ILE  39          3HG1      ILE  39  -2.085   2.128  -3.615
  322   HG21  ILE  39          1HG2      ILE  39  -1.049  -1.295  -2.634
  323   HG22  ILE  39          2HG2      ILE  39  -2.660  -2.022  -2.833
  324   HG23  ILE  39          3HG2      ILE  39  -1.719  -1.540  -4.264
  325   HD11  ILE  39          3HD1      ILE  39   0.178   0.198  -3.048
  326   HD12  ILE  39          1HD1      ILE  39   0.354   1.935  -3.372
  327   HD13  ILE  39          2HD1      ILE  39  -0.492   1.390  -1.908
  328    H    TYR  40           HN       TYR  40  -4.860  -1.809  -5.336
  329    HA   TYR  40           HA       TYR  40  -6.595  -2.869  -3.251
  330    HB2  TYR  40           2HB      TYR  40  -7.374  -3.102  -5.485
  331    HB3  TYR  40           3HB      TYR  40  -5.819  -3.742  -6.044
  332    HD1  TYR  40           2HD      TYR  40  -8.698  -4.577  -3.791
  333    HD2  TYR  40           1HD      TYR  40  -5.488  -6.057  -6.174
  334    HE1  TYR  40           2HE      TYR  40  -9.509  -6.873  -3.463
  335    HE2  TYR  40           1HE      TYR  40  -6.298  -8.350  -5.847
  336    HH   TYR  40           HH       TYR  40  -9.195  -9.083  -3.914
  337    H    ILE  41           HN       ILE  41  -5.803  -3.967  -1.582
  338    HA   ILE  41           HA       ILE  41  -3.172  -5.180  -1.683
  339    HB   ILE  41           HB       ILE  41  -5.305  -5.578   0.449
  340   HG12  ILE  41          2HG1      ILE  41  -4.991  -3.187   0.086
  341   HG13  ILE  41          3HG1      ILE  41  -4.282  -3.690   1.639
  342   HG21  ILE  41          1HG2      ILE  41  -3.364  -5.975   1.918
  343   HG22  ILE  41          2HG2      ILE  41  -3.385  -7.113   0.551
  344   HG23  ILE  41          3HG2      ILE  41  -2.270  -5.725   0.538
  345   HD11  ILE  41          3HD1      ILE  41  -2.759  -3.168  -0.926
  346   HD12  ILE  41          1HD1      ILE  41  -2.830  -2.080   0.476
  347   HD13  ILE  41          2HD1      ILE  41  -2.051  -3.670   0.628
  348    H    ARG  42           HN       ARG  42  -2.929  -6.914  -2.957
  349    HA   ARG  42           HA       ARG  42  -5.078  -8.662  -3.633
  350    HB2  ARG  42           2HB      ARG  42  -3.165  -8.291  -5.114
  351    HB3  ARG  42           3HB      ARG  42  -2.077  -9.032  -3.916
  352    HG2  ARG  42           2HG      ARG  42  -2.556 -10.623  -5.672
  353    HG3  ARG  42           3HG      ARG  42  -3.317 -11.164  -4.157
  354    HD2  ARG  42           2HD      ARG  42  -5.425  -9.954  -5.016
  355    HD3  ARG  42           3HD      ARG  42  -4.611  -9.939  -6.595
  356    HE   ARG  42           HE       ARG  42  -4.792 -12.550  -5.269
  357   HH11  ARG  42          2HH1      ARG  42  -6.057 -10.302  -7.660
  358   HH12  ARG  42          1HH1      ARG  42  -7.006 -11.515  -8.488
  359   HH21  ARG  42          2HH2      ARG  42  -6.083 -14.119  -6.332
  360   HH22  ARG  42          1HH2      ARG  42  -7.022 -13.671  -7.737
  361    H    LYS  43           HN       LYS  43  -2.151  -9.182  -1.595
  362    HA   LYS  43           HA       LYS  43  -3.676 -11.085   0.033
  363    HB2  LYS  43           2HB      LYS  43  -2.916 -12.450  -1.870
  364    HB3  LYS  43           3HB      LYS  43  -1.237 -11.944  -1.559
  365    HG2  LYS  43           2HG      LYS  43  -1.400 -13.007   0.691
  366    HG3  LYS  43           3HG      LYS  43  -3.008 -13.619   0.237
  367    HD2  LYS  43           2HD      LYS  43  -2.006 -14.819  -1.665
  368    HD3  LYS  43           3HD      LYS  43  -0.399 -14.219  -1.190
  369    HE2  LYS  43           2HE      LYS  43  -0.675 -15.350   1.007
  370    HE3  LYS  43           3HE      LYS  43  -2.217 -16.022   0.434
  371    HZ1  LYS  43           3HZ      LYS  43   0.419 -16.506  -0.783
  372    HZ2  LYS  43           1HZ      LYS  43  -0.416 -17.572   0.156
  373    HZ3  LYS  43           2HZ      LYS  43  -1.013 -17.128  -1.315
  374    H    VAL  44           HN       VAL  44  -3.039 -11.040   2.079
  375    HA   VAL  44           HA       VAL  44  -0.387  -9.845   2.694
  376    HB   VAL  44           HB       VAL  44  -2.756 -10.316   4.551
  377   HG11  VAL  44          1HG1      VAL  44  -1.525  -8.876   6.121
  378   HG12  VAL  44          2HG1      VAL  44  -0.588 -10.329   5.699
  379   HG13  VAL  44          3HG1      VAL  44  -0.181  -8.761   4.961
  380   HG21  VAL  44          3HG2      VAL  44  -3.278  -8.628   2.852
  381   HG22  VAL  44          1HG2      VAL  44  -3.095  -7.882   4.457
  382   HG23  VAL  44          2HG2      VAL  44  -1.786  -7.746   3.261
  383    H    ALA  45           HN       ALA  45   1.176 -11.084   3.614
  384    HA   ALA  45           HA       ALA  45   0.696 -13.948   3.681
  385    HB1  ALA  45           1HB      ALA  45   3.094 -14.093   4.218
  386    HB2  ALA  45           2HB      ALA  45   2.802 -13.019   2.830
  387    HB3  ALA  45           3HB      ALA  45   3.150 -12.327   4.434
  388    HA   PRO  46           HA       PRO  46  -0.414 -14.454   7.903
  389    HB2  PRO  46           2HB      PRO  46   1.259 -16.953   7.888
  390    HB3  PRO  46           3HB      PRO  46  -0.496 -16.725   8.178
  391    HG2  PRO  46           2HG      PRO  46   0.433 -17.792   5.922
  392    HG3  PRO  46           3HG      PRO  46  -1.050 -16.785   5.956
  393    HD2  PRO  46           2HD      PRO  46   1.751 -16.131   5.041
  394    HD3  PRO  46           3HD      PRO  46   0.176 -15.594   4.381
  395    H    LEU  47           HN       LEU  47   2.901 -14.407   6.877
  396    HA   LEU  47           HA       LEU  47   3.795 -14.032   9.688
  397    HB2  LEU  47           2HB      LEU  47   6.053 -14.448   8.879
  398    HB3  LEU  47           3HB      LEU  47   4.968 -15.795   8.458
  399    HG   LEU  47           HG       LEU  47   5.627 -13.623   6.472
  400   HD11  LEU  47          1HD1      LEU  47   7.436 -15.062   5.619
  401   HD12  LEU  47          2HD1      LEU  47   7.757 -14.536   7.289
  402   HD13  LEU  47          3HD1      LEU  47   7.174 -16.188   6.971
  403   HD21  LEU  47          3HD2      LEU  47   3.748 -15.124   5.963
  404   HD22  LEU  47          1HD2      LEU  47   5.104 -15.399   4.845
  405   HD23  LEU  47          2HD2      LEU  47   4.811 -16.535   6.182
  406    H    GLY  48           HN       GLY  48   2.511 -12.165   7.471
  407    HA2  GLY  48           1HA      GLY  48   2.679  -9.763   7.791
  408    HA3  GLY  48           2HA      GLY  48   4.437  -9.951   7.977
  409    H    ASP  49           HN       ASP  49   5.647 -10.744   6.067
  410    HA   ASP  49           HA       ASP  49   4.318  -9.877   3.544
  411    HB2  ASP  49           2HB      ASP  49   6.202  -8.652   2.877
  412    HB3  ASP  49           3HB      ASP  49   6.003  -8.229   4.591
  413    HD2  ASP  49           2HD      ASP  49   8.981  -9.839   5.449
  414    HA   PRO  50           HA       PRO  50   6.231  -9.527   1.533
  415    HB2  PRO  50           2HB      PRO  50   5.685 -10.483  -0.987
  416    HB3  PRO  50           3HB      PRO  50   7.291 -10.646  -0.203
  417    HG2  PRO  50           2HG      PRO  50   5.078 -12.650  -0.335
  418    HG3  PRO  50           3HG      PRO  50   6.812 -12.880  -0.733
  419    HD2  PRO  50           2HD      PRO  50   5.759 -13.619   1.658
  420    HD3  PRO  50           3HD      PRO  50   7.401 -12.916   1.542
  421    H    ILE  51           HN       ILE  51   4.679  -8.079   1.147
  422    HA   ILE  51           HA       ILE  51   1.883  -9.031   1.111
  423    HB   ILE  51           HB       ILE  51   3.011  -6.206   1.310
  424   HG12  ILE  51          2HG1      ILE  51   1.810  -8.013   3.432
  425   HG13  ILE  51          3HG1      ILE  51   3.540  -7.635   3.250
  426   HG21  ILE  51          1HG2      ILE  51   0.718  -5.568   1.950
  427   HG22  ILE  51          2HG2      ILE  51   0.763  -6.269   0.316
  428   HG23  ILE  51          3HG2      ILE  51   0.179  -7.243   1.687
  429   HD11  ILE  51          3HD1      ILE  51   1.341  -5.649   3.877
  430   HD12  ILE  51          1HD1      ILE  51   2.518  -6.293   5.042
  431   HD13  ILE  51          2HD1      ILE  51   3.072  -5.272   3.698
  432    H    GLN  52           HN       GLN  52   0.825  -9.249  -0.742
  433    HA   GLN  52           HA       GLN  52   2.111  -8.197  -3.175
  434    HB2  GLN  52           2HB      GLN  52  -0.234 -10.087  -2.810
  435    HB3  GLN  52           3HB      GLN  52   0.517  -9.648  -4.363
  436    HG2  GLN  52           2HG      GLN  52   2.642 -10.629  -3.591
  437    HG3  GLN  52           3HG      GLN  52   1.855 -11.104  -2.070
  438   HE21  GLN  52          1HE2      GLN  52   2.145 -11.716  -5.511
  439   HE22  GLN  52          2HE2      GLN  52   1.320 -13.261  -5.509
  440    H    ILE  53           HN       ILE  53   1.531  -6.334  -4.007
  441    HA   ILE  53           HA       ILE  53  -1.264  -5.412  -3.547
  442    HB   ILE  53           HB       ILE  53  -0.340  -3.074  -3.677
  443   HG12  ILE  53          2HG1      ILE  53   2.319  -4.516  -3.434
  444   HG13  ILE  53          3HG1      ILE  53   1.750  -3.586  -4.841
  445   HG21  ILE  53          1HG2      ILE  53   0.527  -3.053  -1.372
  446   HG22  ILE  53          2HG2      ILE  53  -0.879  -4.131  -1.525
  447   HG23  ILE  53          3HG2      ILE  53   0.762  -4.814  -1.443
  448   HD11  ILE  53          3HD1      ILE  53   2.308  -2.473  -2.079
  449   HD12  ILE  53          1HD1      ILE  53   3.354  -2.286  -3.502
  450   HD13  ILE  53          2HD1      ILE  53   1.740  -1.543  -3.487
  451    H    ASN  54           HN       ASN  54  -2.397  -4.647  -5.286
  452    HA   ASN  54           HA       ASN  54  -1.120  -5.182  -7.901
  453    HB2  ASN  54           2HB      ASN  54  -3.245  -6.292  -7.414
  454    HB3  ASN  54           3HB      ASN  54  -4.019  -4.719  -7.124
  455   HD21  ASN  54          1HD2      ASN  54  -1.667  -5.387  -9.704
  456   HD22  ASN  54          2HD2      ASN  54  -2.794  -5.198 -11.031
  457    H    VAL  55           HN       VAL  55  -0.141  -3.547  -8.846
  458    HA   VAL  55           HA       VAL  55  -1.526  -0.950  -9.046
  459    HB   VAL  55           HB       VAL  55   1.362  -1.192  -8.101
  460   HG11  VAL  55          1HG1      VAL  55   1.274   1.257  -7.870
  461   HG12  VAL  55          2HG1      VAL  55   0.972   0.749  -9.546
  462   HG13  VAL  55          3HG1      VAL  55  -0.385   1.255  -8.511
  463   HG21  VAL  55          3HG2      VAL  55  -0.202  -1.765  -6.305
  464   HG22  VAL  55          1HG2      VAL  55   0.591  -0.207  -5.982
  465   HG23  VAL  55          2HG2      VAL  55  -1.083  -0.242  -6.578
  466    H    ARG  56           HN       ARG  56  -1.293  -0.073 -11.038
  467    HA   ARG  56           HA       ARG  56  -0.510   0.363 -13.137
  468    HB2  ARG  56           2HB      ARG  56   2.077  -0.942 -12.223
  469    HB3  ARG  56           3HB      ARG  56   1.857   0.071 -13.671
  470    HG2  ARG  56           2HG      ARG  56   1.579   0.967 -10.789
  471    HG3  ARG  56           3HG      ARG  56   2.934   1.327 -11.886
  472    HD2  ARG  56           2HD      ARG  56   1.469   2.597 -13.344
  473    HD3  ARG  56           3HD      ARG  56   0.055   2.153 -12.364
  474    HE   ARG  56           HE       ARG  56   2.304   3.834 -11.357
  475   HH11  ARG  56          2HH1      ARG  56  -1.124   3.081 -11.657
  476   HH12  ARG  56          1HH1      ARG  56  -1.631   4.375 -10.596
  477   HH21  ARG  56          2HH2      ARG  56   1.635   5.502  -9.951
  478   HH22  ARG  56          1HH2      ARG  56  -0.067   5.746  -9.630
  479    H    GLY  57           HN       GLY  57  -1.693  -2.311 -12.273
  480    HA2  GLY  57           1HA      GLY  57  -2.428  -4.038 -13.705
  481    HA3  GLY  57           2HA      GLY  57  -1.065  -3.706 -14.798
  482    H    TYR  58           HN       TYR  58   0.792  -3.609 -12.457
  483    HA   TYR  58           HA       TYR  58   1.335  -6.494 -12.434
  484    HB2  TYR  58           2HB      TYR  58   2.918  -4.105 -11.425
  485    HB3  TYR  58           3HB      TYR  58   3.480  -5.784 -11.374
  486    HD1  TYR  58           2HD      TYR  58   3.912  -6.996 -13.533
  487    HD2  TYR  58           1HD      TYR  58   3.082  -2.819 -13.432
  488    HE1  TYR  58           2HE      TYR  58   4.845  -6.757 -15.790
  489    HE2  TYR  58           1HE      TYR  58   4.019  -2.576 -15.689
  490    HH   TYR  58           HH       TYR  58   5.327  -5.350 -17.504
  491    H    GLU  59           HN       GLU  59   1.800  -7.658 -10.494
  492    HA   GLU  59           HA       GLU  59   0.659  -6.396  -8.047
  493    HB2  GLU  59           2HB      GLU  59   0.955  -9.333  -8.719
  494    HB3  GLU  59           3HB      GLU  59   0.283  -8.661  -7.214
  495    HG2  GLU  59           2HG      GLU  59  -1.552  -7.663  -8.430
  496    HG3  GLU  59           3HG      GLU  59  -0.855  -8.184  -9.978
  497    HE2  GLU  59           2HE      GLU  59  -1.658 -11.586  -9.051
  498    H    LEU  60           HN       LEU  60   2.142  -5.675  -6.760
  499    HA   LEU  60           HA       LEU  60   4.919  -6.535  -7.191
  500    HB2  LEU  60           2HB      LEU  60   3.807  -4.308  -5.459
  501    HB3  LEU  60           3HB      LEU  60   5.493  -4.523  -5.985
  502    HG   LEU  60           HG       LEU  60   3.144  -3.921  -7.804
  503   HD11  LEU  60          1HD1      LEU  60   4.158  -1.691  -8.024
  504   HD12  LEU  60          2HD1      LEU  60   3.695  -2.032  -6.341
  505   HD13  LEU  60          3HD1      LEU  60   5.402  -2.141  -6.834
  506   HD21  LEU  60          3HD2      LEU  60   4.915  -5.222  -8.896
  507   HD22  LEU  60          1HD2      LEU  60   4.870  -3.557  -9.519
  508   HD23  LEU  60          2HD2      LEU  60   6.127  -4.036  -8.355
  509    H    SER  61           HN       SER  61   6.309  -7.209  -5.578
  510    HA   SER  61           HA       SER  61   4.983  -8.276  -3.146
  511    HB2  SER  61           2HB      SER  61   7.761  -8.819  -4.260
  512    HB3  SER  61           3HB      SER  61   6.966  -9.670  -2.914
  513    HG   SER  61           HG       SER  61   6.791 -10.805  -4.911
  514    H    LEU  62           HN       LEU  62   4.962  -6.824  -1.523
  515    HA   LEU  62           HA       LEU  62   7.286  -4.978  -1.317
  516    HB2  LEU  62           2HB      LEU  62   5.034  -3.983  -1.677
  517    HB3  LEU  62           3HB      LEU  62   4.501  -4.714  -0.144
  518    HG   LEU  62           HG       LEU  62   6.205  -3.365   1.047
  519   HD11  LEU  62          1HD1      LEU  62   7.285  -1.486  -0.123
  520   HD12  LEU  62          2HD1      LEU  62   7.778  -3.051  -0.809
  521   HD13  LEU  62          3HD1      LEU  62   6.584  -2.042  -1.660
  522   HD21  LEU  62          3HD2      LEU  62   3.881  -2.604   0.864
  523   HD22  LEU  62          1HD2      LEU  62   5.005  -1.226   0.856
  524   HD23  LEU  62          2HD2      LEU  62   4.266  -1.777  -0.665
  525    H    ARG  63           HN       ARG  63   8.496  -4.858   0.481
  526    HA   ARG  63           HA       ARG  63   8.323  -6.976   2.443
  527    HB2  ARG  63           2HB      ARG  63  10.393  -5.709   1.535
  528    HB3  ARG  63           3HB      ARG  63   9.939  -4.433   2.691
  529    HG2  ARG  63           2HG      ARG  63  11.641  -5.821   3.666
  530    HG3  ARG  63           3HG      ARG  63  10.106  -6.093   4.524
  531    HD2  ARG  63           2HD      ARG  63   9.777  -8.191   3.516
  532    HD3  ARG  63           3HD      ARG  63  10.963  -7.860   2.234
  533    HE   ARG  63           HE       ARG  63  12.456  -7.777   4.538
  534   HH11  ARG  63          2HH1      ARG  63  10.092 -10.109   3.369
  535   HH12  ARG  63          1HH1      ARG  63  10.976 -11.498   3.961
  536   HH21  ARG  63          2HH2      ARG  63  13.656  -9.605   5.223
  537   HH22  ARG  63          1HH2      ARG  63  12.996 -11.212   5.011
  538    H    LYS  64           HN       LYS  64   7.694  -6.849   4.592
  539    HA   LYS  64           HA       LYS  64   5.477  -5.198   5.143
  540    HB2  LYS  64           2HB      LYS  64   5.730  -6.009   7.485
  541    HB3  LYS  64           3HB      LYS  64   5.748  -7.302   6.261
  542    HG2  LYS  64           2HG      LYS  64   8.244  -7.306   6.404
  543    HG3  LYS  64           3HG      LYS  64   8.117  -6.153   7.754
  544    HD2  LYS  64           2HD      LYS  64   6.835  -7.755   9.053
  545    HD3  LYS  64           3HD      LYS  64   6.823  -8.895   7.686
  546    HE2  LYS  64           2HE      LYS  64   9.251  -7.946   9.239
  547    HE3  LYS  64           3HE      LYS  64   8.504  -9.556   9.318
  548    HZ1  LYS  64           3HZ      LYS  64   9.771  -8.371   6.938
  549    HZ2  LYS  64           1HZ      LYS  64  10.430  -9.540   7.894
  550    HZ3  LYS  64           2HZ      LYS  64   9.077  -9.865   7.010
  551    H    SER  65           HN       SER  65   8.918  -4.741   5.838
  552    HA   SER  65           HA       SER  65   8.673  -2.702   7.787
  553    HB2  SER  65           2HB      SER  65  10.996  -2.063   6.900
  554    HB3  SER  65           3HB      SER  65  10.787  -3.729   7.490
  555    HG   SER  65           HG       SER  65  11.858  -3.632   5.453
  556    H    ALA  66           HN       ALA  66   8.859  -2.530   4.219
  557    HA   ALA  66           HA       ALA  66   8.741   0.350   4.159
  558    HB1  ALA  66           1HB      ALA  66   8.400   0.048   1.740
  559    HB2  ALA  66           2HB      ALA  66   9.737  -0.962   2.338
  560    HB3  ALA  66           3HB      ALA  66   8.152  -1.696   1.993
  561    H    ALA  67           HN       ALA  67   6.377  -2.271   4.134
  562    HA   ALA  67           HA       ALA  67   4.159  -0.645   3.314
  563    HB1  ALA  67           1HB      ALA  67   2.779  -2.526   4.091
  564    HB2  ALA  67           2HB      ALA  67   4.153  -3.088   3.110
  565    HB3  ALA  67           3HB      ALA  67   4.203  -3.241   4.883
  566    H    GLU  68           HN       GLU  68   5.851  -1.044   6.334
  567    HA   GLU  68           HA       GLU  68   3.672   0.179   7.884
  568    HB2  GLU  68           2HB      GLU  68   6.552  -0.322   8.702
  569    HB3  GLU  68           3HB      GLU  68   5.174   0.037   9.770
  570    HG2  GLU  68           2HG      GLU  68   4.122  -2.100   8.937
  571    HG3  GLU  68           3HG      GLU  68   5.675  -2.465   8.154
  572    HE2  GLU  68           2HE      GLU  68   5.326  -3.564  11.777
  573    H    MET  69           HN       MET  69   6.261   1.147   5.875
  574    HA   MET  69           HA       MET  69   6.696   3.715   7.227
  575    HB2  MET  69           2HB      MET  69   8.272   2.083   5.683
  576    HB3  MET  69           3HB      MET  69   7.768   3.321   4.509
  577    HG2  MET  69           2HG      MET  69   9.866   3.958   5.518
  578    HG3  MET  69           3HG      MET  69   8.592   5.075   6.033
  579    HE1  MET  69           3HE      MET  69  10.315   5.902   7.948
  580    HE2  MET  69           1HE      MET  69  11.048   4.810   9.145
  581    HE3  MET  69           2HE      MET  69  11.506   4.684   7.431
  582    H    ILE  70           HN       ILE  70   4.611   2.361   4.886
  583    HA   ILE  70           HA       ILE  70   3.998   5.013   3.702
  584    HB   ILE  70           HB       ILE  70   2.970   2.228   3.000
  585   HG12  ILE  70          2HG1      ILE  70   4.967   3.949   1.507
  586   HG13  ILE  70          3HG1      ILE  70   5.401   2.591   2.572
  587   HG21  ILE  70          1HG2      ILE  70   2.094   3.283   0.957
  588   HG22  ILE  70          2HG2      ILE  70   1.382   4.004   2.418
  589   HG23  ILE  70          3HG2      ILE  70   2.664   4.867   1.532
  590   HD11  ILE  70          3HD1      ILE  70   3.725   2.412   0.054
  591   HD12  ILE  70          1HD1      ILE  70   5.422   1.911   0.206
  592   HD13  ILE  70          2HD1      ILE  70   4.161   1.054   1.120
  593    H    GLU  71           HN       GLU  71   2.176   6.152   4.364
  594    HA   GLU  71           HA       GLU  71   0.208   4.522   5.855
  595    HB2  GLU  71           2HB      GLU  71  -0.751   6.533   6.764
  596    HB3  GLU  71           3HB      GLU  71   0.981   6.402   7.154
  597    HG2  GLU  71           2HG      GLU  71   1.108   7.949   4.959
  598    HG3  GLU  71           3HG      GLU  71  -0.482   8.427   5.590
  599    HE2  GLU  71           2HE      GLU  71   0.977   9.708   8.528
  600    H    VAL  72           HN       VAL  72  -1.908   4.498   5.353
  601    HA   VAL  72           HA       VAL  72  -2.706   5.766   2.797
  602    HB   VAL  72           HB       VAL  72  -3.846   3.665   2.131
  603   HG11  VAL  72          1HG1      VAL  72  -1.846   2.417   1.428
  604   HG12  VAL  72          2HG1      VAL  72  -1.623   4.170   1.232
  605   HG13  VAL  72          3HG1      VAL  72  -0.869   3.325   2.604
  606   HG21  VAL  72          3HG2      VAL  72  -4.112   2.675   4.358
  607   HG22  VAL  72          1HG2      VAL  72  -3.299   1.544   3.253
  608   HG23  VAL  72          2HG2      VAL  72  -2.352   2.433   4.469
  609    H    GLU  73           HN       GLU  73  -5.201   5.318   2.504
  610    HA   GLU  73           HA       GLU  73  -6.468   5.397   5.192
  611    HB2  GLU  73           2HB      GLU  73  -8.108   7.001   4.376
  612    HB3  GLU  73           3HB      GLU  73  -6.457   7.655   4.260
  613    HG2  GLU  73           2HG      GLU  73  -6.418   7.380   1.903
  614    HG3  GLU  73           3HG      GLU  73  -7.904   6.407   1.923
  615    HE2  GLU  73           2HE      GLU  73  -9.892   9.222   1.879
  616    H    LEU  74           HN       LEU  74  -8.378   4.353   5.451
  617    HA   LEU  74           HA       LEU  74  -9.008   2.277   3.515
  618    HB2  LEU  74           2HB      LEU  74  -9.224   2.495   6.216
  619    HB3  LEU  74           3HB      LEU  74 -10.883   2.917   5.732
  620    HG   LEU  74           HG       LEU  74 -10.823   0.591   6.256
  621   HD11  LEU  74          1HD1      LEU  74 -11.534  -0.429   4.138
  622   HD12  LEU  74          2HD1      LEU  74 -12.194   1.211   4.327
  623   HD13  LEU  74          3HD1      LEU  74 -10.811   0.927   3.244
  624   HD21  LEU  74          3HD2      LEU  74  -8.409   0.238   6.032
  625   HD22  LEU  74          1HD2      LEU  74  -9.320  -0.997   5.132
  626   HD23  LEU  74          2HD2      LEU  74  -8.550   0.349   4.261
  627    H    GLU  75           HN       GLU  75 -10.100   2.804   1.688
  628    HA   GLU  75           HA       GLU  75 -11.678   5.225   1.589
  629    HB2  GLU  75           2HB      GLU  75 -10.400   4.431  -0.356
  630    HB3  GLU  75           3HB      GLU  75 -11.431   2.983  -0.439
  631    HG2  GLU  75           2HG      GLU  75 -12.065   4.719  -2.082
  632    HG3  GLU  75           3HG      GLU  75 -13.371   4.333  -0.940
  633    HE2  GLU  75           2HE      GLU  75 -13.212   7.524   0.496
  634    H    HIS  76           HN       HIS  76 -13.464   5.271   2.760
  635    HA   HIS  76           HA       HIS  76 -15.622   3.402   2.024
  636    HB2  HIS  76           2HB      HIS  76 -14.265   2.628   4.137
  637    HB3  HIS  76           3HB      HIS  76 -15.116   3.959   4.944
  638    HD1  HIS  76           1HD      HIS  76 -15.623   0.551   3.478
  639    HD2  HIS  76           2HD      HIS  76 -17.900   3.547   5.299
  640    HE1  HIS  76           1HE      HIS  76 -17.855  -0.504   4.047
  641    HE2  HIS  76           2HE      HIS  76 -19.233   1.318   5.154
  642    H    HIS  77           HN       HIS  77 -14.884   6.183   1.509
  643    HA   HIS  77           HA       HIS  77 -16.281   7.985   3.209
  644    HB2  HIS  77           2HB      HIS  77 -14.541   8.691   1.639
  645    HB3  HIS  77           3HB      HIS  77 -15.548   8.191   0.268
  646    HD1  HIS  77           1HD      HIS  77 -17.035   9.919  -0.716
  647    HD2  HIS  77           2HD      HIS  77 -15.741  10.946   3.119
  648    HE1  HIS  77           1HE      HIS  77 -17.858  12.278  -0.302
  649    HE2  HIS  77           2HE      HIS  77 -17.077  12.897   2.034
  650    H    HIS  78           HN       HIS  78 -17.337   5.964   0.503
  651    HA   HIS  78           HA       HIS  78 -19.846   7.406   0.212
  652    HB2  HIS  78           2HB      HIS  78 -18.763   6.270  -1.694
  653    HB3  HIS  78           3HB      HIS  78 -19.000   4.708  -0.888
  654    HD1  HIS  78           1HD      HIS  78 -21.130   3.516  -1.382
  655    HD2  HIS  78           2HD      HIS  78 -21.337   7.579  -2.326
  656    HE1  HIS  78           1HE      HIS  78 -23.364   3.862  -2.522
  657    HE2  HIS  78           2HE      HIS  78 -23.487   6.332  -3.093
  658    H    HIS  79           HN       HIS  79 -20.617   7.359   2.360
  659    HA   HIS  79           HA       HIS  79 -22.501   5.235   2.780
  660    HB2  HIS  79           2HB      HIS  79 -20.609   4.020   3.687
  661    HB3  HIS  79           3HB      HIS  79 -20.134   5.412   4.677
  662    HD1  HIS  79           1HD      HIS  79 -22.638   2.611   4.489
  663    HD2  HIS  79           2HD      HIS  79 -21.590   5.734   7.054
  664    HE1  HIS  79           1HE      HIS  79 -23.879   2.191   6.655
  665    HE2  HIS  79           2HE      HIS  79 -23.239   4.090   8.212
  666    H    HIS  80           HN       HIS  80 -20.580   7.625   4.642
  667    HA   HIS  80           HA       HIS  80 -22.927   8.519   6.097
  668    HB2  HIS  80           2HB      HIS  80 -20.586   8.490   7.013
  669    HB3  HIS  80           3HB      HIS  80 -20.181   9.802   5.891
  670    HD1  HIS  80           1HD      HIS  80 -21.500  12.116   6.282
  671    HD2  HIS  80           2HD      HIS  80 -21.753   9.298   9.357
  672    HE1  HIS  80           1HE      HIS  80 -22.318  13.370   8.327
  673    HE2  HIS  80           2HE      HIS  80 -22.470  11.654  10.193
  674    H    HIS  81           HN       HIS  81 -24.352  10.022   5.485
  675    HA   HIS  81           HA       HIS  81 -23.679  11.730   3.170
  676    HB2  HIS  81           2HB      HIS  81 -26.223  10.999   4.594
  677    HB3  HIS  81           3HB      HIS  81 -26.150  12.492   3.639
  678    HD1  HIS  81           1HD      HIS  81 -26.028  12.289   1.090
  679    HD2  HIS  81           2HD      HIS  81 -26.103   8.614   3.073
  680    HE1  HIS  81           1HE      HIS  81 -26.453  10.536  -0.688
  681    HE2  HIS  81           2HE      HIS  81 -26.495   8.305   0.522
  Start of MODEL   16
    1    H1   MET   1           HN       MET   1  -3.556   6.543  12.920
    2    HA   MET   1           HA       MET   1  -1.972   7.202  10.658
    3    HB2  MET   1           2HB      MET   1  -0.084   7.396  12.167
    4    HB3  MET   1           3HB      MET   1  -0.449   5.809  12.883
    5    HG2  MET   1           2HG      MET   1   0.055   4.722  10.745
    6    HG3  MET   1           3HG      MET   1   0.399   6.301  10.015
    7    HE1  MET   1           3HE      MET   1   2.743   5.322   9.200
    8    HE2  MET   1           1HE      MET   1   3.936   4.577  10.289
    9    HE3  MET   1           2HE      MET   1   2.381   3.769   9.990
   10    H    PHE   2           HN       PHE   2  -2.472   5.766   9.147
   11    HA   PHE   2           HA       PHE   2  -3.045   2.982  10.037
   12    HB2  PHE   2           2HB      PHE   2  -5.089   4.219   9.299
   13    HB3  PHE   2           3HB      PHE   2  -4.335   4.445   7.712
   14    HD1  PHE   2           1HD      PHE   2  -5.485   1.833  10.104
   15    HD2  PHE   2           2HD      PHE   2  -4.470   2.763   6.076
   16    HE1  PHE   2           1HE      PHE   2  -6.368  -0.343   9.382
   17    HE2  PHE   2           2HE      PHE   2  -5.344   0.587   5.350
   18    HZ   PHE   2           HZ       PHE   2  -6.286  -0.975   7.003
   19    H    SER   3           HN       SER   3  -1.411   1.754   9.441
   20    HA   SER   3           HA       SER   3   0.362   2.644   7.299
   21    HB2  SER   3           2HB      SER   3   0.470   0.095   8.947
   22    HB3  SER   3           3HB      SER   3   1.798   0.859   8.040
   23    HG   SER   3           HG       SER   3   1.875   1.324  10.291
   24    H    LEU   4           HN       LEU   4   0.918   1.427   5.456
   25    HA   LEU   4           HA       LEU   4  -1.278   0.212   4.098
   26    HB2  LEU   4           2HB      LEU   4   0.614   1.399   3.018
   27    HB3  LEU   4           3HB      LEU   4   1.692   0.063   3.490
   28    HG   LEU   4           HG       LEU   4   0.435  -1.471   2.063
   29   HD11  LEU   4          1HD1      LEU   4  -1.289  -0.622   0.529
   30   HD12  LEU   4          2HD1      LEU   4  -1.763  -0.397   2.229
   31   HD13  LEU   4          3HD1      LEU   4  -1.164   0.986   1.281
   32   HD21  LEU   4          3HD2      LEU   4   2.353  -0.257   1.131
   33   HD22  LEU   4          1HD2      LEU   4   1.114  -0.542  -0.113
   34   HD23  LEU   4          2HD2      LEU   4   1.277   1.068   0.627
   35    H    ARG   5           HN       ARG   5   1.198  -1.014   6.208
   36    HA   ARG   5           HA       ARG   5   1.146  -3.774   5.485
   37    HB2  ARG   5           2HB      ARG   5   2.096  -4.147   7.700
   38    HB3  ARG   5           3HB      ARG   5   2.832  -2.697   6.974
   39    HG2  ARG   5           2HG      ARG   5   1.941  -1.312   8.508
   40    HG3  ARG   5           3HG      ARG   5   0.417  -2.227   8.606
   41    HD2  ARG   5           2HD      ARG   5   1.568  -3.944   9.964
   42    HD3  ARG   5           3HD      ARG   5   3.052  -2.970   9.907
   43    HE   ARG   5           HE       ARG   5   0.556  -1.784  10.992
   44   HH11  ARG   5          2HH1      ARG   5   3.783  -3.066  11.526
   45   HH12  ARG   5          1HH1      ARG   5   3.977  -2.281  13.077
   46   HH21  ARG   5          2HH2      ARG   5   0.833  -0.713  12.989
   47   HH22  ARG   5          1HH2      ARG   5   2.304  -0.946  13.906
   48    H    ASP   6           HN       ASP   6  -1.137  -1.721   7.094
   49    HA   ASP   6           HA       ASP   6  -2.459  -3.935   8.501
   50    HB2  ASP   6           2HB      ASP   6  -2.890  -0.944   8.374
   51    HB3  ASP   6           3HB      ASP   6  -4.077  -2.031   9.128
   52    HD2  ASP   6           2HD      ASP   6  -0.639  -1.389  11.017
   53    H    ALA   7           HN       ALA   7  -2.438  -2.820   5.385
   54    HA   ALA   7           HA       ALA   7  -5.318  -3.152   4.919
   55    HB1  ALA   7           1HB      ALA   7  -4.749  -2.714   2.566
   56    HB2  ALA   7           2HB      ALA   7  -4.073  -1.467   3.640
   57    HB3  ALA   7           3HB      ALA   7  -3.018  -2.740   2.980
   58    H    LYS   8           HN       LYS   8  -6.236  -5.077   4.630
   59    HA   LYS   8           HA       LYS   8  -4.416  -7.374   4.311
   60    HB2  LYS   8           2HB      LYS   8  -7.155  -6.976   5.438
   61    HB3  LYS   8           3HB      LYS   8  -6.737  -8.578   4.783
   62    HG2  LYS   8           2HG      LYS   8  -6.331  -8.515   7.173
   63    HG3  LYS   8           3HG      LYS   8  -4.792  -8.670   6.294
   64    HD2  LYS   8           2HD      LYS   8  -4.457  -6.215   6.548
   65    HD3  LYS   8           3HD      LYS   8  -5.936  -6.151   7.536
   66    HE2  LYS   8           2HE      LYS   8  -3.487  -7.830   8.164
   67    HE3  LYS   8           3HE      LYS   8  -3.853  -6.250   8.890
   68    HZ1  LYS   8           3HZ      LYS   8  -5.519  -8.666   9.116
   69    HZ2  LYS   8           1HZ      LYS   8  -4.547  -8.057  10.298
   70    HZ3  LYS   8           2HZ      LYS   8  -5.859  -7.200   9.790
   71    H    CYS   9           HN       CYS   9  -5.411  -9.301   3.149
   72    HA   CYS   9           HA       CYS   9  -5.539  -8.660   0.400
   73    HB2  CYS   9           2HB      CYS   9  -6.282 -11.085   0.209
   74    HB3  CYS   9           3HB      CYS   9  -4.724 -10.778   1.015
   75    HG   CYS   9           HG       CYS   9  -5.931 -12.796   2.152
   76    H    GLY  10           HN       GLY  10  -7.115  -7.964  -0.852
   77    HA2  GLY  10           1HA      GLY  10  -9.317  -8.165  -1.736
   78    HA3  GLY  10           2HA      GLY  10  -9.890  -8.719  -0.146
   79    H    GLN  11           HN       GLN  11  -7.978  -6.328   0.779
   80    HA   GLN  11           HA       GLN  11 -10.215  -4.406   0.791
   81    HB2  GLN  11           2HB      GLN  11  -7.605  -4.546   2.322
   82    HB3  GLN  11           3HB      GLN  11  -8.743  -3.181   2.430
   83    HG2  GLN  11           2HG      GLN  11 -10.486  -4.722   3.238
   84    HG3  GLN  11           3HG      GLN  11  -9.321  -6.062   3.165
   85   HE21  GLN  11          1HE2      GLN  11 -10.815  -4.938   5.459
   86   HE22  GLN  11          2HE2      GLN  11  -9.598  -4.473   6.631
   87    H    THR  12           HN       THR  12  -9.847  -2.159   0.373
   88    HA   THR  12           HA       THR  12  -7.571  -1.647  -1.471
   89    HB   THR  12           HB       THR  12 -10.408  -0.579  -1.756
   90    HG1  THR  12           1HG      THR  12 -10.436  -1.981  -3.595
   91   HG21  THR  12          3HG2      THR  12  -7.987  -0.371  -3.580
   92   HG22  THR  12          1HG2      THR  12  -9.614   0.249  -3.940
   93   HG23  THR  12          2HG2      THR  12  -8.676   0.949  -2.603
   94    H    VAL  13           HN       VAL  13  -6.380   0.085  -0.946
   95    HA   VAL  13           HA       VAL  13  -7.577   2.044   0.940
   96    HB   VAL  13           HB       VAL  13  -5.333   2.248   2.020
   97   HG11  VAL  13          1HG1      VAL  13  -5.506   0.203   3.373
   98   HG12  VAL  13          2HG1      VAL  13  -7.106   0.911   3.054
   99   HG13  VAL  13          3HG1      VAL  13  -6.567  -0.520   2.142
  100   HG21  VAL  13          3HG2      VAL  13  -3.977   1.352   0.187
  101   HG22  VAL  13          1HG2      VAL  13  -3.677   0.459   1.697
  102   HG23  VAL  13          2HG2      VAL  13  -4.700  -0.258   0.431
  103    H    LYS  14           HN       LYS  14  -5.899   3.974   1.129
  104    HA   LYS  14           HA       LYS  14  -4.976   4.683  -1.612
  105    HB2  LYS  14           2HB      LYS  14  -7.148   5.703  -1.264
  106    HB3  LYS  14           3HB      LYS  14  -6.635   6.328   0.322
  107    HG2  LYS  14           2HG      LYS  14  -4.859   7.646  -0.958
  108    HG3  LYS  14           3HG      LYS  14  -5.774   7.226  -2.426
  109    HD2  LYS  14           2HD      LYS  14  -6.793   8.724   0.008
  110    HD3  LYS  14           3HD      LYS  14  -6.527   9.380  -1.625
  111    HE2  LYS  14           2HE      LYS  14  -8.316   8.116  -2.534
  112    HE3  LYS  14           3HE      LYS  14  -8.429   7.093  -1.085
  113    HZ1  LYS  14           3HZ      LYS  14  -9.076   9.961  -1.213
  114    HZ2  LYS  14           1HZ      LYS  14 -10.171   8.730  -1.157
  115    HZ3  LYS  14           2HZ      LYS  14  -9.182   9.010   0.131
  116    H    VAL  15           HN       VAL  15  -2.927   5.397  -1.614
  117    HA   VAL  15           HA       VAL  15  -1.551   5.800   0.923
  118    HB   VAL  15           HB       VAL  15  -0.555   6.246  -1.921
  119   HG11  VAL  15          1HG1      VAL  15   1.694   6.071  -0.938
  120   HG12  VAL  15          2HG1      VAL  15   0.780   7.427  -0.238
  121   HG13  VAL  15          3HG1      VAL  15   0.972   5.915   0.680
  122   HG21  VAL  15          3HG2      VAL  15  -1.278   3.935  -1.565
  123   HG22  VAL  15          1HG2      VAL  15   0.492   4.034  -1.712
  124   HG23  VAL  15          2HG2      VAL  15  -0.257   3.832  -0.111
  125    H    VAL  16           HN       VAL  16  -1.279   7.719   1.975
  126    HA   VAL  16           HA       VAL  16  -1.884  10.124   0.345
  127    HB   VAL  16           HB       VAL  16  -2.518  11.234   2.539
  128   HG11  VAL  16          1HG1      VAL  16  -4.791  10.292   2.514
  129   HG12  VAL  16          2HG1      VAL  16  -4.162  10.520   0.866
  130   HG13  VAL  16          3HG1      VAL  16  -4.200   8.893   1.589
  131   HG21  VAL  16          3HG2      VAL  16  -1.497   9.616   4.070
  132   HG22  VAL  16          1HG2      VAL  16  -3.241   9.771   4.381
  133   HG23  VAL  16          2HG2      VAL  16  -2.618   8.358   3.498
  134    H    LYS  17           HN       LYS  17   0.177   8.915   3.038
  135    HA   LYS  17           HA       LYS  17   2.090  11.000   2.169
  136    HB2  LYS  17           2HB      LYS  17   0.740  11.641   4.278
  137    HB3  LYS  17           3HB      LYS  17   1.724  10.406   5.100
  138    HG2  LYS  17           2HG      LYS  17   3.763  11.569   4.481
  139    HG3  LYS  17           3HG      LYS  17   2.832  12.763   3.546
  140    HD2  LYS  17           2HD      LYS  17   1.705  13.478   5.628
  141    HD3  LYS  17           3HD      LYS  17   2.707  12.325   6.543
  142    HE2  LYS  17           2HE      LYS  17   4.741  13.489   5.743
  143    HE3  LYS  17           3HE      LYS  17   3.715  14.661   4.887
  144    HZ1  LYS  17           3HZ      LYS  17   3.742  14.212   7.794
  145    HZ2  LYS  17           1HZ      LYS  17   4.429  15.491   7.013
  146    HZ3  LYS  17           2HZ      LYS  17   2.791  15.300   6.999
  147    H    LEU  18           HN       LEU  18   4.146  10.417   2.093
  148    HA   LEU  18           HA       LEU  18   4.816   7.648   2.926
  149    HB2  LEU  18           2HB      LEU  18   6.329   9.602   1.165
  150    HB3  LEU  18           3HB      LEU  18   6.709   7.882   1.426
  151    HG   LEU  18           HG       LEU  18   4.156   8.883   0.130
  152   HD11  LEU  18          1HD1      LEU  18   5.167   8.199  -2.010
  153   HD12  LEU  18          2HD1      LEU  18   6.104   9.497  -1.234
  154   HD13  LEU  18          3HD1      LEU  18   6.686   7.816  -1.168
  155   HD21  LEU  18          3HD2      LEU  18   4.011   6.658   1.157
  156   HD22  LEU  18          1HD2      LEU  18   3.947   6.547  -0.617
  157   HD23  LEU  18          2HD2      LEU  18   5.448   6.138   0.245
  158    H    HIS  19           HN       HIS  19   5.916   7.384   4.794
  159    HA   HIS  19           HA       HIS  19   6.858   9.824   6.143
  160    HB2  HIS  19           2HB      HIS  19   6.515   6.959   7.065
  161    HB3  HIS  19           3HB      HIS  19   7.212   8.234   8.082
  162    HD1  HIS  19           1HD      HIS  19   4.896   7.128   9.371
  163    HD2  HIS  19           2HD      HIS  19   4.440   9.995   6.368
  164    HE1  HIS  19           1HE      HIS  19   2.589   8.128   9.694
  165    HE2  HIS  19           2HE      HIS  19   2.322   9.875   7.871
  166    H    GLY  20           HN       GLY  20   8.224   7.652   4.038
  167    HA2  GLY  20           1HA      GLY  20  10.782   7.377   5.437
  168    HA3  GLY  20           2HA      GLY  20  10.381   6.794   3.806
  169    H    THR  21           HN       THR  21  12.825   7.988   4.325
  170    HA   THR  21           HA       THR  21  12.639  10.773   3.429
  171    HB   THR  21           HB       THR  21  15.207   9.189   3.576
  172    HG1  THR  21           1HG      THR  21  15.234   9.716   5.835
  173   HG21  THR  21          3HG2      THR  21  14.465  12.054   4.277
  174   HG22  THR  21          1HG2      THR  21  16.102  11.362   4.344
  175   HG23  THR  21          2HG2      THR  21  15.269  11.524   2.781
  176    H    GLY  22           HN       GLY  22  14.674  11.070   1.612
  177    HA2  GLY  22           1HA      GLY  22  13.332  10.652  -0.776
  178    HA3  GLY  22           2HA      GLY  22  15.080  10.954  -0.635
  179    H    ALA  23           HN       ALA  23  15.897   8.541   0.604
  180    HA   ALA  23           HA       ALA  23  16.106   6.908  -1.731
  181    HB1  ALA  23           1HB      ALA  23  17.298   5.327  -0.270
  182    HB2  ALA  23           2HB      ALA  23  17.852   6.996  -0.009
  183    HB3  ALA  23           3HB      ALA  23  16.747   6.233   1.158
  184    H    LEU  24           HN       LEU  24  14.071   6.759   1.164
  185    HA   LEU  24           HA       LEU  24  12.925   4.190   0.517
  186    HB2  LEU  24           2HB      LEU  24  12.168   6.437   2.383
  187    HB3  LEU  24           3HB      LEU  24  11.083   5.052   2.117
  188    HG   LEU  24           HG       LEU  24  12.362   4.785   4.160
  189   HD11  LEU  24          1HD1      LEU  24  13.300   2.550   3.737
  190   HD12  LEU  24          2HD1      LEU  24  11.754   2.781   2.889
  191   HD13  LEU  24          3HD1      LEU  24  13.287   2.878   1.990
  192   HD21  LEU  24          3HD2      LEU  24  14.333   6.112   3.572
  193   HD22  LEU  24          1HD2      LEU  24  14.805   4.495   4.139
  194   HD23  LEU  24          2HD2      LEU  24  14.831   4.867   2.402
  195    H    LYS  25           HN       LYS  25  11.936   7.592   0.097
  196    HA   LYS  25           HA       LYS  25   9.373   7.156  -0.957
  197    HB2  LYS  25           2HB      LYS  25  11.394   9.336  -1.566
  198    HB3  LYS  25           3HB      LYS  25   9.689   9.376  -2.075
  199    HG2  LYS  25           2HG      LYS  25   8.967   9.405   0.245
  200    HG3  LYS  25           3HG      LYS  25  10.656   9.273   0.794
  201    HD2  LYS  25           2HD      LYS  25  11.181  11.417  -0.279
  202    HD3  LYS  25           3HD      LYS  25   9.503  11.546  -0.858
  203    HE2  LYS  25           2HE      LYS  25   8.693  11.631   1.444
  204    HE3  LYS  25           3HE      LYS  25  10.350  11.430   2.053
  205    HZ1  LYS  25           3HZ      LYS  25   9.378  13.700   0.447
  206    HZ2  LYS  25           1HZ      LYS  25   9.668  13.726   2.070
  207    HZ3  LYS  25           2HZ      LYS  25  10.915  13.513   1.014
  208    H    ARG  26           HN       ARG  26  12.488   7.566  -2.707
  209    HA   ARG  26           HA       ARG  26  11.287   7.415  -5.290
  210    HB2  ARG  26           2HB      ARG  26  13.567   8.368  -4.614
  211    HB3  ARG  26           3HB      ARG  26  14.150   6.687  -4.659
  212    HG2  ARG  26           2HG      ARG  26  13.471   6.519  -7.011
  213    HG3  ARG  26           3HG      ARG  26  12.904   8.205  -6.964
  214    HD2  ARG  26           2HD      ARG  26  15.252   8.855  -6.280
  215    HD3  ARG  26           3HD      ARG  26  15.737   7.187  -6.650
  216    HE   ARG  26           HE       ARG  26  14.329   8.250  -8.871
  217   HH11  ARG  26          2HH1      ARG  26  17.438   8.371  -7.231
  218   HH12  ARG  26          1HH1      ARG  26  18.286   9.010  -8.620
  219   HH21  ARG  26          2HH2      ARG  26  15.412   9.178 -10.640
  220   HH22  ARG  26          1HH2      ARG  26  17.135   9.468 -10.554
  221    H    ARG  27           HN       ARG  27  12.613   4.967  -3.095
  222    HA   ARG  27           HA       ARG  27  12.709   2.805  -4.939
  223    HB2  ARG  27           2HB      ARG  27  13.708   2.808  -2.652
  224    HB3  ARG  27           3HB      ARG  27  12.067   2.726  -1.967
  225    HG2  ARG  27           2HG      ARG  27  12.978   0.521  -1.929
  226    HG3  ARG  27           3HG      ARG  27  11.746   0.569  -3.214
  227    HD2  ARG  27           2HD      ARG  27  13.592   0.969  -4.864
  228    HD3  ARG  27           3HD      ARG  27  14.757   0.710  -3.547
  229    HE   ARG  27           HE       ARG  27  12.790  -1.386  -4.336
  230   HH11  ARG  27          2HH1      ARG  27  16.039  -0.364  -3.457
  231   HH12  ARG  27          1HH1      ARG  27  16.736  -1.952  -3.683
  232   HH21  ARG  27          2HH2      ARG  27  13.730  -3.438  -4.706
  233   HH22  ARG  27          1HH2      ARG  27  15.432  -3.689  -4.389
  234    H    ILE  28           HN       ILE  28  10.134   3.973  -2.764
  235    HA   ILE  28           HA       ILE  28   8.244   1.946  -3.538
  236    HB   ILE  28           HB       ILE  28   7.776   4.648  -2.209
  237   HG12  ILE  28          2HG1      ILE  28   8.201   1.905  -0.982
  238   HG13  ILE  28          3HG1      ILE  28   9.420   3.202  -1.044
  239   HG21  ILE  28          1HG2      ILE  28   5.717   3.615  -1.342
  240   HG22  ILE  28          2HG2      ILE  28   5.725   3.651  -3.120
  241   HG23  ILE  28          3HG2      ILE  28   6.074   2.133  -2.258
  242   HD11  ILE  28          3HD1      ILE  28   6.759   3.328   0.396
  243   HD12  ILE  28          1HD1      ILE  28   8.343   3.095   1.165
  244   HD13  ILE  28          2HD1      ILE  28   7.979   4.622   0.336
  245    H    MET  29           HN       MET  29   8.936   5.264  -4.578
  246    HA   MET  29           HA       MET  29   6.623   5.593  -6.220
  247    HB2  MET  29           2HB      MET  29   9.373   6.861  -6.355
  248    HB3  MET  29           3HB      MET  29   7.991   7.359  -7.359
  249    HG2  MET  29           2HG      MET  29   6.733   7.961  -5.359
  250    HG3  MET  29           3HG      MET  29   8.071   7.418  -4.333
  251    HE1  MET  29           3HE      MET  29   8.271   9.665  -3.047
  252    HE2  MET  29           1HE      MET  29   8.306  11.266  -3.822
  253    HE3  MET  29           2HE      MET  29   6.846  10.255  -3.936
  254    H    ASP  30           HN       ASP  30   9.928   4.417  -6.917
  255    HA   ASP  30           HA       ASP  30   9.611   4.020  -9.702
  256    HB2  ASP  30           2HB      ASP  30  11.785   3.890  -8.645
  257    HB3  ASP  30           3HB      ASP  30  11.262   2.525  -7.634
  258    HD2  ASP  30           2HD      ASP  30  12.361   1.818 -11.375
  259    H    MET  31           HN       MET  31   8.628   2.144  -6.913
  260    HA   MET  31           HA       MET  31   7.926  -0.272  -8.280
  261    HB2  MET  31           2HB      MET  31   8.318   0.281  -5.768
  262    HB3  MET  31           3HB      MET  31   6.606   0.768  -5.782
  263    HG2  MET  31           2HG      MET  31   5.883  -1.423  -6.267
  264    HG3  MET  31           3HG      MET  31   7.519  -1.958  -6.688
  265    HE1  MET  31           3HE      MET  31   5.910   0.066  -3.650
  266    HE2  MET  31           1HE      MET  31   7.055  -0.421  -2.380
  267    HE3  MET  31           2HE      MET  31   7.636   0.472  -3.803
  268    H    GLY  32           HN       GLY  32   6.389   2.844  -7.924
  269    HA2  GLY  32           1HA      GLY  32   4.643   3.318  -9.593
  270    HA3  GLY  32           2HA      GLY  32   3.967   1.711  -9.241
  271    H    ILE  33           HN       ILE  33   4.815   2.420  -6.304
  272    HA   ILE  33           HA       ILE  33   2.127   3.325  -5.630
  273    HB   ILE  33           HB       ILE  33   4.447   2.712  -3.760
  274   HG12  ILE  33          2HG1      ILE  33   2.307   0.901  -4.921
  275   HG13  ILE  33          3HG1      ILE  33   4.067   0.783  -5.160
  276   HG21  ILE  33          1HG2      ILE  33   2.663   2.326  -2.109
  277   HG22  ILE  33          2HG2      ILE  33   2.603   3.984  -2.753
  278   HG23  ILE  33          3HG2      ILE  33   1.441   2.764  -3.326
  279   HD11  ILE  33          3HD1      ILE  33   2.594   0.365  -2.547
  280   HD12  ILE  33          1HD1      ILE  33   3.266  -0.919  -3.573
  281   HD13  ILE  33          2HD1      ILE  33   4.354   0.245  -2.787
  282    H    THR  34           HN       THR  34   1.597   5.386  -5.497
  283    HA   THR  34           HA       THR  34   3.654   7.316  -4.556
  284    HB   THR  34           HB       THR  34   2.482   8.925  -6.260
  285    HG1  THR  34           1HG      THR  34   1.752   7.763  -8.122
  286   HG21  THR  34          3HG2      THR  34   4.353   6.730  -7.221
  287   HG22  THR  34          1HG2      THR  34   4.099   8.299  -8.017
  288   HG23  THR  34          2HG2      THR  34   4.840   8.234  -6.403
  289    H    ARG  35           HN       ARG  35   2.308   9.625  -4.431
  290    HA   ARG  35           HA       ARG  35   0.377   9.064  -2.316
  291    HB2  ARG  35           2HB      ARG  35   1.186  11.734  -3.501
  292    HB3  ARG  35           3HB      ARG  35   0.356  11.450  -1.953
  293    HG2  ARG  35           2HG      ARG  35   2.381  10.233  -1.158
  294    HG3  ARG  35           3HG      ARG  35   3.202  10.699  -2.668
  295    HD2  ARG  35           2HD      ARG  35   2.588  13.113  -2.045
  296    HD3  ARG  35           3HD      ARG  35   2.213  12.473  -0.430
  297    HE   ARG  35           HE       ARG  35   4.886  12.016  -1.643
  298   HH11  ARG  35          2HH1      ARG  35   2.865  13.365   0.908
  299   HH12  ARG  35          1HH1      ARG  35   4.222  13.780   1.930
  300   HH21  ARG  35          2HH2      ARG  35   6.640  12.585  -0.316
  301   HH22  ARG  35          1HH2      ARG  35   6.357  13.339   1.237
  302    H    GLY  36           HN       GLY  36  -1.770   9.025  -2.493
  303    HA2  GLY  36           1HA      GLY  36  -3.866   9.621  -3.295
  304    HA3  GLY  36           2HA      GLY  36  -3.095  10.574  -4.584
  305    H    CYS  37           HN       CYS  37  -2.174   7.222  -4.020
  306    HA   CYS  37           HA       CYS  37  -3.550   6.562  -6.572
  307    HB2  CYS  37           2HB      CYS  37  -1.941   4.778  -6.839
  308    HB3  CYS  37           3HB      CYS  37  -1.106   6.333  -6.599
  309    HG   CYS  37           HG       CYS  37   0.277   4.402  -5.512
  310    H    GLU  38           HN       GLU  38  -4.693   4.645  -6.774
  311    HA   GLU  38           HA       GLU  38  -5.948   3.728  -4.292
  312    HB2  GLU  38           2HB      GLU  38  -7.162   4.237  -6.458
  313    HB3  GLU  38           3HB      GLU  38  -6.411   2.770  -7.128
  314    HG2  GLU  38           2HG      GLU  38  -7.502   1.432  -5.370
  315    HG3  GLU  38           3HG      GLU  38  -8.287   2.904  -4.757
  316    HE2  GLU  38           2HE      GLU  38  -9.923   1.045  -7.765
  317    H    ILE  39           HN       ILE  39  -5.287   2.029  -3.168
  318    HA   ILE  39           HA       ILE  39  -3.394   0.153  -4.493
  319    HB   ILE  39           HB       ILE  39  -3.602   1.078  -1.601
  320   HG12  ILE  39          2HG1      ILE  39  -2.498   2.657  -3.075
  321   HG13  ILE  39          3HG1      ILE  39  -1.327   1.908  -1.964
  322   HG21  ILE  39          1HG2      ILE  39  -1.686  -0.381  -1.120
  323   HG22  ILE  39          2HG2      ILE  39  -3.098  -1.316  -1.664
  324   HG23  ILE  39          3HG2      ILE  39  -1.748  -1.008  -2.783
  325   HD11  ILE  39          3HD1      ILE  39  -1.746   1.169  -4.869
  326   HD12  ILE  39          1HD1      ILE  39  -0.393   2.124  -4.229
  327   HD13  ILE  39          2HD1      ILE  39  -0.573   0.422  -3.757
  328    H    TYR  40           HN       TYR  40  -4.345  -1.725  -4.959
  329    HA   TYR  40           HA       TYR  40  -6.320  -2.811  -3.018
  330    HB2  TYR  40           2HB      TYR  40  -7.121  -2.725  -5.324
  331    HB3  TYR  40           3HB      TYR  40  -5.694  -3.614  -5.883
  332    HD1  TYR  40           1HD      TYR  40  -8.798  -3.911  -3.849
  333    HD2  TYR  40           2HD      TYR  40  -5.612  -5.998  -5.761
  334    HE1  TYR  40           1HE      TYR  40  -9.948  -6.042  -3.444
  335    HE2  TYR  40           2HE      TYR  40  -6.770  -8.126  -5.371
  336    HH   TYR  40           HH       TYR  40  -8.586  -9.162  -4.498
  337    H    ILE  41           HN       ILE  41  -5.728  -4.397  -1.679
  338    HA   ILE  41           HA       ILE  41  -3.039  -5.535  -2.043
  339    HB   ILE  41           HB       ILE  41  -4.966  -5.927   0.279
  340   HG12  ILE  41          2HG1      ILE  41  -4.443  -3.544  -0.072
  341   HG13  ILE  41          3HG1      ILE  41  -3.729  -4.178   1.430
  342   HG21  ILE  41          1HG2      ILE  41  -2.928  -6.547   1.521
  343   HG22  ILE  41          2HG2      ILE  41  -3.178  -7.611   0.119
  344   HG23  ILE  41          3HG2      ILE  41  -1.960  -6.315   0.048
  345   HD11  ILE  41          3HD1      ILE  41  -2.264  -3.724  -1.183
  346   HD12  ILE  41          1HD1      ILE  41  -2.159  -2.688   0.255
  347   HD13  ILE  41          2HD1      ILE  41  -1.550  -4.356   0.320
  348    H    ARG  42           HN       ARG  42  -2.745  -7.383  -3.042
  349    HA   ARG  42           HA       ARG  42  -4.936  -9.149  -3.699
  350    HB2  ARG  42           2HB      ARG  42  -1.924  -9.375  -4.008
  351    HB3  ARG  42           3HB      ARG  42  -3.071 -10.610  -4.583
  352    HG2  ARG  42           2HG      ARG  42  -3.091  -7.724  -5.486
  353    HG3  ARG  42           3HG      ARG  42  -2.247  -9.038  -6.340
  354    HD2  ARG  42           2HD      ARG  42  -4.459 -10.250  -6.448
  355    HD3  ARG  42           3HD      ARG  42  -5.222  -8.770  -5.829
  356    HE   ARG  42           HE       ARG  42  -3.554  -8.303  -8.150
  357   HH11  ARG  42          2HH1      ARG  42  -6.731  -9.387  -7.090
  358   HH12  ARG  42          1HH1      ARG  42  -7.526  -8.901  -8.570
  359   HH21  ARG  42          2HH2      ARG  42  -4.598  -7.660 -10.059
  360   HH22  ARG  42          1HH2      ARG  42  -6.318  -7.923 -10.251
  361    H    LYS  43           HN       LYS  43  -1.971  -9.486  -1.705
  362    HA   LYS  43           HA       LYS  43  -3.358 -11.459  -0.011
  363    HB2  LYS  43           2HB      LYS  43  -2.479 -12.904  -1.709
  364    HB3  LYS  43           3HB      LYS  43  -0.917 -12.051  -1.716
  365    HG2  LYS  43           2HG      LYS  43  -0.670 -12.815   0.707
  366    HG3  LYS  43           3HG      LYS  43  -2.038 -13.907   0.385
  367    HD2  LYS  43           2HD      LYS  43  -0.812 -15.046  -1.339
  368    HD3  LYS  43           3HD      LYS  43   0.500 -13.847  -1.272
  369    HE2  LYS  43           2HE      LYS  43   0.991 -14.532   1.048
  370    HE3  LYS  43           3HE      LYS  43  -0.301 -15.749   0.953
  371    HZ1  LYS  43           3HZ      LYS  43   2.120 -15.686  -0.722
  372    HZ2  LYS  43           1HZ      LYS  43   1.856 -16.708   0.544
  373    HZ3  LYS  43           2HZ      LYS  43   0.922 -16.816  -0.809
  374    H    VAL  44           HN       VAL  44  -2.703 -11.347   2.063
  375    HA   VAL  44           HA       VAL  44  -0.080 -10.037   2.599
  376    HB   VAL  44           HB       VAL  44  -2.446 -10.370   4.483
  377   HG11  VAL  44          1HG1      VAL  44  -1.177  -8.890   5.988
  378   HG12  VAL  44          2HG1      VAL  44  -0.279 -10.384   5.634
  379   HG13  VAL  44          3HG1      VAL  44   0.168  -8.862   4.824
  380   HG21  VAL  44          3HG2      VAL  44  -2.925  -8.748   2.711
  381   HG22  VAL  44          1HG2      VAL  44  -2.723  -7.935   4.279
  382   HG23  VAL  44          2HG2      VAL  44  -1.411  -7.888   3.080
  383    H    ALA  45           HN       ALA  45   1.493 -11.350   3.316
  384    HA   ALA  45           HA       ALA  45   0.936 -14.156   3.652
  385    HB1  ALA  45           1HB      ALA  45   3.351 -14.338   4.105
  386    HB2  ALA  45           2HB      ALA  45   3.035 -13.340   2.667
  387    HB3  ALA  45           3HB      ALA  45   3.464 -12.567   4.213
  388    HA   PRO  46           HA       PRO  46   0.037 -14.334   7.970
  389    HB2  PRO  46           2HB      PRO  46   1.512 -16.950   7.991
  390    HB3  PRO  46           3HB      PRO  46  -0.203 -16.574   8.359
  391    HG2  PRO  46           2HG      PRO  46   0.521 -17.826   6.122
  392    HG3  PRO  46           3HG      PRO  46  -0.885 -16.714   6.180
  393    HD2  PRO  46           2HD      PRO  46   1.901 -16.306   5.089
  394    HD3  PRO  46           3HD      PRO  46   0.333 -15.702   4.473
  395    H    LEU  47           HN       LEU  47   3.279 -14.753   6.727
  396    HA   LEU  47           HA       LEU  47   4.571 -14.506   9.333
  397    HB2  LEU  47           2HB      LEU  47   5.552 -15.764   7.431
  398    HB3  LEU  47           3HB      LEU  47   5.696 -14.237   6.526
  399    HG   LEU  47           HG       LEU  47   7.033 -14.404   9.192
  400   HD11  LEU  47          1HD1      LEU  47   9.008 -15.495   8.194
  401   HD12  LEU  47          2HD1      LEU  47   7.589 -16.566   8.154
  402   HD13  LEU  47          3HD1      LEU  47   8.111 -15.725   6.675
  403   HD21  LEU  47          3HD2      LEU  47   7.096 -12.339   7.851
  404   HD22  LEU  47          1HD2      LEU  47   8.723 -13.037   8.023
  405   HD23  LEU  47          2HD2      LEU  47   7.827 -13.237   6.499
  406    H    GLY  48           HN       GLY  48   3.151 -12.419   7.009
  407    HA2  GLY  48           1HA      GLY  48   2.835 -10.101   7.872
  408    HA3  GLY  48           2HA      GLY  48   4.579 -10.096   8.216
  409    H    ASP  49           HN       ASP  49   5.539 -11.349   5.915
  410    HA   ASP  49           HA       ASP  49   4.505  -9.916   3.587
  411    HB2  ASP  49           2HB      ASP  49   6.346  -8.525   3.168
  412    HB3  ASP  49           3HB      ASP  49   6.015  -8.292   4.898
  413    HD2  ASP  49           2HD      ASP  49   9.568  -9.348   3.912
  414    HA   PRO  50           HA       PRO  50   6.371  -9.256   1.693
  415    HB2  PRO  50           2HB      PRO  50   5.953 -10.054  -0.915
  416    HB3  PRO  50           3HB      PRO  50   7.555 -10.098  -0.111
  417    HG2  PRO  50           2HG      PRO  50   5.592 -12.318  -0.462
  418    HG3  PRO  50           3HG      PRO  50   7.351 -12.318  -0.816
  419    HD2  PRO  50           2HD      PRO  50   6.321 -13.368   1.465
  420    HD3  PRO  50           3HD      PRO  50   7.880 -12.489   1.462
  421    H    ILE  51           HN       ILE  51   4.744  -7.918   1.091
  422    HA   ILE  51           HA       ILE  51   2.012  -9.036   1.160
  423    HB   ILE  51           HB       ILE  51   3.050  -6.171   1.237
  424   HG12  ILE  51          2HG1      ILE  51   1.815  -7.937   3.372
  425   HG13  ILE  51          3HG1      ILE  51   3.523  -7.452   3.261
  426   HG21  ILE  51          1HG2      ILE  51   0.736  -5.510   1.749
  427   HG22  ILE  51          2HG2      ILE  51   0.855  -6.275   0.148
  428   HG23  ILE  51          3HG2      ILE  51   0.208  -7.193   1.528
  429   HD11  ILE  51          3HD1      ILE  51   1.171  -5.595   3.704
  430   HD12  ILE  51          1HD1      ILE  51   2.325  -6.118   4.948
  431   HD13  ILE  51          2HD1      ILE  51   2.881  -5.111   3.595
  432    H    GLN  52           HN       GLN  52   0.716  -9.122  -0.608
  433    HA   GLN  52           HA       GLN  52   1.988  -8.351  -3.172
  434    HB2  GLN  52           2HB      GLN  52  -0.424 -10.108  -2.610
  435    HB3  GLN  52           3HB      GLN  52   0.343  -9.848  -4.195
  436    HG2  GLN  52           2HG      GLN  52   1.682 -11.128  -1.799
  437    HG3  GLN  52           3HG      GLN  52   0.942 -12.012  -3.152
  438   HE21  GLN  52          1HE2      GLN  52   3.628  -9.984  -2.118
  439   HE22  GLN  52          2HE2      GLN  52   4.641 -10.272  -3.518
  440    H    ILE  53           HN       ILE  53   1.363  -6.553  -4.174
  441    HA   ILE  53           HA       ILE  53  -1.405  -5.576  -3.648
  442    HB   ILE  53           HB       ILE  53   0.915  -3.783  -4.446
  443   HG12  ILE  53          2HG1      ILE  53   0.646  -3.053  -1.919
  444   HG13  ILE  53          3HG1      ILE  53   0.133  -4.746  -1.724
  445   HG21  ILE  53          1HG2      ILE  53  -0.540  -2.001  -3.575
  446   HG22  ILE  53          2HG2      ILE  53  -1.353  -2.942  -4.847
  447   HG23  ILE  53          3HG2      ILE  53  -1.762  -3.217  -3.135
  448   HD11  ILE  53          3HD1      ILE  53   2.764  -3.808  -2.891
  449   HD12  ILE  53          1HD1      ILE  53   2.534  -4.484  -1.266
  450   HD13  ILE  53          2HD1      ILE  53   2.251  -5.500  -2.695
  451    H    ASN  54           HN       ASN  54  -2.431  -4.471  -5.454
  452    HA   ASN  54           HA       ASN  54  -1.152  -5.063  -8.083
  453    HB2  ASN  54           2HB      ASN  54  -3.222  -6.374  -7.733
  454    HB3  ASN  54           3HB      ASN  54  -4.120  -4.867  -7.451
  455   HD21  ASN  54          1HD2      ASN  54  -2.538  -6.911  -9.830
  456   HD22  ASN  54          2HD2      ASN  54  -3.166  -6.096 -11.247
  457    H    VAL  55           HN       VAL  55  -0.297  -3.240  -8.824
  458    HA   VAL  55           HA       VAL  55  -1.971  -0.783  -8.708
  459    HB   VAL  55           HB       VAL  55   1.058  -0.870  -8.414
  460   HG11  VAL  55          1HG1      VAL  55   0.850   1.533  -7.931
  461   HG12  VAL  55          2HG1      VAL  55   0.224   1.136  -9.548
  462   HG13  VAL  55          3HG1      VAL  55  -0.905   1.435  -8.204
  463   HG21  VAL  55          3HG2      VAL  55  -0.039  -1.732  -6.402
  464   HG22  VAL  55          1HG2      VAL  55   0.697  -0.143  -6.094
  465   HG23  VAL  55          2HG2      VAL  55  -1.062  -0.277  -6.327
  466    H    ARG  56           HN       ARG  56  -2.281   0.134 -10.668
  467    HA   ARG  56           HA       ARG  56  -2.087   0.553 -12.918
  468    HB2  ARG  56           2HB      ARG  56   0.796  -0.342 -12.544
  469    HB3  ARG  56           3HB      ARG  56   0.143   0.535 -13.949
  470    HG2  ARG  56           2HG      ARG  56  -0.047   1.682 -11.171
  471    HG3  ARG  56           3HG      ARG  56   1.434   1.857 -12.144
  472    HD2  ARG  56           2HD      ARG  56   0.518   3.432 -13.447
  473    HD3  ARG  56           3HD      ARG  56  -0.985   2.507 -13.651
  474    HE   ARG  56           HE       ARG  56  -1.964   3.725 -11.959
  475   HH11  ARG  56          2HH1      ARG  56   1.529   4.241 -11.843
  476   HH12  ARG  56          1HH1      ARG  56   1.412   5.574 -10.720
  477   HH21  ARG  56          2HH2      ARG  56  -2.100   5.476 -10.540
  478   HH22  ARG  56          1HH2      ARG  56  -0.646   6.274  -9.982
  479    H    GLY  57           HN       GLY  57  -2.605  -2.222 -11.723
  480    HA2  GLY  57           1HA      GLY  57  -3.309  -4.194 -12.729
  481    HA3  GLY  57           2HA      GLY  57  -2.622  -3.641 -14.273
  482    H    TYR  58           HN       TYR  58  -0.378  -3.259 -11.804
  483    HA   TYR  58           HA       TYR  58   1.004  -5.758 -12.651
  484    HB2  TYR  58           2HB      TYR  58   1.805  -3.027 -12.478
  485    HB3  TYR  58           3HB      TYR  58   2.667  -3.897 -11.198
  486    HD1  TYR  58           2HD      TYR  58   4.193  -5.782 -11.800
  487    HD2  TYR  58           1HD      TYR  58   2.381  -3.334 -14.781
  488    HE1  TYR  58           2HE      TYR  58   5.829  -6.577 -13.449
  489    HE2  TYR  58           1HE      TYR  58   4.023  -4.121 -16.430
  490    HH   TYR  58           HH       TYR  58   6.577  -6.461 -15.592
  491    H    GLU  59           HN       GLU  59   1.307  -7.341 -11.163
  492    HA   GLU  59           HA       GLU  59   0.581  -6.930  -8.391
  493    HB2  GLU  59           2HB      GLU  59   1.535  -9.164 -10.073
  494    HB3  GLU  59           3HB      GLU  59   2.055  -9.223  -8.372
  495    HG2  GLU  59           2HG      GLU  59  -0.010 -10.484  -8.764
  496    HG3  GLU  59           3HG      GLU  59  -0.242  -9.141  -7.625
  497    HE2  GLU  59           2HE      GLU  59  -1.968  -8.805 -11.198
  498    H    LEU  60           HN       LEU  60   1.836  -6.496  -6.680
  499    HA   LEU  60           HA       LEU  60   4.748  -6.143  -7.195
  500    HB2  LEU  60           2HB      LEU  60   2.928  -4.342  -5.568
  501    HB3  LEU  60           3HB      LEU  60   4.689  -4.159  -5.759
  502    HG   LEU  60           HG       LEU  60   2.642  -3.938  -7.979
  503   HD11  LEU  60          1HD1      LEU  60   3.162  -1.535  -7.924
  504   HD12  LEU  60          2HD1      LEU  60   2.487  -2.092  -6.375
  505   HD13  LEU  60          3HD1      LEU  60   4.236  -1.801  -6.531
  506   HD21  LEU  60          3HD2      LEU  60   4.824  -4.745  -8.754
  507   HD22  LEU  60          1HD2      LEU  60   4.525  -3.084  -9.316
  508   HD23  LEU  60          2HD2      LEU  60   5.624  -3.374  -7.948
  509    H    SER  61           HN       SER  61   6.073  -7.026  -5.724
  510    HA   SER  61           HA       SER  61   4.869  -8.095  -3.238
  511    HB2  SER  61           2HB      SER  61   7.590  -8.533  -4.523
  512    HB3  SER  61           3HB      SER  61   7.049  -9.276  -2.999
  513    HG   SER  61           HG       SER  61   6.728 -10.647  -4.819
  514    H    LEU  62           HN       LEU  62   4.781  -6.592  -1.659
  515    HA   LEU  62           HA       LEU  62   7.105  -4.752  -1.411
  516    HB2  LEU  62           2HB      LEU  62   4.927  -3.674  -1.725
  517    HB3  LEU  62           3HB      LEU  62   4.295  -4.529  -0.297
  518    HG   LEU  62           HG       LEU  62   5.924  -3.322   1.113
  519   HD11  LEU  62          1HD1      LEU  62   7.129  -1.383   0.193
  520   HD12  LEU  62          2HD1      LEU  62   7.640  -2.896  -0.589
  521   HD13  LEU  62          3HD1      LEU  62   6.534  -1.787  -1.435
  522   HD21  LEU  62          3HD2      LEU  62   3.634  -2.489   0.829
  523   HD22  LEU  62          1HD2      LEU  62   4.783  -1.144   1.021
  524   HD23  LEU  62          2HD2      LEU  62   4.148  -1.546  -0.591
  525    H    ARG  63           HN       ARG  63   8.243  -4.590   0.452
  526    HA   ARG  63           HA       ARG  63   8.039  -6.791   2.340
  527    HB2  ARG  63           2HB      ARG  63   9.888  -4.540   1.765
  528    HB3  ARG  63           3HB      ARG  63   9.828  -5.095   3.454
  529    HG2  ARG  63           2HG      ARG  63  11.611  -6.160   2.063
  530    HG3  ARG  63           3HG      ARG  63  10.487  -7.303   2.836
  531    HD2  ARG  63           2HD      ARG  63  10.875  -8.067   0.607
  532    HD3  ARG  63           3HD      ARG  63   9.226  -7.409   0.673
  533    HE   ARG  63           HE       ARG  63   9.866  -5.641  -0.725
  534   HH11  ARG  63          2HH1      ARG  63  12.667  -7.548   0.237
  535   HH12  ARG  63          1HH1      ARG  63  13.680  -6.949  -1.057
  536   HH21  ARG  63          2HH2      ARG  63  11.180  -4.925  -2.465
  537   HH22  ARG  63          1HH2      ARG  63  12.840  -5.465  -2.586
  538    H    LYS  64           HN       LYS  64   7.338  -6.729   4.456
  539    HA   LYS  64           HA       LYS  64   5.186  -4.967   4.978
  540    HB2  LYS  64           2HB      LYS  64   5.138  -5.946   7.220
  541    HB3  LYS  64           3HB      LYS  64   5.310  -7.188   5.957
  542    HG2  LYS  64           2HG      LYS  64   7.736  -7.307   6.453
  543    HG3  LYS  64           3HG      LYS  64   7.497  -6.137   7.774
  544    HD2  LYS  64           2HD      LYS  64   5.944  -7.685   8.875
  545    HD3  LYS  64           3HD      LYS  64   6.152  -8.850   7.545
  546    HE2  LYS  64           2HE      LYS  64   8.263  -7.911   9.511
  547    HE3  LYS  64           3HE      LYS  64   7.527  -9.526   9.416
  548    HZ1  LYS  64           3HZ      LYS  64   9.210  -8.286   7.343
  549    HZ2  LYS  64           1HZ      LYS  64   9.686  -9.471   8.385
  550    HZ3  LYS  64           2HZ      LYS  64   8.527  -9.784   7.256
  551    H    SER  65           HN       SER  65   8.601  -4.775   5.796
  552    HA   SER  65           HA       SER  65   8.465  -2.803   7.823
  553    HB2  SER  65           2HB      SER  65  10.613  -3.149   5.698
  554    HB3  SER  65           3HB      SER  65  10.799  -2.389   7.297
  555    HG   SER  65           HG       SER  65  11.516  -4.574   7.262
  556    H    ALA  66           HN       ALA  66   8.508  -2.538   4.263
  557    HA   ALA  66           HA       ALA  66   8.526   0.359   4.334
  558    HB1  ALA  66           1HB      ALA  66   8.126   0.189   1.914
  559    HB2  ALA  66           2HB      ALA  66   9.448  -0.883   2.432
  560    HB3  ALA  66           3HB      ALA  66   7.837  -1.558   2.086
  561    H    ALA  67           HN       ALA  67   6.097  -2.194   4.225
  562    HA   ALA  67           HA       ALA  67   3.910  -0.505   3.481
  563    HB1  ALA  67           1HB      ALA  67   2.497  -2.380   4.225
  564    HB2  ALA  67           2HB      ALA  67   3.855  -2.946   3.226
  565    HB3  ALA  67           3HB      ALA  67   3.910  -3.138   4.995
  566    H    GLU  68           HN       GLU  68   5.511  -1.152   6.547
  567    HA   GLU  68           HA       GLU  68   3.258   0.037   8.032
  568    HB2  GLU  68           2HB      GLU  68   4.573  -0.551  10.037
  569    HB3  GLU  68           3HB      GLU  68   4.248  -1.946   8.980
  570    HG2  GLU  68           2HG      GLU  68   6.514  -1.812   8.090
  571    HG3  GLU  68           3HG      GLU  68   6.843  -0.397   9.113
  572    HE2  GLU  68           2HE      GLU  68   7.050  -3.995  10.708
  573    H    MET  69           HN       MET  69   5.663   1.340   6.260
  574    HA   MET  69           HA       MET  69   5.995   3.575   8.212
  575    HB2  MET  69           2HB      MET  69   8.030   4.191   7.106
  576    HB3  MET  69           3HB      MET  69   8.110   2.462   7.518
  577    HG2  MET  69           2HG      MET  69   7.508   1.922   5.170
  578    HG3  MET  69           3HG      MET  69   7.566   3.652   4.789
  579    HE1  MET  69           3HE      MET  69  10.032   4.405   6.853
  580    HE2  MET  69           1HE      MET  69  11.386   4.410   5.700
  581    HE3  MET  69           2HE      MET  69   9.828   5.134   5.242
  582    H    ILE  70           HN       ILE  70   3.880   2.787   6.073
  583    HA   ILE  70           HA       ILE  70   3.977   5.373   4.594
  584    HB   ILE  70           HB       ILE  70   2.652   2.760   3.759
  585   HG12  ILE  70          2HG1      ILE  70   5.022   2.570   3.511
  586   HG13  ILE  70          3HG1      ILE  70   4.319   2.849   1.899
  587   HG21  ILE  70          1HG2      ILE  70   2.163   3.913   1.640
  588   HG22  ILE  70          2HG2      ILE  70   1.384   4.726   3.017
  589   HG23  ILE  70          3HG2      ILE  70   2.860   5.412   2.296
  590   HD11  ILE  70          3HD1      ILE  70   5.676   4.928   3.632
  591   HD12  ILE  70          1HD1      ILE  70   6.387   4.143   2.206
  592   HD13  ILE  70          2HD1      ILE  70   4.975   5.205   2.020
  593    H    GLU  71           HN       GLU  71   2.305   6.738   4.769
  594    HA   GLU  71           HA       GLU  71   0.132   6.019   6.631
  595    HB2  GLU  71           2HB      GLU  71   1.427   8.171   6.797
  596    HB3  GLU  71           3HB      GLU  71   0.711   8.652   5.240
  597    HG2  GLU  71           2HG      GLU  71  -0.536   9.714   6.964
  598    HG3  GLU  71           3HG      GLU  71  -1.547   8.415   6.296
  599    HE2  GLU  71           2HE      GLU  71  -1.794   6.918   9.375
  600    H    VAL  72           HN       VAL  72  -1.658   5.113   5.818
  601    HA   VAL  72           HA       VAL  72  -2.639   6.152   3.218
  602    HB   VAL  72           HB       VAL  72  -3.401   3.902   2.575
  603   HG11  VAL  72          1HG1      VAL  72  -1.218   2.928   1.996
  604   HG12  VAL  72          2HG1      VAL  72  -1.229   4.690   1.761
  605   HG13  VAL  72          3HG1      VAL  72  -0.433   3.988   3.189
  606   HG21  VAL  72          3HG2      VAL  72  -3.637   2.927   4.805
  607   HG22  VAL  72          1HG2      VAL  72  -2.620   1.901   3.767
  608   HG23  VAL  72          2HG2      VAL  72  -1.868   2.936   5.003
  609    H    GLU  73           HN       GLU  73  -4.987   5.490   2.856
  610    HA   GLU  73           HA       GLU  73  -6.436   5.294   5.447
  611    HB2  GLU  73           2HB      GLU  73  -8.146   6.849   4.539
  612    HB3  GLU  73           3HB      GLU  73  -6.562   7.613   4.812
  613    HG2  GLU  73           2HG      GLU  73  -6.071   7.541   2.449
  614    HG3  GLU  73           3HG      GLU  73  -7.571   6.643   2.129
  615    HE2  GLU  73           2HE      GLU  73  -9.198   9.626   1.708
  616    H    LEU  74           HN       LEU  74  -8.784   4.661   5.077
  617    HA   LEU  74           HA       LEU  74  -8.724   2.320   3.323
  618    HB2  LEU  74           2HB      LEU  74  -9.928   2.990   5.767
  619    HB3  LEU  74           3HB      LEU  74 -11.271   2.848   4.608
  620    HG   LEU  74           HG       LEU  74 -10.913   0.752   5.774
  621   HD11  LEU  74          1HD1      LEU  74 -10.663  -0.752   3.840
  622   HD12  LEU  74          2HD1      LEU  74 -11.676   0.654   3.446
  623   HD13  LEU  74          3HD1      LEU  74  -9.987   0.588   2.889
  624   HD21  LEU  74          3HD2      LEU  74  -8.539   1.028   6.309
  625   HD22  LEU  74          1HD2      LEU  74  -8.834  -0.533   5.510
  626   HD23  LEU  74          2HD2      LEU  74  -8.121   0.813   4.592
  627    H    GLU  75           HN       GLU  75  -9.692   2.087   1.425
  628    HA   GLU  75           HA       GLU  75 -11.336   4.312   0.364
  629    HB2  GLU  75           2HB      GLU  75  -9.395   2.613  -0.728
  630    HB3  GLU  75           3HB      GLU  75 -10.936   2.014  -1.385
  631    HG2  GLU  75           2HG      GLU  75  -9.993   4.886  -1.542
  632    HG3  GLU  75           3HG      GLU  75  -9.785   3.679  -2.830
  633    HE2  GLU  75           2HE      GLU  75 -13.323   3.693  -3.382
  634    H    HIS  76           HN       HIS  76 -12.953   2.829  -1.421
  635    HA   HIS  76           HA       HIS  76 -15.108   2.083   0.281
  636    HB2  HIS  76           2HB      HIS  76 -14.574   1.519  -2.650
  637    HB3  HIS  76           3HB      HIS  76 -16.093   1.109  -1.831
  638    HD1  HIS  76           1HD      HIS  76 -14.058   4.058  -3.019
  639    HD2  HIS  76           2HD      HIS  76 -17.824   3.248  -1.408
  640    HE1  HIS  76           1HE      HIS  76 -15.408   6.186  -3.281
  641    HE2  HIS  76           2HE      HIS  76 -17.699   5.689  -2.303
  642    H    HIS  77           HN       HIS  77 -15.079   0.381   1.631
  643    HA   HIS  77           HA       HIS  77 -13.436  -1.924   0.890
  644    HB2  HIS  77           2HB      HIS  77 -13.902  -2.742   3.176
  645    HB3  HIS  77           3HB      HIS  77 -13.136  -1.144   3.125
  646    HD1  HIS  77           1HD      HIS  77 -14.461   0.859   4.064
  647    HD2  HIS  77           2HD      HIS  77 -16.509  -2.778   4.264
  648    HE1  HIS  77           1HE      HIS  77 -16.426   1.238   5.615
  649    HE2  HIS  77           2HE      HIS  77 -17.667  -0.972   5.735
  650    H    HIS  78           HN       HIS  78 -14.883  -2.409  -0.960
  651    HA   HIS  78           HA       HIS  78 -17.188  -4.018   0.009
  652    HB2  HIS  78           2HB      HIS  78 -18.200  -3.838  -2.160
  653    HB3  HIS  78           3HB      HIS  78 -17.812  -2.217  -1.556
  654    HD1  HIS  78           1HD      HIS  78 -17.457  -4.388  -4.455
  655    HD2  HIS  78           2HD      HIS  78 -15.422  -1.092  -2.882
  656    HE1  HIS  78           1HE      HIS  78 -16.043  -3.459  -6.344
  657    HE2  HIS  78           2HE      HIS  78 -14.813  -1.459  -5.382
  658    H    HIS  79           HN       HIS  79 -16.066  -5.827   0.593
  659    HA   HIS  79           HA       HIS  79 -14.866  -7.311  -1.698
  660    HB2  HIS  79           2HB      HIS  79 -13.255  -6.629   0.117
  661    HB3  HIS  79           3HB      HIS  79 -14.174  -7.658   1.231
  662    HD1  HIS  79           1HD      HIS  79 -12.880  -9.714   1.616
  663    HD2  HIS  79           2HD      HIS  79 -12.709  -8.510  -2.380
  664    HE1  HIS  79           1HE      HIS  79 -11.513 -11.470   0.408
  665    HE2  HIS  79           2HE      HIS  79 -11.419 -10.739  -2.020
  666    H    HIS  80           HN       HIS  80 -17.328  -7.099   0.646
  667    HA   HIS  80           HA       HIS  80 -18.058  -9.928   0.460
  668    HB2  HIS  80           2HB      HIS  80 -19.394  -7.469   1.604
  669    HB3  HIS  80           3HB      HIS  80 -20.264  -9.005   1.436
  670    HD1  HIS  80           1HD      HIS  80 -17.677  -7.268   3.496
  671    HD2  HIS  80           2HD      HIS  80 -19.336 -11.086   3.130
  672    HE1  HIS  80           1HE      HIS  80 -16.959  -8.556   5.559
  673    HE2  HIS  80           2HE      HIS  80 -17.974 -10.870   5.332
  674    H    HIS  81           HN       HIS  81 -18.439  -6.995  -1.292
  675    HA   HIS  81           HA       HIS  81 -19.469  -8.286  -3.598
  676    HB2  HIS  81           2HB      HIS  81 -21.530  -8.135  -1.963
  677    HB3  HIS  81           3HB      HIS  81 -21.533  -6.426  -2.438
  678    HD1  HIS  81           1HD      HIS  81 -21.613  -6.058  -5.188
  679    HD2  HIS  81           2HD      HIS  81 -22.900  -9.732  -3.666
  680    HE1  HIS  81           1HE      HIS  81 -23.013  -7.132  -7.011
  681    HE2  HIS  81           2HE      HIS  81 -23.788  -9.357  -6.076
  Start of MODEL   17
    1    H1   MET   1           HN       MET   1  -3.384   6.918  12.304
    2    HA   MET   1           HA       MET   1  -1.972   7.327   9.875
    3    HB2  MET   1           2HB      MET   1  -0.000   7.770  11.203
    4    HB3  MET   1           3HB      MET   1  -0.265   6.295  12.165
    5    HG2  MET   1           2HG      MET   1   0.132   4.924  10.166
    6    HG3  MET   1           3HG      MET   1   0.398   6.391   9.209
    7    HE1  MET   1           3HE      MET   1   2.711   5.257   8.417
    8    HE2  MET   1           1HE      MET   1   3.976   4.716   9.544
    9    HE3  MET   1           2HE      MET   1   2.417   3.862   9.483
   10    H    PHE   2           HN       PHE   2  -2.931   5.818   8.704
   11    HA   PHE   2           HA       PHE   2  -3.413   3.152   9.923
   12    HB2  PHE   2           2HB      PHE   2  -5.341   4.322   8.901
   13    HB3  PHE   2           3HB      PHE   2  -4.473   4.389   7.357
   14    HD1  PHE   2           1HD      PHE   2  -5.816   2.002   9.882
   15    HD2  PHE   2           2HD      PHE   2  -4.650   2.623   5.834
   16    HE1  PHE   2           1HE      PHE   2  -6.735  -0.195   9.281
   17    HE2  PHE   2           2HE      PHE   2  -5.566   0.425   5.230
   18    HZ   PHE   2           HZ       PHE   2  -6.613  -0.987   6.957
   19    H    SER   3           HN       SER   3  -1.798   1.746   9.600
   20    HA   SER   3           HA       SER   3   0.168   2.238   7.523
   21    HB2  SER   3           2HB      SER   3  -0.098  -0.257   9.222
   22    HB3  SER   3           3HB      SER   3   1.370   0.426   8.482
   23    HG   SER   3           HG       SER   3   1.212   0.884  10.731
   24    H    LEU   4           HN       LEU   4   0.521   1.157   5.637
   25    HA   LEU   4           HA       LEU   4  -1.628  -0.158   4.336
   26    HB2  LEU   4           2HB      LEU   4   0.213   0.952   3.168
   27    HB3  LEU   4           3HB      LEU   4   1.353  -0.266   3.788
   28    HG   LEU   4           HG       LEU   4   0.169  -2.000   2.498
   29   HD11  LEU   4          1HD1      LEU   4  -1.469  -1.341   0.781
   30   HD12  LEU   4          2HD1      LEU   4  -2.048  -0.952   2.417
   31   HD13  LEU   4          3HD1      LEU   4  -1.407   0.336   1.368
   32   HD21  LEU   4          3HD2      LEU   4   2.130  -0.855   1.566
   33   HD22  LEU   4          1HD2      LEU   4   0.973  -1.284   0.284
   34   HD23  LEU   4          2HD2      LEU   4   1.073   0.394   0.865
   35    H    ARG   5           HN       ARG   5   1.054  -1.348   6.301
   36    HA   ARG   5           HA       ARG   5   0.718  -4.139   5.750
   37    HB2  ARG   5           2HB      ARG   5   2.558  -2.650   7.024
   38    HB3  ARG   5           3HB      ARG   5   1.615  -3.186   8.435
   39    HG2  ARG   5           2HG      ARG   5   2.841  -5.034   6.380
   40    HG3  ARG   5           3HG      ARG   5   3.595  -4.598   7.932
   41    HD2  ARG   5           2HD      ARG   5   0.934  -6.006   7.574
   42    HD3  ARG   5           3HD      ARG   5   2.465  -6.773   8.047
   43    HE   ARG   5           HE       ARG   5   2.012  -4.733   9.899
   44   HH11  ARG   5          2HH1      ARG   5   0.363  -7.654   8.821
   45   HH12  ARG   5          1HH1      ARG   5  -0.363  -7.971  10.380
   46   HH21  ARG   5          2HH2      ARG   5   1.074  -5.161  11.931
   47   HH22  ARG   5          1HH2      ARG   5   0.041  -6.556  12.144
   48    H    ASP   6           HN       ASP   6  -0.970  -1.836   7.768
   49    HA   ASP   6           HA       ASP   6  -2.069  -3.858   9.566
   50    HB2  ASP   6           2HB      ASP   6  -1.481  -1.582  10.331
   51    HB3  ASP   6           3HB      ASP   6  -2.712  -0.907   9.241
   52    HD2  ASP   6           2HD      ASP   6  -4.153  -2.982  12.321
   53    H    ALA   7           HN       ALA   7  -2.842  -2.609   6.489
   54    HA   ALA   7           HA       ALA   7  -5.708  -2.987   6.664
   55    HB1  ALA   7           1HB      ALA   7  -5.647  -2.706   4.219
   56    HB2  ALA   7           2HB      ALA   7  -4.701  -1.444   5.043
   57    HB3  ALA   7           3HB      ALA   7  -3.870  -2.806   4.253
   58    H    LYS   8           HN       LYS   8  -6.466  -4.493   4.550
   59    HA   LYS   8           HA       LYS   8  -5.254  -7.164   5.051
   60    HB2  LYS   8           2HB      LYS   8  -8.212  -6.471   5.112
   61    HB3  LYS   8           3HB      LYS   8  -7.551  -8.124   5.118
   62    HG2  LYS   8           2HG      LYS   8  -7.019  -6.027   7.240
   63    HG3  LYS   8           3HG      LYS   8  -8.222  -7.333   7.366
   64    HD2  LYS   8           2HD      LYS   8  -6.492  -9.015   7.259
   65    HD3  LYS   8           3HD      LYS   8  -5.254  -7.779   6.930
   66    HE2  LYS   8           2HE      LYS   8  -6.916  -7.930   9.464
   67    HE3  LYS   8           3HE      LYS   8  -5.270  -8.578   9.295
   68    HZ1  LYS   8           3HZ      LYS   8  -6.045  -5.756   8.958
   69    HZ2  LYS   8           1HZ      LYS   8  -5.269  -6.388  10.267
   70    HZ3  LYS   8           2HZ      LYS   8  -4.516  -6.356   8.800
   71    H    CYS   9           HN       CYS   9  -6.198  -8.817   3.437
   72    HA   CYS   9           HA       CYS   9  -5.691  -7.726   0.806
   73    HB2  CYS   9           2HB      CYS   9  -6.055 -10.049   0.049
   74    HB3  CYS   9           3HB      CYS   9  -4.870  -9.916   1.372
   75    HG   CYS   9           HG       CYS   9  -6.207 -12.148   1.598
   76    H    GLY  10           HN       GLY  10  -7.076  -7.653  -0.991
   77    HA2  GLY  10           1HA      GLY  10  -9.139  -7.680  -2.081
   78    HA3  GLY  10           2HA      GLY  10  -9.918  -8.231  -0.581
   79    H    GLN  11           HN       GLN  11  -7.983  -5.714   0.276
   80    HA   GLN  11           HA       GLN  11 -10.294  -3.855   0.220
   81    HB2  GLN  11           2HB      GLN  11  -7.743  -3.872   1.868
   82    HB3  GLN  11           3HB      GLN  11  -9.035  -2.652   1.988
   83    HG2  GLN  11           2HG      GLN  11  -9.534  -5.598   2.429
   84    HG3  GLN  11           3HG      GLN  11  -9.010  -4.511   3.733
   85   HE21  GLN  11          1HE2      GLN  11 -10.950  -4.905   4.883
   86   HE22  GLN  11          2HE2      GLN  11 -12.464  -4.176   4.390
   87    H    THR  12           HN       THR  12 -10.157  -1.803  -0.600
   88    HA   THR  12           HA       THR  12  -7.765  -1.286  -2.287
   89    HB   THR  12           HB       THR  12 -10.489   0.061  -2.430
   90    HG1  THR  12           1HG      THR  12 -10.820  -1.382  -4.205
   91   HG21  THR  12          3HG2      THR  12  -8.187  -0.107  -4.410
   92   HG22  THR  12          1HG2      THR  12  -9.741   0.709  -4.693
   93   HG23  THR  12          2HG2      THR  12  -8.632   1.320  -3.444
   94    H    VAL  13           HN       VAL  13  -6.319  -0.013  -1.343
   95    HA   VAL  13           HA       VAL  13  -7.333   2.176   0.399
   96    HB   VAL  13           HB       VAL  13  -5.123   2.152   1.490
   97   HG11  VAL  13          1HG1      VAL  13  -5.322   0.004   2.671
   98   HG12  VAL  13          2HG1      VAL  13  -6.913   0.758   2.421
   99   HG13  VAL  13          3HG1      VAL  13  -6.399  -0.600   1.392
  100   HG21  VAL  13          3HG2      VAL  13  -3.788   1.381  -0.417
  101   HG22  VAL  13          1HG2      VAL  13  -3.499   0.365   1.014
  102   HG23  VAL  13          2HG2      VAL  13  -4.540  -0.229  -0.300
  103    H    LYS  14           HN       LYS  14  -6.068   4.171   0.392
  104    HA   LYS  14           HA       LYS  14  -4.718   4.672  -2.226
  105    HB2  LYS  14           2HB      LYS  14  -6.848   5.820  -2.175
  106    HB3  LYS  14           3HB      LYS  14  -6.506   6.470  -0.553
  107    HG2  LYS  14           2HG      LYS  14  -4.362   7.335  -2.113
  108    HG3  LYS  14           3HG      LYS  14  -5.781   7.506  -3.172
  109    HD2  LYS  14           2HD      LYS  14  -5.583   8.582  -0.341
  110    HD3  LYS  14           3HD      LYS  14  -5.318   9.540  -1.816
  111    HE2  LYS  14           2HE      LYS  14  -7.601   9.149  -2.533
  112    HE3  LYS  14           3HE      LYS  14  -7.883   8.066  -1.152
  113    HZ1  LYS  14           3HZ      LYS  14  -7.272  10.941  -0.977
  114    HZ2  LYS  14           1HZ      LYS  14  -8.756  10.260  -0.753
  115    HZ3  LYS  14           2HZ      LYS  14  -7.533   9.937   0.304
  116    H    VAL  15           HN       VAL  15  -2.700   5.600  -2.117
  117    HA   VAL  15           HA       VAL  15  -1.417   5.630   0.459
  118    HB   VAL  15           HB       VAL  15  -0.402   6.757  -2.177
  119   HG11  VAL  15          1HG1      VAL  15   1.824   6.438  -1.183
  120   HG12  VAL  15          2HG1      VAL  15   0.834   7.556  -0.217
  121   HG13  VAL  15          3HG1      VAL  15   1.069   5.877   0.327
  122   HG21  VAL  15          3HG2      VAL  15  -1.037   4.400  -2.391
  123   HG22  VAL  15          1HG2      VAL  15   0.730   4.593  -2.455
  124   HG23  VAL  15          2HG2      VAL  15  -0.045   3.998  -0.968
  125    H    VAL  16           HN       VAL  16  -1.403   7.216   1.934
  126    HA   VAL  16           HA       VAL  16  -2.005   9.948   0.941
  127    HB   VAL  16           HB       VAL  16  -2.564  10.242   3.545
  128   HG11  VAL  16          1HG1      VAL  16  -4.933   9.909   2.967
  129   HG12  VAL  16          2HG1      VAL  16  -4.058  10.743   1.662
  130   HG13  VAL  16          3HG1      VAL  16  -4.450   9.013   1.509
  131   HG21  VAL  16          3HG2      VAL  16  -2.039   7.922   4.131
  132   HG22  VAL  16          1HG2      VAL  16  -3.761   8.276   4.403
  133   HG23  VAL  16          2HG2      VAL  16  -3.259   7.349   2.970
  134    H    LYS  17           HN       LYS  17   0.175   7.998   2.946
  135    HA   LYS  17           HA       LYS  17   1.919  10.399   3.091
  136    HB2  LYS  17           2HB      LYS  17   0.564   9.929   5.246
  137    HB3  LYS  17           3HB      LYS  17   1.642   8.527   5.438
  138    HG2  LYS  17           2HG      LYS  17   2.641  10.203   6.720
  139    HG3  LYS  17           3HG      LYS  17   3.566  10.206   5.199
  140    HD2  LYS  17           2HD      LYS  17   3.175  12.479   5.661
  141    HD3  LYS  17           3HD      LYS  17   1.962  12.056   4.429
  142    HE2  LYS  17           2HE      LYS  17   1.407  12.061   7.410
  143    HE3  LYS  17           3HE      LYS  17   1.118  13.459   6.354
  144    HZ1  LYS  17           3HZ      LYS  17  -0.145  10.815   6.078
  145    HZ2  LYS  17           1HZ      LYS  17  -0.872  12.165   6.679
  146    HZ3  LYS  17           2HZ      LYS  17  -0.414  12.114   5.097
  147    H    LEU  18           HN       LEU  18   3.852   9.962   2.294
  148    HA   LEU  18           HA       LEU  18   4.817   7.150   2.369
  149    HB2  LEU  18           2HB      LEU  18   5.687   9.559   0.742
  150    HB3  LEU  18           3HB      LEU  18   6.522   7.987   0.733
  151    HG   LEU  18           HG       LEU  18   3.645   8.413  -0.112
  152   HD11  LEU  18          1HD1      LEU  18   4.489   8.159  -2.410
  153   HD12  LEU  18          2HD1      LEU  18   5.198   9.581  -1.611
  154   HD13  LEU  18          3HD1      LEU  18   6.155   8.091  -1.789
  155   HD21  LEU  18          3HD2      LEU  18   4.157   6.150   0.694
  156   HD22  LEU  18          1HD2      LEU  18   3.877   6.154  -1.063
  157   HD23  LEU  18          2HD2      LEU  18   5.537   6.059  -0.427
  158    H    HIS  19           HN       HIS  19   5.799   6.868   4.339
  159    HA   HIS  19           HA       HIS  19   7.478   8.959   5.470
  160    HB2  HIS  19           2HB      HIS  19   7.009   6.063   6.235
  161    HB3  HIS  19           3HB      HIS  19   8.091   7.152   7.122
  162    HD1  HIS  19           1HD      HIS  19   7.036   8.208   9.078
  163    HD2  HIS  19           2HD      HIS  19   4.237   7.346   6.097
  164    HE1  HIS  19           1HE      HIS  19   4.783   8.896  10.003
  165    HE2  HIS  19           2HE      HIS  19   3.087   8.371   8.193
  166    H    GLY  20           HN       GLY  20   9.758   8.171   6.262
  167    HA2  GLY  20           1HA      GLY  20  11.814   7.164   5.645
  168    HA3  GLY  20           2HA      GLY  20  11.123   6.744   4.061
  169    H    THR  21           HN       THR  21  13.537   7.797   3.855
  170    HA   THR  21           HA       THR  21  12.922  10.563   2.974
  171    HB   THR  21           HB       THR  21  15.548   9.747   4.273
  172    HG1  THR  21           1HG      THR  21  14.771  11.041   6.031
  173   HG21  THR  21          3HG2      THR  21  14.401  12.449   3.485
  174   HG22  THR  21          1HG2      THR  21  15.964  12.178   4.288
  175   HG23  THR  21          2HG2      THR  21  15.700  11.578   2.636
  176    H    GLY  22           HN       GLY  22  13.156  10.680   0.857
  177    HA2  GLY  22           1HA      GLY  22  14.137  10.553  -1.201
  178    HA3  GLY  22           2HA      GLY  22  15.657  10.145  -0.372
  179    H    ALA  23           HN       ALA  23  16.221   7.970  -0.037
  180    HA   ALA  23           HA       ALA  23  15.838   6.356  -2.269
  181    HB1  ALA  23           1HB      ALA  23  16.892   4.567  -0.946
  182    HB2  ALA  23           2HB      ALA  23  17.703   6.130  -0.690
  183    HB3  ALA  23           3HB      ALA  23  16.588   5.492   0.543
  184    H    LEU  24           HN       LEU  24  14.273   5.978   0.944
  185    HA   LEU  24           HA       LEU  24  12.723   3.715   0.290
  186    HB2  LEU  24           2HB      LEU  24  12.435   5.955   2.269
  187    HB3  LEU  24           3HB      LEU  24  11.114   4.782   2.059
  188    HG   LEU  24           HG       LEU  24  12.501   4.185   3.951
  189   HD11  LEU  24          1HD1      LEU  24  13.034   1.867   3.324
  190   HD12  LEU  24          2HD1      LEU  24  11.479   2.388   2.637
  191   HD13  LEU  24          3HD1      LEU  24  12.928   2.310   1.605
  192   HD21  LEU  24          3HD2      LEU  24  14.600   5.230   3.244
  193   HD22  LEU  24          1HD2      LEU  24  14.855   3.526   3.683
  194   HD23  LEU  24          2HD2      LEU  24  14.791   4.001   1.971
  195    H    LYS  25           HN       LYS  25  11.851   7.181   0.155
  196    HA   LYS  25           HA       LYS  25   9.243   6.842  -0.882
  197    HB2  LYS  25           2HB      LYS  25  11.264   9.086  -1.177
  198    HB3  LYS  25           3HB      LYS  25   9.565   9.201  -1.694
  199    HG2  LYS  25           2HG      LYS  25   8.823   8.852   0.601
  200    HG3  LYS  25           3HG      LYS  25  10.511   8.671   1.135
  201    HD2  LYS  25           2HD      LYS  25  10.992  10.969   0.432
  202    HD3  LYS  25           3HD      LYS  25   9.316  11.154  -0.138
  203    HE2  LYS  25           2HE      LYS  25   8.485  10.805   2.133
  204    HE3  LYS  25           3HE      LYS  25  10.144  10.557   2.719
  205    HZ1  LYS  25           3HZ      LYS  25   9.097  13.041   1.537
  206    HZ2  LYS  25           1HZ      LYS  25   9.375  12.784   3.141
  207    HZ3  LYS  25           2HZ      LYS  25  10.637  12.811   2.082
  208    H    ARG  26           HN       ARG  26  12.321   7.528  -2.566
  209    HA   ARG  26           HA       ARG  26  11.284   7.655  -5.183
  210    HB2  ARG  26           2HB      ARG  26  13.547   8.387  -4.342
  211    HB3  ARG  26           3HB      ARG  26  14.030   6.674  -4.343
  212    HG2  ARG  26           2HG      ARG  26  12.993   7.975  -6.846
  213    HG3  ARG  26           3HG      ARG  26  14.686   8.189  -6.339
  214    HD2  ARG  26           2HD      ARG  26  14.988   5.752  -6.323
  215    HD3  ARG  26           3HD      ARG  26  13.298   5.536  -6.826
  216    HE   ARG  26           HE       ARG  26  14.914   7.218  -8.584
  217   HH11  ARG  26          2HH1      ARG  26  13.792   3.965  -7.852
  218   HH12  ARG  26          1HH1      ARG  26  14.026   3.385  -9.486
  219   HH21  ARG  26          2HH2      ARG  26  15.204   6.466 -10.698
  220   HH22  ARG  26          1HH2      ARG  26  14.826   4.805 -11.100
  221    H    ARG  27           HN       ARG  27  12.443   4.883  -3.272
  222    HA   ARG  27           HA       ARG  27  12.474   2.965  -5.358
  223    HB2  ARG  27           2HB      ARG  27  13.414   2.763  -3.008
  224    HB3  ARG  27           3HB      ARG  27  11.750   2.462  -2.455
  225    HG2  ARG  27           2HG      ARG  27  12.791   0.345  -2.686
  226    HG3  ARG  27           3HG      ARG  27  11.681   0.523  -4.067
  227    HD2  ARG  27           2HD      ARG  27  13.564   1.207  -5.491
  228    HD3  ARG  27           3HD      ARG  27  14.672   1.032  -4.113
  229    HE   ARG  27           HE       ARG  27  13.120  -1.256  -5.233
  230   HH11  ARG  27          2HH1      ARG  27  16.078   0.163  -3.946
  231   HH12  ARG  27          1HH1      ARG  27  17.010  -1.307  -4.115
  232   HH21  ARG  27          2HH2      ARG  27  14.360  -3.163  -5.482
  233   HH22  ARG  27          1HH2      ARG  27  16.038  -3.189  -4.985
  234    H    ILE  28           HN       ILE  28   9.937   3.766  -2.961
  235    HA   ILE  28           HA       ILE  28   8.028   1.928  -4.042
  236    HB   ILE  28           HB       ILE  28   7.584   4.390  -2.306
  237   HG12  ILE  28          2HG1      ILE  28   8.052   1.496  -1.521
  238   HG13  ILE  28          3HG1      ILE  28   9.254   2.802  -1.397
  239   HG21  ILE  28          1HG2      ILE  28   5.547   3.225  -1.567
  240   HG22  ILE  28          2HG2      ILE  28   5.520   3.530  -3.319
  241   HG23  ILE  28          3HG2      ILE  28   5.891   1.902  -2.705
  242   HD11  ILE  28          3HD1      ILE  28   6.615   2.667   0.082
  243   HD12  ILE  28          1HD1      ILE  28   8.213   2.339   0.783
  244   HD13  ILE  28          2HD1      ILE  28   7.820   3.971   0.207
  245    H    MET  29           HN       MET  29   8.578   5.441  -4.498
  246    HA   MET  29           HA       MET  29   6.147   5.876  -5.934
  247    HB2  MET  29           2HB      MET  29   8.732   7.450  -5.862
  248    HB3  MET  29           3HB      MET  29   7.254   7.995  -6.689
  249    HG2  MET  29           2HG      MET  29   6.059   7.825  -4.495
  250    HG3  MET  29           3HG      MET  29   7.620   7.488  -3.729
  251    HE1  MET  29           3HE      MET  29   9.534   9.398  -5.525
  252    HE2  MET  29           1HE      MET  29   9.586  10.849  -4.499
  253    HE3  MET  29           2HE      MET  29   9.678   9.235  -3.758
  254    H    ASP  30           HN       ASP  30   9.389   4.888  -6.950
  255    HA   ASP  30           HA       ASP  30   9.087   5.473  -9.721
  256    HB2  ASP  30           2HB      ASP  30  11.259   5.006  -8.683
  257    HB3  ASP  30           3HB      ASP  30  10.758   3.333  -8.358
  258    HD2  ASP  30           2HD      ASP  30  12.039   2.464 -11.410
  259    H    MET  31           HN       MET  31   7.924   2.843  -7.720
  260    HA   MET  31           HA       MET  31   7.358   1.108  -9.992
  261    HB2  MET  31           2HB      MET  31   6.534   0.957  -7.076
  262    HB3  MET  31           3HB      MET  31   6.267  -0.317  -8.290
  263    HG2  MET  31           2HG      MET  31   8.690  -0.542  -8.592
  264    HG3  MET  31           3HG      MET  31   8.965   0.734  -7.395
  265    HE1  MET  31           3HE      MET  31   6.694   0.086  -5.248
  266    HE2  MET  31           1HE      MET  31   7.602  -0.928  -4.104
  267    HE3  MET  31           2HE      MET  31   8.370   0.507  -4.822
  268    H    GLY  32           HN       GLY  32   5.954   3.908  -8.843
  269    HA2  GLY  32           1HA      GLY  32   4.038   4.752 -10.054
  270    HA3  GLY  32           2HA      GLY  32   3.359   3.109 -10.060
  271    H    ILE  33           HN       ILE  33   4.716   3.497  -7.085
  272    HA   ILE  33           HA       ILE  33   2.046   4.046  -5.948
  273    HB   ILE  33           HB       ILE  33   4.535   3.064  -4.507
  274   HG12  ILE  33          2HG1      ILE  33   2.270   1.413  -5.666
  275   HG13  ILE  33          3HG1      ILE  33   3.904   1.543  -6.361
  276   HG21  ILE  33          1HG2      ILE  33   2.912   2.269  -2.834
  277   HG22  ILE  33          2HG2      ILE  33   2.781   4.025  -3.083
  278   HG23  ILE  33          3HG2      ILE  33   1.581   2.931  -3.811
  279   HD11  ILE  33          3HD1      ILE  33   3.216   0.425  -3.631
  280   HD12  ILE  33          1HD1      ILE  33   3.652  -0.533  -5.062
  281   HD13  ILE  33          2HD1      ILE  33   4.850   0.553  -4.327
  282    H    THR  34           HN       THR  34   1.766   6.215  -5.767
  283    HA   THR  34           HA       THR  34   3.613   7.551  -3.885
  284    HB   THR  34           HB       THR  34   4.309   8.296  -6.132
  285    HG1  THR  34           1HG      THR  34   4.026  10.550  -5.720
  286   HG21  THR  34          3HG2      THR  34   1.457   9.307  -6.399
  287   HG22  THR  34          1HG2      THR  34   2.781   9.623  -7.543
  288   HG23  THR  34          2HG2      THR  34   2.181   7.964  -7.317
  289    H    ARG  35           HN       ARG  35   2.586   9.614  -3.022
  290    HA   ARG  35           HA       ARG  35   0.073   8.899  -1.928
  291    HB2  ARG  35           2HB      ARG  35   0.025  11.106  -0.923
  292    HB3  ARG  35           3HB      ARG  35   1.637  10.369  -0.765
  293    HG2  ARG  35           2HG      ARG  35   0.984  12.375  -2.922
  294    HG3  ARG  35           3HG      ARG  35   1.529  12.858  -1.298
  295    HD2  ARG  35           2HD      ARG  35   3.535  11.347  -1.658
  296    HD3  ARG  35           3HD      ARG  35   3.022  11.209  -3.353
  297    HE   ARG  35           HE       ARG  35   3.287  13.945  -2.381
  298   HH11  ARG  35          2HH1      ARG  35   4.821  11.240  -4.051
  299   HH12  ARG  35          1HH1      ARG  35   6.093  12.228  -4.734
  300   HH21  ARG  35          2HH2      ARG  35   4.974  15.200  -3.222
  301   HH22  ARG  35          1HH2      ARG  35   6.178  14.473  -4.263
  302    H    GLY  36           HN       GLY  36  -1.929   9.101  -2.601
  303    HA2  GLY  36           1HA      GLY  36  -3.613  10.504  -3.730
  304    HA3  GLY  36           2HA      GLY  36  -2.394  10.838  -4.982
  305    H    CYS  37           HN       CYS  37  -1.378   8.089  -4.978
  306    HA   CYS  37           HA       CYS  37  -3.371   6.963  -6.804
  307    HB2  CYS  37           2HB      CYS  37  -0.660   5.925  -5.922
  308    HB3  CYS  37           3HB      CYS  37  -1.647   5.290  -7.261
  309    HG   CYS  37           HG       CYS  37   0.432   6.553  -8.209
  310    H    GLU  38           HN       GLU  38  -4.271   4.857  -6.616
  311    HA   GLU  38           HA       GLU  38  -4.524   4.007  -3.787
  312    HB2  GLU  38           2HB      GLU  38  -6.548   2.820  -4.487
  313    HB3  GLU  38           3HB      GLU  38  -6.630   4.555  -4.879
  314    HG2  GLU  38           2HG      GLU  38  -5.824   2.472  -6.908
  315    HG3  GLU  38           3HG      GLU  38  -7.520   2.913  -6.613
  316    HE2  GLU  38           2HE      GLU  38  -7.121   5.997  -8.174
  317    H    ILE  39           HN       ILE  39  -4.722   1.697  -3.365
  318    HA   ILE  39           HA       ILE  39  -3.153   0.019  -5.240
  319    HB   ILE  39           HB       ILE  39  -2.711   0.237  -2.229
  320   HG12  ILE  39          2HG1      ILE  39  -0.847   0.897  -4.530
  321   HG13  ILE  39          3HG1      ILE  39  -1.713   2.087  -3.530
  322   HG21  ILE  39          1HG2      ILE  39  -0.932  -1.428  -2.567
  323   HG22  ILE  39          2HG2      ILE  39  -2.523  -2.070  -3.040
  324   HG23  ILE  39          3HG2      ILE  39  -1.369  -1.543  -4.288
  325   HD11  ILE  39          3HD1      ILE  39   0.362   0.110  -2.544
  326   HD12  ILE  39          1HD1      ILE  39   0.626   1.847  -2.802
  327   HD13  ILE  39          2HD1      ILE  39  -0.505   1.302  -1.545
  328    H    TYR  40           HN       TYR  40  -4.241  -1.814  -5.659
  329    HA   TYR  40           HA       TYR  40  -6.291  -2.739  -3.761
  330    HB2  TYR  40           2HB      TYR  40  -6.844  -2.850  -6.119
  331    HB3  TYR  40           3HB      TYR  40  -5.378  -3.786  -6.459
  332    HD1  TYR  40           1HD      TYR  40  -8.633  -3.919  -4.632
  333    HD2  TYR  40           2HD      TYR  40  -5.397  -6.146  -6.282
  334    HE1  TYR  40           1HE      TYR  40  -9.864  -6.008  -4.230
  335    HE2  TYR  40           2HE      TYR  40  -6.628  -8.232  -5.889
  336    HH   TYR  40           HH       TYR  40  -8.523  -9.198  -5.096
  337    H    ILE  41           HN       ILE  41  -5.740  -4.001  -2.107
  338    HA   ILE  41           HA       ILE  41  -3.075  -5.180  -2.077
  339    HB   ILE  41           HB       ILE  41  -5.308  -5.305  -0.014
  340   HG12  ILE  41          2HG1      ILE  41  -2.861  -3.518  -0.212
  341   HG13  ILE  41          3HG1      ILE  41  -4.543  -3.017  -0.510
  342   HG21  ILE  41          1HG2      ILE  41  -3.516  -5.959   1.541
  343   HG22  ILE  41          2HG2      ILE  41  -3.681  -7.132   0.213
  344   HG23  ILE  41          3HG2      ILE  41  -2.347  -5.952   0.199
  345   HD11  ILE  41          3HD1      ILE  41  -3.423  -4.018   2.118
  346   HD12  ILE  41          1HD1      ILE  41  -3.789  -2.325   1.725
  347   HD13  ILE  41          2HD1      ILE  41  -5.104  -3.515   1.820
  348    H    ARG  42           HN       ARG  42  -2.551  -7.153  -2.675
  349    HA   ARG  42           HA       ARG  42  -4.693  -9.051  -3.354
  350    HB2  ARG  42           2HB      ARG  42  -1.733  -8.863  -3.890
  351    HB3  ARG  42           3HB      ARG  42  -2.610 -10.391  -4.140
  352    HG2  ARG  42           2HG      ARG  42  -3.360  -7.769  -5.448
  353    HG3  ARG  42           3HG      ARG  42  -2.317  -9.003  -6.196
  354    HD2  ARG  42           2HD      ARG  42  -4.266 -10.637  -5.694
  355    HD3  ARG  42           3HD      ARG  42  -5.245  -9.169  -5.483
  356    HE   ARG  42           HE       ARG  42  -5.035  -8.691  -7.775
  357   HH11  ARG  42          2HH1      ARG  42  -3.384 -11.653  -6.830
  358   HH12  ARG  42          1HH1      ARG  42  -3.111 -12.178  -8.476
  359   HH21  ARG  42          2HH2      ARG  42  -4.621  -9.359  -9.924
  360   HH22  ARG  42          1HH2      ARG  42  -3.812 -10.880 -10.227
  361    H    LYS  43           HN       LYS  43  -1.609  -9.100  -1.488
  362    HA   LYS  43           HA       LYS  43  -2.828 -11.154   0.260
  363    HB2  LYS  43           2HB      LYS  43  -0.354 -11.468  -1.433
  364    HB3  LYS  43           3HB      LYS  43  -0.516 -12.344   0.107
  365    HG2  LYS  43           2HG      LYS  43  -2.490 -12.508  -2.182
  366    HG3  LYS  43           3HG      LYS  43  -1.177 -13.673  -1.888
  367    HD2  LYS  43           2HD      LYS  43  -2.138 -14.068   0.395
  368    HD3  LYS  43           3HD      LYS  43  -3.520 -13.046  -0.067
  369    HE2  LYS  43           2HE      LYS  43  -4.095 -14.569  -1.868
  370    HE3  LYS  43           3HE      LYS  43  -2.652 -15.553  -1.537
  371    HZ1  LYS  43           3HZ      LYS  43  -4.905 -15.140   0.312
  372    HZ2  LYS  43           1HZ      LYS  43  -4.621 -16.506  -0.565
  373    HZ3  LYS  43           2HZ      LYS  43  -3.567 -16.054   0.619
  374    H    VAL  44           HN       VAL  44  -2.712 -10.273   2.216
  375    HA   VAL  44           HA       VAL  44  -0.031  -9.291   3.071
  376    HB   VAL  44           HB       VAL  44  -2.762  -8.753   4.305
  377   HG11  VAL  44          1HG1      VAL  44  -1.564  -7.320   5.909
  378   HG12  VAL  44          2HG1      VAL  44  -1.040  -9.015   6.033
  379   HG13  VAL  44          3HG1      VAL  44  -0.013  -7.825   5.199
  380   HG21  VAL  44          3HG2      VAL  44  -2.314  -7.451   2.279
  381   HG22  VAL  44          1HG2      VAL  44  -2.305  -6.411   3.722
  382   HG23  VAL  44          2HG2      VAL  44  -0.769  -6.900   2.969
  383    H    ALA  45           HN       ALA  45   1.079 -10.638   4.369
  384    HA   ALA  45           HA       ALA  45  -0.081 -13.140   5.164
  385    HB1  ALA  45           1HB      ALA  45   2.075 -13.523   6.290
  386    HB2  ALA  45           2HB      ALA  45   2.306 -12.899   4.641
  387    HB3  ALA  45           3HB      ALA  45   2.508 -11.817   6.039
  388    HA   PRO  46           HA       PRO  46  -2.053 -12.135   8.968
  389    HB2  PRO  46           2HB      PRO  46  -0.899 -14.735   9.975
  390    HB3  PRO  46           3HB      PRO  46  -2.599 -14.169   9.882
  391    HG2  PRO  46           2HG      PRO  46  -1.642 -15.984   8.199
  392    HG3  PRO  46           3HG      PRO  46  -2.869 -14.779   7.688
  393    HD2  PRO  46           2HD      PRO  46   0.094 -14.920   7.148
  394    HD3  PRO  46           3HD      PRO  46  -1.230 -14.310   6.111
  395    H    LEU  47           HN       LEU  47   1.323 -13.184   8.913
  396    HA   LEU  47           HA       LEU  47   1.861 -12.036  11.557
  397    HB2  LEU  47           2HB      LEU  47   3.003 -14.081  10.652
  398    HB3  LEU  47           3HB      LEU  47   3.793 -13.039   9.445
  399    HG   LEU  47           HG       LEU  47   4.121 -12.495  12.387
  400   HD11  LEU  47          1HD1      LEU  47   6.137 -13.916  12.372
  401   HD12  LEU  47          2HD1      LEU  47   4.669 -14.870  12.055
  402   HD13  LEU  47          3HD1      LEU  47   5.754 -14.436  10.713
  403   HD21  LEU  47          3HD2      LEU  47   4.903 -10.810  10.775
  404   HD22  LEU  47          1HD2      LEU  47   6.271 -11.554  11.634
  405   HD23  LEU  47          2HD2      LEU  47   5.899 -12.044   9.965
  406    H    GLY  48           HN       GLY  48   2.532 -11.315   8.113
  407    HA2  GLY  48           1HA      GLY  48   2.244  -8.595   8.212
  408    HA3  GLY  48           2HA      GLY  48   3.913  -8.850   8.771
  409    H    ASP  49           HN       ASP  49   5.450  -9.794   7.362
  410    HA   ASP  49           HA       ASP  49   4.917  -9.131   4.558
  411    HB2  ASP  49           2HB      ASP  49   7.313  -9.626   4.238
  412    HB3  ASP  49           3HB      ASP  49   7.044  -8.465   5.557
  413    HD2  ASP  49           2HD      ASP  49   8.810 -11.879   6.372
  414    HA   PRO  50           HA       PRO  50   5.896  -9.552   2.776
  415    HB2  PRO  50           2HB      PRO  50   5.428 -10.484   0.269
  416    HB3  PRO  50           3HB      PRO  50   6.809 -11.077   1.246
  417    HG2  PRO  50           2HG      PRO  50   4.189 -12.375   0.728
  418    HG3  PRO  50           3HG      PRO  50   5.823 -13.111   0.780
  419    HD2  PRO  50           2HD      PRO  50   3.908 -13.097   2.854
  420    HD3  PRO  50           3HD      PRO  50   5.659 -13.415   3.051
  421    H    ILE  51           HN       ILE  51   4.759  -8.083   1.286
  422    HA   ILE  51           HA       ILE  51   1.809  -8.399   1.499
  423    HB   ILE  51           HB       ILE  51   3.430  -5.820   1.526
  424   HG12  ILE  51          2HG1      ILE  51   2.089  -5.582   3.746
  425   HG13  ILE  51          3HG1      ILE  51   1.910  -7.349   3.628
  426   HG21  ILE  51          1HG2      ILE  51   1.264  -4.674   1.780
  427   HG22  ILE  51          2HG2      ILE  51   1.347  -5.571   0.247
  428   HG23  ILE  51          3HG2      ILE  51   0.422  -6.233   1.616
  429   HD11  ILE  51          3HD1      ILE  51   4.525  -5.828   3.719
  430   HD12  ILE  51          1HD1      ILE  51   3.811  -6.739   5.064
  431   HD13  ILE  51          2HD1      ILE  51   4.346  -7.595   3.604
  432    H    GLN  52           HN       GLN  52   1.254  -9.192  -0.437
  433    HA   GLN  52           HA       GLN  52   2.461  -8.075  -2.872
  434    HB2  GLN  52           2HB      GLN  52   0.393 -10.247  -2.427
  435    HB3  GLN  52           3HB      GLN  52   0.992  -9.733  -4.023
  436    HG2  GLN  52           2HG      GLN  52   3.282 -10.370  -3.323
  437    HG3  GLN  52           3HG      GLN  52   2.618 -10.967  -1.787
  438   HE21  GLN  52          1HE2      GLN  52   4.064 -12.404  -3.932
  439   HE22  GLN  52          2HE2      GLN  52   2.995 -13.694  -4.440
  440    H    ILE  53           HN       ILE  53   1.582  -6.538  -4.073
  441    HA   ILE  53           HA       ILE  53  -1.264  -5.844  -3.616
  442    HB   ILE  53           HB       ILE  53  -0.582  -3.410  -3.679
  443   HG12  ILE  53          2HG1      ILE  53   2.176  -4.578  -3.184
  444   HG13  ILE  53          3HG1      ILE  53   1.644  -3.742  -4.662
  445   HG21  ILE  53          1HG2      ILE  53   0.065  -3.310  -1.306
  446   HG22  ILE  53          2HG2      ILE  53  -1.212  -4.518  -1.583
  447   HG23  ILE  53          3HG2      ILE  53   0.473  -5.041  -1.346
  448   HD11  ILE  53          3HD1      ILE  53   1.844  -2.519  -1.899
  449   HD12  ILE  53          1HD1      ILE  53   2.988  -2.257  -3.232
  450   HD13  ILE  53          2HD1      ILE  53   1.314  -1.682  -3.378
  451    H    ASN  54           HN       ASN  54  -2.275  -4.776  -5.378
  452    HA   ASN  54           HA       ASN  54  -0.670  -4.884  -7.886
  453    HB2  ASN  54           2HB      ASN  54  -2.699  -6.373  -7.747
  454    HB3  ASN  54           3HB      ASN  54  -3.694  -4.906  -7.629
  455   HD21  ASN  54          1HD2      ASN  54  -1.659  -6.889  -9.703
  456   HD22  ASN  54          2HD2      ASN  54  -2.093  -6.114 -11.212
  457    H    VAL  55           HN       VAL  55   0.069  -2.956  -8.421
  458    HA   VAL  55           HA       VAL  55  -1.639  -0.601  -7.799
  459    HB   VAL  55           HB       VAL  55   1.379  -0.661  -8.146
  460   HG11  VAL  55          1HG1      VAL  55   1.285   1.614  -7.215
  461   HG12  VAL  55          2HG1      VAL  55   0.336   1.483  -8.714
  462   HG13  VAL  55          3HG1      VAL  55  -0.488   1.507  -7.136
  463   HG21  VAL  55          3HG2      VAL  55   0.716  -1.897  -6.136
  464   HG22  VAL  55          1HG2      VAL  55   1.508  -0.363  -5.708
  465   HG23  VAL  55          2HG2      VAL  55  -0.262  -0.510  -5.598
  466    H    ARG  56           HN       ARG  56  -2.549   0.287  -9.492
  467    HA   ARG  56           HA       ARG  56  -2.860   1.185 -11.559
  468    HB2  ARG  56           2HB      ARG  56   0.092   0.661 -12.002
  469    HB3  ARG  56           3HB      ARG  56  -0.961   1.663 -13.030
  470    HG2  ARG  56           2HG      ARG  56  -1.365   3.091 -10.952
  471    HG3  ARG  56           3HG      ARG  56   0.001   2.214 -10.221
  472    HD2  ARG  56           2HD      ARG  56   0.711   4.338 -11.265
  473    HD3  ARG  56           3HD      ARG  56   1.467   2.928 -12.035
  474    HE   ARG  56           HE       ARG  56  -0.914   4.321 -13.178
  475   HH11  ARG  56          2HH1      ARG  56   2.274   2.861 -13.504
  476   HH12  ARG  56          1HH1      ARG  56   2.312   3.039 -15.244
  477   HH21  ARG  56          2HH2      ARG  56  -0.868   4.530 -15.432
  478   HH22  ARG  56          1HH2      ARG  56   0.527   3.986 -16.338
  479    H    GLY  57           HN       GLY  57  -1.926  -1.987 -11.034
  480    HA2  GLY  57           1HA      GLY  57  -3.169  -3.554 -12.587
  481    HA3  GLY  57           2HA      GLY  57  -2.335  -2.696 -13.903
  482    H    TYR  58           HN       TYR  58   0.044  -2.441 -11.973
  483    HA   TYR  58           HA       TYR  58   1.230  -5.030 -12.712
  484    HB2  TYR  58           2HB      TYR  58   2.377  -2.435 -11.656
  485    HB3  TYR  58           3HB      TYR  58   3.340  -3.915 -11.796
  486    HD1  TYR  58           2HD      TYR  58   3.343  -5.051 -14.152
  487    HD2  TYR  58           1HD      TYR  58   2.243  -0.986 -13.500
  488    HE1  TYR  58           2HE      TYR  58   3.792  -4.552 -16.511
  489    HE2  TYR  58           1HE      TYR  58   2.686  -0.488 -15.863
  490    HH   TYR  58           HH       TYR  58   3.797  -2.987 -18.151
  491    H    GLU  59           HN       GLU  59   1.759  -6.605 -11.348
  492    HA   GLU  59           HA       GLU  59   0.803  -6.320  -8.577
  493    HB2  GLU  59           2HB      GLU  59   0.200  -8.244 -10.089
  494    HB3  GLU  59           3HB      GLU  59   1.901  -8.759  -9.992
  495    HG2  GLU  59           2HG      GLU  59   1.702  -9.109  -7.609
  496    HG3  GLU  59           3HG      GLU  59   0.044  -8.471  -7.620
  497    HE2  GLU  59           2HE      GLU  59   0.559 -12.243  -8.433
  498    H    LEU  60           HN       LEU  60   2.074  -5.995  -6.919
  499    HA   LEU  60           HA       LEU  60   5.010  -6.372  -7.294
  500    HB2  LEU  60           2HB      LEU  60   3.607  -4.163  -5.756
  501    HB3  LEU  60           3HB      LEU  60   5.363  -4.365  -5.960
  502    HG   LEU  60           HG       LEU  60   3.398  -3.783  -8.190
  503   HD11  LEU  60          1HD1      LEU  60   4.385  -1.531  -8.190
  504   HD12  LEU  60          2HD1      LEU  60   3.610  -1.901  -6.633
  505   HD13  LEU  60          3HD1      LEU  60   5.382  -1.969  -6.784
  506   HD21  LEU  60          3HD2      LEU  60   5.378  -5.028  -8.928
  507   HD22  LEU  60          1HD2      LEU  60   5.416  -3.357  -9.532
  508   HD23  LEU  60          2HD2      LEU  60   6.433  -3.823  -8.151
  509    H    SER  61           HN       SER  61   6.222  -6.767  -5.343
  510    HA   SER  61           HA       SER  61   4.548  -7.711  -3.066
  511    HB2  SER  61           2HB      SER  61   5.434  -9.614  -4.439
  512    HB3  SER  61           3HB      SER  61   7.083  -9.041  -4.091
  513    HG   SER  61           HG       SER  61   6.389 -10.686  -2.642
  514    H    LEU  62           HN       LEU  62   4.925  -6.321  -1.447
  515    HA   LEU  62           HA       LEU  62   7.691  -5.266  -1.164
  516    HB2  LEU  62           2HB      LEU  62   5.010  -4.220  -0.244
  517    HB3  LEU  62           3HB      LEU  62   6.552  -3.595   0.387
  518    HG   LEU  62           HG       LEU  62   5.581  -3.492  -2.482
  519   HD11  LEU  62          1HD1      LEU  62   5.595  -1.053  -2.128
  520   HD12  LEU  62          2HD1      LEU  62   4.501  -1.870  -0.987
  521   HD13  LEU  62          3HD1      LEU  62   6.097  -1.303  -0.440
  522   HD21  LEU  62          3HD2      LEU  62   8.006  -3.871  -2.376
  523   HD22  LEU  62          1HD2      LEU  62   7.642  -2.223  -2.938
  524   HD23  LEU  62          2HD2      LEU  62   8.178  -2.492  -1.263
  525    H    ARG  63           HN       ARG  63   8.530  -4.995   1.019
  526    HA   ARG  63           HA       ARG  63   7.877  -7.367   2.627
  527    HB2  ARG  63           2HB      ARG  63  10.224  -6.001   1.993
  528    HB3  ARG  63           3HB      ARG  63   9.917  -5.586   3.696
  529    HG2  ARG  63           2HG      ARG  63  11.361  -7.581   3.407
  530    HG3  ARG  63           3HG      ARG  63   9.864  -7.913   4.312
  531    HD2  ARG  63           2HD      ARG  63  10.489  -9.653   2.593
  532    HD3  ARG  63           3HD      ARG  63   8.855  -8.976   2.426
  533    HE   ARG  63           HE       ARG  63   9.833  -7.507   0.629
  534   HH11  ARG  63          2HH1      ARG  63  11.350 -10.563   1.496
  535   HH12  ARG  63          1HH1      ARG  63  12.065 -10.802  -0.082
  536   HH21  ARG  63          2HH2      ARG  63  10.751  -7.836  -1.435
  537   HH22  ARG  63          1HH2      ARG  63  11.725  -9.255  -1.745
  538    H    LYS  64           HN       LYS  64   7.995  -7.026   5.076
  539    HA   LYS  64           HA       LYS  64   5.680  -5.576   5.798
  540    HB2  LYS  64           2HB      LYS  64   6.806  -7.571   6.949
  541    HB3  LYS  64           3HB      LYS  64   7.884  -6.376   7.709
  542    HG2  LYS  64           2HG      LYS  64   4.894  -6.122   7.921
  543    HG3  LYS  64           3HG      LYS  64   5.803  -7.208   9.000
  544    HD2  LYS  64           2HD      LYS  64   6.378  -4.250   8.654
  545    HD3  LYS  64           3HD      LYS  64   5.379  -4.939   9.956
  546    HE2  LYS  64           2HE      LYS  64   7.331  -6.316  10.660
  547    HE3  LYS  64           3HE      LYS  64   8.313  -5.501   9.424
  548    HZ1  LYS  64           3HZ      LYS  64   6.971  -4.184  11.689
  549    HZ2  LYS  64           1HZ      LYS  64   8.586  -4.498  11.580
  550    HZ3  LYS  64           2HZ      LYS  64   7.883  -3.428  10.542
  551    H    SER  65           HN       SER  65   9.135  -4.767   6.075
  552    HA   SER  65           HA       SER  65   8.896  -2.505   7.726
  553    HB2  SER  65           2HB      SER  65  10.889  -2.879   5.466
  554    HB3  SER  65           3HB      SER  65  11.103  -1.933   6.958
  555    HG   SER  65           HG       SER  65  12.093  -4.006   7.070
  556    H    ALA  66           HN       ALA  66   8.751  -2.722   4.135
  557    HA   ALA  66           HA       ALA  66   8.490   0.135   3.839
  558    HB1  ALA  66           1HB      ALA  66   7.998  -0.370   1.478
  559    HB2  ALA  66           2HB      ALA  66   9.419  -1.272   2.053
  560    HB3  ALA  66           3HB      ALA  66   7.851  -2.096   1.880
  561    H    ALA  67           HN       ALA  67   6.198  -2.604   3.798
  562    HA   ALA  67           HA       ALA  67   3.913  -1.055   3.110
  563    HB1  ALA  67           1HB      ALA  67   2.625  -2.979   3.948
  564    HB2  ALA  67           2HB      ALA  67   3.996  -3.506   2.945
  565    HB3  ALA  67           3HB      ALA  67   4.093  -3.624   4.718
  566    H    GLU  68           HN       GLU  68   5.540  -1.669   6.161
  567    HA   GLU  68           HA       GLU  68   3.241  -0.764   7.723
  568    HB2  GLU  68           2HB      GLU  68   4.851  -2.630   8.352
  569    HB3  GLU  68           3HB      GLU  68   6.043  -1.353   8.693
  570    HG2  GLU  68           2HG      GLU  68   4.472  -0.371  10.325
  571    HG3  GLU  68           3HG      GLU  68   3.354  -1.719  10.024
  572    HE2  GLU  68           2HE      GLU  68   6.681  -2.484  12.063
  573    H    MET  69           HN       MET  69   5.902   0.708   6.138
  574    HA   MET  69           HA       MET  69   5.887   2.981   8.038
  575    HB2  MET  69           2HB      MET  69   7.830   3.798   6.913
  576    HB3  MET  69           3HB      MET  69   8.064   2.060   7.221
  577    HG2  MET  69           2HG      MET  69   7.379   1.626   4.855
  578    HG3  MET  69           3HG      MET  69   7.355   3.377   4.588
  579    HE1  MET  69           3HE      MET  69   9.834   4.212   6.520
  580    HE2  MET  69           1HE      MET  69  11.147   4.291   5.323
  581    HE3  MET  69           2HE      MET  69   9.539   4.931   4.919
  582    H    ILE  70           HN       ILE  70   4.097   1.954   5.479
  583    HA   ILE  70           HA       ILE  70   3.796   4.702   4.401
  584    HB   ILE  70           HB       ILE  70   2.890   2.045   3.229
  585   HG12  ILE  70          2HG1      ILE  70   5.264   2.280   3.034
  586   HG13  ILE  70          3HG1      ILE  70   4.541   2.625   1.445
  587   HG21  ILE  70          1HG2      ILE  70   2.243   3.351   1.246
  588   HG22  ILE  70          2HG2      ILE  70   1.326   3.857   2.683
  589   HG23  ILE  70          3HG2      ILE  70   2.678   4.853   2.094
  590   HD11  ILE  70          3HD1      ILE  70   5.518   4.684   3.441
  591   HD12  ILE  70          1HD1      ILE  70   6.363   4.199   1.956
  592   HD13  ILE  70          2HD1      ILE  70   4.796   5.028   1.850
  593    H    GLU  71           HN       GLU  71   2.088   5.857   4.901
  594    HA   GLU  71           HA       GLU  71  -0.146   4.512   6.293
  595    HB2  GLU  71           2HB      GLU  71   0.666   6.303   7.562
  596    HB3  GLU  71           3HB      GLU  71   0.825   7.360   6.138
  597    HG2  GLU  71           2HG      GLU  71  -1.850   6.907   6.136
  598    HG3  GLU  71           3HG      GLU  71  -1.501   6.827   7.877
  599    HE2  GLU  71           2HE      GLU  71  -0.849  10.213   8.049
  600    H    VAL  72           HN       VAL  72  -2.015   4.157   5.356
  601    HA   VAL  72           HA       VAL  72  -2.539   5.532   2.780
  602    HB   VAL  72           HB       VAL  72  -3.555   3.405   1.948
  603   HG11  VAL  72          1HG1      VAL  72  -1.429   2.297   1.402
  604   HG12  VAL  72          2HG1      VAL  72  -1.295   4.066   1.275
  605   HG13  VAL  72          3HG1      VAL  72  -0.620   3.220   2.689
  606   HG21  VAL  72          3HG2      VAL  72  -3.970   2.334   4.112
  607   HG22  VAL  72          1HG2      VAL  72  -2.993   1.285   3.060
  608   HG23  VAL  72          2HG2      VAL  72  -2.217   2.187   4.383
  609    H    GLU  73           HN       GLU  73  -4.753   5.502   2.100
  610    HA   GLU  73           HA       GLU  73  -6.622   5.675   4.403
  611    HB2  GLU  73           2HB      GLU  73  -6.385   7.723   3.134
  612    HB3  GLU  73           3HB      GLU  73  -6.665   6.852   1.607
  613    HG2  GLU  73           2HG      GLU  73  -8.962   6.256   2.585
  614    HG3  GLU  73           3HG      GLU  73  -8.634   7.522   3.789
  615    HE2  GLU  73           2HE      GLU  73  -8.772  10.010   1.256
  616    H    LEU  74           HN       LEU  74  -8.117   4.137   4.606
  617    HA   LEU  74           HA       LEU  74  -8.581   2.372   2.272
  618    HB2  LEU  74           2HB      LEU  74  -7.929   1.326   4.395
  619    HB3  LEU  74           3HB      LEU  74  -9.354   2.047   5.184
  620    HG   LEU  74           HG       LEU  74 -10.845   0.646   4.000
  621   HD11  LEU  74          1HD1      LEU  74 -10.137  -0.911   2.224
  622   HD12  LEU  74          2HD1      LEU  74  -9.793   0.776   1.782
  623   HD13  LEU  74          3HD1      LEU  74  -8.476  -0.283   2.340
  624   HD21  LEU  74          3HD2      LEU  74  -9.656  -0.427   5.864
  625   HD22  LEU  74          1HD2      LEU  74 -10.054  -1.609   4.594
  626   HD23  LEU  74          2HD2      LEU  74  -8.394  -0.986   4.740
  627    H    GLU  75           HN       GLU  75 -10.551   2.101   1.346
  628    HA   GLU  75           HA       GLU  75 -12.362   4.208   1.213
  629    HB2  GLU  75           2HB      GLU  75 -12.137   2.292  -0.368
  630    HB3  GLU  75           3HB      GLU  75 -12.961   1.256   0.823
  631    HG2  GLU  75           2HG      GLU  75 -14.251   3.746  -0.278
  632    HG3  GLU  75           3HG      GLU  75 -14.326   2.192  -1.136
  633    HE2  GLU  75           2HE      GLU  75 -16.893   2.781   1.659
  634    H    HIS  76           HN       HIS  76 -13.674   5.083   2.651
  635    HA   HIS  76           HA       HIS  76 -14.813   3.330   4.762
  636    HB2  HIS  76           2HB      HIS  76 -14.397   5.110   6.427
  637    HB3  HIS  76           3HB      HIS  76 -12.900   4.437   5.755
  638    HD1  HIS  76           1HD      HIS  76 -14.665   7.594   6.348
  639    HD2  HIS  76           2HD      HIS  76 -11.629   6.246   3.807
  640    HE1  HIS  76           1HE      HIS  76 -13.489   9.668   5.483
  641    HE2  HIS  76           2HE      HIS  76 -11.650   8.841   3.946
  642    H    HIS  77           HN       HIS  77 -16.918   3.378   4.634
  643    HA   HIS  77           HA       HIS  77 -18.282   5.989   4.491
  644    HB2  HIS  77           2HB      HIS  77 -18.705   3.723   2.538
  645    HB3  HIS  77           3HB      HIS  77 -20.001   4.871   2.922
  646    HD1  HIS  77           1HD      HIS  77 -16.785   4.533   1.054
  647    HD2  HIS  77           2HD      HIS  77 -19.575   7.510   1.951
  648    HE1  HIS  77           1HE      HIS  77 -16.257   6.480  -0.478
  649    HE2  HIS  77           2HE      HIS  77 -17.954   8.283   0.070
  650    H    HIS  78           HN       HIS  78 -20.647   5.708   5.028
  651    HA   HIS  78           HA       HIS  78 -22.267   5.005   6.466
  652    HB2  HIS  78           2HB      HIS  78 -20.774   2.371   6.371
  653    HB3  HIS  78           3HB      HIS  78 -22.262   2.623   7.302
  654    HD1  HIS  78           1HD      HIS  78 -21.111   1.500   4.084
  655    HD2  HIS  78           2HD      HIS  78 -24.469   3.548   5.492
  656    HE1  HIS  78           1HE      HIS  78 -22.897   1.236   2.307
  657    HE2  HIS  78           2HE      HIS  78 -24.939   2.477   3.166
  658    H    HIS  79           HN       HIS  79 -19.039   5.284   7.202
  659    HA   HIS  79           HA       HIS  79 -19.327   4.797  10.092
  660    HB2  HIS  79           2HB      HIS  79 -17.265   4.180   8.756
  661    HB3  HIS  79           3HB      HIS  79 -16.963   5.915   8.549
  662    HD1  HIS  79           1HD      HIS  79 -15.869   7.166  10.464
  663    HD2  HIS  79           2HD      HIS  79 -16.933   3.246  11.444
  664    HE1  HIS  79           1HE      HIS  79 -14.752   6.663  12.681
  665    HE2  HIS  79           2HE      HIS  79 -15.400   4.279  13.275
  666    H    HIS  80           HN       HIS  80 -21.142   6.482   9.927
  667    HA   HIS  80           HA       HIS  80 -20.419   9.239   9.576
  668    HB2  HIS  80           2HB      HIS  80 -22.619   9.712  10.614
  669    HB3  HIS  80           3HB      HIS  80 -22.710   8.554   9.275
  670    HD1  HIS  80           1HD      HIS  80 -23.484   8.981  12.856
  671    HD2  HIS  80           2HD      HIS  80 -23.214   5.835  10.126
  672    HE1  HIS  80           1HE      HIS  80 -24.644   7.009  13.937
  673    HE2  HIS  80           2HE      HIS  80 -24.473   5.093  12.278
  674    H    HIS  81           HN       HIS  81 -20.419   7.006  12.273
  675    HA   HIS  81           HA       HIS  81 -19.277   9.177  13.968
  676    HB2  HIS  81           2HB      HIS  81 -21.372   8.341  14.897
  677    HB3  HIS  81           3HB      HIS  81 -20.793   6.670  14.773
  678    HD1  HIS  81           1HD      HIS  81 -19.670   5.738  16.786
  679    HD2  HIS  81           2HD      HIS  81 -19.743   9.915  16.809
  680    HE1  HIS  81           1HE      HIS  81 -18.726   6.448  19.029
  681    HE2  HIS  81           2HE      HIS  81 -18.773   8.988  19.034
  Start of MODEL   18
    1    H1   MET   1           HN       MET   1  -2.091   6.388  13.492
    2    HA   MET   1           HA       MET   1  -0.919   7.263  11.055
    3    HB2  MET   1           2HB      MET   1   1.225   7.060  12.237
    4    HB3  MET   1           3HB      MET   1   0.844   5.371  12.649
    5    HG2  MET   1           2HG      MET   1   0.828   4.799  10.260
    6    HG3  MET   1           3HG      MET   1   1.218   6.478   9.853
    7    HE1  MET   1           3HE      MET   1   3.256   5.619   8.405
    8    HE2  MET   1           1HE      MET   1   4.529   4.540   9.021
    9    HE3  MET   1           2HE      MET   1   2.864   3.939   8.841
   10    H    PHE   2           HN       PHE   2  -1.592   5.971   9.419
   11    HA   PHE   2           HA       PHE   2  -2.322   3.169  10.104
   12    HB2  PHE   2           2HB      PHE   2  -4.341   4.690   9.884
   13    HB3  PHE   2           3HB      PHE   2  -3.885   4.924   8.189
   14    HD1  PHE   2           2HD      PHE   2  -4.093   3.090   6.581
   15    HD2  PHE   2           1HD      PHE   2  -5.229   2.568  10.655
   16    HE1  PHE   2           2HE      PHE   2  -5.289   1.031   5.983
   17    HE2  PHE   2           1HE      PHE   2  -6.426   0.507  10.058
   18    HZ   PHE   2           HZ       PHE   2  -6.458  -0.267   7.720
   19    H    SER   3           HN       SER   3  -0.647   2.144   9.173
   20    HA   SER   3           HA       SER   3   0.392   3.170   6.623
   21    HB2  SER   3           2HB      SER   3   2.205   1.537   6.984
   22    HB3  SER   3           3HB      SER   3   1.988   2.611   8.387
   23    HG   SER   3           HG       SER   3   2.231   0.403   8.987
   24    H    LEU   4           HN       LEU   4   1.126   1.406   5.033
   25    HA   LEU   4           HA       LEU   4  -1.198   0.119   4.005
   26    HB2  LEU   4           2HB      LEU   4   0.827   0.902   2.723
   27    HB3  LEU   4           3HB      LEU   4   1.699  -0.509   3.370
   28    HG   LEU   4           HG       LEU   4   0.069  -1.993   2.254
   29   HD11  LEU   4          1HD1      LEU   4  -1.468  -1.057   0.576
   30   HD12  LEU   4          2HD1      LEU   4  -1.839  -0.451   2.207
   31   HD13  LEU   4          3HD1      LEU   4  -0.977   0.588   1.046
   32   HD21  LEU   4          3HD2      LEU   4   2.186  -1.402   1.161
   33   HD22  LEU   4          1HD2      LEU   4   0.888  -1.615  -0.037
   34   HD23  LEU   4          2HD2      LEU   4   1.414   0.021   0.422
   35    H    ARG   5           HN       ARG   5   1.235  -0.820   6.308
   36    HA   ARG   5           HA       ARG   5   0.607  -3.669   6.134
   37    HB2  ARG   5           2HB      ARG   5   2.761  -2.179   7.008
   38    HB3  ARG   5           3HB      ARG   5   1.997  -2.697   8.530
   39    HG2  ARG   5           2HG      ARG   5   2.765  -4.560   6.275
   40    HG3  ARG   5           3HG      ARG   5   3.771  -4.233   7.706
   41    HD2  ARG   5           2HD      ARG   5   2.110  -5.150   9.172
   42    HD3  ARG   5           3HD      ARG   5   0.933  -5.277   7.847
   43    HE   ARG   5           HE       ARG   5   3.311  -6.792   7.287
   44   HH11  ARG   5          2HH1      ARG   5   0.337  -6.764   9.160
   45   HH12  ARG   5          1HH1      ARG   5   0.213  -8.507   9.236
   46   HH21  ARG   5          2HH2      ARG   5   3.141  -9.074   7.377
   47   HH22  ARG   5          1HH2      ARG   5   1.803  -9.817   8.224
   48    H    ASP   6           HN       ASP   6  -0.868  -0.940   7.490
   49    HA   ASP   6           HA       ASP   6  -2.007  -2.430   9.762
   50    HB2  ASP   6           2HB      ASP   6  -2.320   0.422   8.790
   51    HB3  ASP   6           3HB      ASP   6  -3.312  -0.265  10.094
   52    HD2  ASP   6           2HD      ASP   6  -0.420  -0.471  12.185
   53    H    ALA   7           HN       ALA   7  -2.597  -1.959   6.460
   54    HA   ALA   7           HA       ALA   7  -5.496  -2.188   6.591
   55    HB1  ALA   7           1HB      ALA   7  -5.335  -2.462   4.150
   56    HB2  ALA   7           2HB      ALA   7  -4.383  -1.067   4.708
   57    HB3  ALA   7           3HB      ALA   7  -3.566  -2.589   4.281
   58    H    LYS   8           HN       LYS   8  -6.519  -4.064   5.253
   59    HA   LYS   8           HA       LYS   8  -5.165  -6.600   6.048
   60    HB2  LYS   8           2HB      LYS   8  -8.120  -5.926   6.214
   61    HB3  LYS   8           3HB      LYS   8  -7.436  -7.553   6.439
   62    HG2  LYS   8           2HG      LYS   8  -7.733  -6.808   8.614
   63    HG3  LYS   8           3HG      LYS   8  -6.018  -6.446   8.304
   64    HD2  LYS   8           2HD      LYS   8  -6.655  -4.109   7.736
   65    HD3  LYS   8           3HD      LYS   8  -8.337  -4.494   8.170
   66    HE2  LYS   8           2HE      LYS   8  -7.327  -3.404  10.052
   67    HE3  LYS   8           3HE      LYS   8  -7.524  -5.123  10.459
   68    HZ1  LYS   8           3HZ      LYS   8  -5.029  -3.855   9.550
   69    HZ2  LYS   8           1HZ      LYS   8  -5.370  -4.299  11.101
   70    HZ3  LYS   8           2HZ      LYS   8  -5.211  -5.449   9.930
   71    H    CYS   9           HN       CYS   9  -5.710  -8.471   4.735
   72    HA   CYS   9           HA       CYS   9  -5.705  -7.857   1.952
   73    HB2  CYS   9           2HB      CYS   9  -5.938 -10.292   1.630
   74    HB3  CYS   9           3HB      CYS   9  -4.655  -9.861   2.787
   75    HG   CYS   9           HG       CYS   9  -5.787 -12.102   3.508
   76    H    GLY  10           HN       GLY  10  -7.293  -7.600   0.492
   77    HA2  GLY  10           1HA      GLY  10  -9.492  -8.061  -0.352
   78    HA3  GLY  10           2HA      GLY  10 -10.042  -8.374   1.310
   79    H    GLN  11           HN       GLN  11  -8.012  -5.698   1.271
   80    HA   GLN  11           HA       GLN  11 -10.355  -3.870   1.062
   81    HB2  GLN  11           2HB      GLN  11  -7.916  -3.809   2.845
   82    HB3  GLN  11           3HB      GLN  11  -8.906  -2.360   2.546
   83    HG2  GLN  11           2HG      GLN  11 -10.866  -3.501   3.445
   84    HG3  GLN  11           3HG      GLN  11  -9.902  -4.969   3.714
   85   HE21  GLN  11          1HE2      GLN  11 -10.439  -4.906   5.943
   86   HE22  GLN  11          2HE2      GLN  11  -9.661  -3.772   7.028
   87    H    THR  12           HN       THR  12 -10.141  -1.920   0.005
   88    HA   THR  12           HA       THR  12  -7.658  -1.632  -1.606
   89    HB   THR  12           HB       THR  12 -10.394  -0.387  -2.101
   90    HG1  THR  12           1HG      THR  12 -10.492  -1.974  -3.781
   91   HG21  THR  12          3HG2      THR  12  -7.913  -0.586  -3.852
   92   HG22  THR  12          1HG2      THR  12  -9.471   0.124  -4.335
   93   HG23  THR  12          2HG2      THR  12  -8.510   0.888  -3.049
   94    H    VAL  13           HN       VAL  13  -6.306  -0.091  -0.991
   95    HA   VAL  13           HA       VAL  13  -7.439   2.239   0.476
   96    HB   VAL  13           HB       VAL  13  -5.238   2.423   1.628
   97   HG11  VAL  13          1HG1      VAL  13  -5.584   0.566   3.202
   98   HG12  VAL  13          2HG1      VAL  13  -7.125   1.318   2.730
   99   HG13  VAL  13          3HG1      VAL  13  -6.638  -0.238   2.018
  100   HG21  VAL  13          3HG2      VAL  13  -3.868   1.236  -0.019
  101   HG22  VAL  13          1HG2      VAL  13  -3.683   0.518   1.598
  102   HG23  VAL  13          2HG2      VAL  13  -4.697  -0.287   0.379
  103    H    LYS  14           HN       LYS  14  -5.853   4.172   0.365
  104    HA   LYS  14           HA       LYS  14  -4.433   4.184  -2.248
  105    HB2  LYS  14           2HB      LYS  14  -6.273   6.316  -1.146
  106    HB3  LYS  14           3HB      LYS  14  -5.109   6.599  -2.463
  107    HG2  LYS  14           2HG      LYS  14  -6.237   4.892  -3.819
  108    HG3  LYS  14           3HG      LYS  14  -7.410   4.629  -2.505
  109    HD2  LYS  14           2HD      LYS  14  -6.984   7.162  -4.119
  110    HD3  LYS  14           3HD      LYS  14  -8.410   6.097  -4.131
  111    HE2  LYS  14           2HE      LYS  14  -8.674   6.611  -1.669
  112    HE3  LYS  14           3HE      LYS  14  -7.421   7.853  -1.872
  113    HZ1  LYS  14           3HZ      LYS  14  -9.985   7.756  -3.313
  114    HZ2  LYS  14           1HZ      LYS  14  -9.622   8.771  -2.067
  115    HZ3  LYS  14           2HZ      LYS  14  -8.822   8.909  -3.501
  116    H    VAL  15           HN       VAL  15  -2.644   5.562  -2.376
  117    HA   VAL  15           HA       VAL  15  -1.280   5.840   0.182
  118    HB   VAL  15           HB       VAL  15  -0.354   6.706  -2.580
  119   HG11  VAL  15          1HG1      VAL  15   1.899   6.523  -1.617
  120   HG12  VAL  15          2HG1      VAL  15   0.905   7.704  -0.733
  121   HG13  VAL  15          3HG1      VAL  15   1.189   6.087  -0.044
  122   HG21  VAL  15          3HG2      VAL  15  -0.945   4.333  -2.573
  123   HG22  VAL  15          1HG2      VAL  15   0.817   4.551  -2.693
  124   HG23  VAL  15          2HG2      VAL  15   0.084   4.074  -1.144
  125    H    VAL  16           HN       VAL  16  -1.039   7.660   1.372
  126    HA   VAL  16           HA       VAL  16  -1.818  10.197   0.036
  127    HB   VAL  16           HB       VAL  16  -2.460  11.016   2.354
  128   HG11  VAL  16          1HG1      VAL  16  -4.698   9.994   2.255
  129   HG12  VAL  16          2HG1      VAL  16  -4.111  10.438   0.636
  130   HG13  VAL  16          3HG1      VAL  16  -4.072   8.738   1.162
  131   HG21  VAL  16          3HG2      VAL  16  -1.342   9.274   3.665
  132   HG22  VAL  16          1HG2      VAL  16  -3.084   9.319   4.022
  133   HG23  VAL  16          2HG2      VAL  16  -2.426   8.046   2.968
  134    H    LYS  17           HN       LYS  17   0.325   8.681   2.457
  135    HA   LYS  17           HA       LYS  17   2.214  10.921   1.984
  136    HB2  LYS  17           2HB      LYS  17   0.787  11.321   4.054
  137    HB3  LYS  17           3HB      LYS  17   1.581   9.892   4.761
  138    HG2  LYS  17           2HG      LYS  17   3.690  10.960   4.802
  139    HG3  LYS  17           3HG      LYS  17   3.138  12.269   3.729
  140    HD2  LYS  17           2HD      LYS  17   1.546  12.995   5.493
  141    HD3  LYS  17           3HD      LYS  17   2.202  11.736   6.568
  142    HE2  LYS  17           2HE      LYS  17   3.931  13.884   5.325
  143    HE3  LYS  17           3HE      LYS  17   3.095  14.106   6.878
  144    HZ1  LYS  17           3HZ      LYS  17   5.051  11.990   6.271
  145    HZ2  LYS  17           1HZ      LYS  17   5.342  13.335   7.178
  146    HZ3  LYS  17           2HZ      LYS  17   4.276  12.196   7.712
  147    H    LEU  18           HN       LEU  18   4.352  10.306   1.995
  148    HA   LEU  18           HA       LEU  18   4.782   7.394   2.461
  149    HB2  LEU  18           2HB      LEU  18   6.085   9.291   0.498
  150    HB3  LEU  18           3HB      LEU  18   6.675   7.646   0.833
  151    HG   LEU  18           HG       LEU  18   3.944   8.346  -0.285
  152   HD11  LEU  18          1HD1      LEU  18   4.797   7.384  -2.383
  153   HD12  LEU  18          2HD1      LEU  18   5.753   8.798  -1.880
  154   HD13  LEU  18          3HD1      LEU  18   6.391   7.156  -1.628
  155   HD21  LEU  18          3HD2      LEU  18   3.951   6.294   1.069
  156   HD22  LEU  18          1HD2      LEU  18   3.743   5.919  -0.658
  157   HD23  LEU  18          2HD2      LEU  18   5.322   5.669   0.121
  158    H    HIS  19           HN       HIS  19   5.896   6.969   4.221
  159    HA   HIS  19           HA       HIS  19   7.631   9.027   5.398
  160    HB2  HIS  19           2HB      HIS  19   7.026   6.189   6.306
  161    HB3  HIS  19           3HB      HIS  19   7.905   7.417   7.236
  162    HD1  HIS  19           1HD      HIS  19   6.442   8.040   9.126
  163    HD2  HIS  19           2HD      HIS  19   4.292   7.689   5.563
  164    HE1  HIS  19           1HE      HIS  19   4.054   8.670   9.678
  165    HE2  HIS  19           2HE      HIS  19   2.743   8.448   7.514
  166    H    GLY  20           HN       GLY  20   9.898   8.646   5.879
  167    HA2  GLY  20           1HA      GLY  20  11.533   6.611   5.519
  168    HA3  GLY  20           2HA      GLY  20  11.130   6.924   3.816
  169    H    THR  21           HN       THR  21  13.730   7.016   4.703
  170    HA   THR  21           HA       THR  21  14.454   9.781   5.308
  171    HB   THR  21           HB       THR  21  16.636   8.042   4.431
  172    HG1  THR  21           1HG      THR  21  16.342   6.512   6.143
  173   HG21  THR  21          3HG2      THR  21  15.910   9.249   7.125
  174   HG22  THR  21          1HG2      THR  21  17.491   8.561   6.686
  175   HG23  THR  21          2HG2      THR  21  16.901  10.024   5.865
  176    H    GLY  22           HN       GLY  22  13.008   9.370   2.795
  177    HA2  GLY  22           1HA      GLY  22  13.223  10.580   0.799
  178    HA3  GLY  22           2HA      GLY  22  14.980  10.680   1.052
  179    H    ALA  23           HN       ALA  23  16.057   8.385   1.034
  180    HA   ALA  23           HA       ALA  23  15.855   7.480  -1.632
  181    HB1  ALA  23           1HB      ALA  23  17.380   5.684  -0.926
  182    HB2  ALA  23           2HB      ALA  23  17.876   7.257  -0.260
  183    HB3  ALA  23           3HB      ALA  23  17.047   6.073   0.777
  184    H    LEU  24           HN       LEU  24  14.561   6.082   1.398
  185    HA   LEU  24           HA       LEU  24  13.469   3.732   0.229
  186    HB2  LEU  24           2HB      LEU  24  13.777   4.499   2.719
  187    HB3  LEU  24           3HB      LEU  24  12.143   5.174   2.510
  188    HG   LEU  24           HG       LEU  24  12.241   2.918   3.597
  189   HD11  LEU  24          1HD1      LEU  24  10.372   1.962   2.315
  190   HD12  LEU  24          2HD1      LEU  24  10.196   3.720   2.512
  191   HD13  LEU  24          3HD1      LEU  24  10.750   3.049   0.960
  192   HD21  LEU  24          3HD2      LEU  24  14.086   1.983   2.276
  193   HD22  LEU  24          1HD2      LEU  24  12.642   0.949   2.173
  194   HD23  LEU  24          2HD2      LEU  24  13.067   2.020   0.817
  195    H    LYS  25           HN       LYS  25  12.087   6.987   0.778
  196    HA   LYS  25           HA       LYS  25   9.482   6.485  -0.195
  197    HB2  LYS  25           2HB      LYS  25  11.209   8.979  -0.225
  198    HB3  LYS  25           3HB      LYS  25   9.493   8.966  -0.695
  199    HG2  LYS  25           2HG      LYS  25   8.777   8.488   1.483
  200    HG3  LYS  25           3HG      LYS  25  10.395   7.952   1.995
  201    HD2  LYS  25           2HD      LYS  25   9.778  10.177   2.901
  202    HD3  LYS  25           3HD      LYS  25  11.237  10.218   1.881
  203    HE2  LYS  25           2HE      LYS  25   9.789  12.133   1.422
  204    HE3  LYS  25           3HE      LYS  25   9.909  11.069   0.004
  205    HZ1  LYS  25           3HZ      LYS  25   7.664  11.143   1.905
  206    HZ2  LYS  25           1HZ      LYS  25   7.658  11.786   0.388
  207    HZ3  LYS  25           2HZ      LYS  25   7.775  10.155   0.588
  208    H    ARG  26           HN       ARG  26  12.414   7.628  -1.895
  209    HA   ARG  26           HA       ARG  26  11.163   7.952  -4.431
  210    HB2  ARG  26           2HB      ARG  26  13.438   8.812  -3.533
  211    HB3  ARG  26           3HB      ARG  26  14.069   7.225  -4.038
  212    HG2  ARG  26           2HG      ARG  26  12.565   9.008  -5.949
  213    HG3  ARG  26           3HG      ARG  26  14.309   9.208  -5.658
  214    HD2  ARG  26           2HD      ARG  26  14.760   6.977  -6.415
  215    HD3  ARG  26           3HD      ARG  26  13.026   6.597  -6.498
  216    HE   ARG  26           HE       ARG  26  13.755   8.835  -8.177
  217   HH11  ARG  26          2HH1      ARG  26  13.875   5.336  -7.938
  218   HH12  ARG  26          1HH1      ARG  26  13.747   5.082  -9.663
  219   HH21  ARG  26          2HH2      ARG  26  13.527   8.496 -10.431
  220   HH22  ARG  26          1HH2      ARG  26  13.550   6.869 -11.074
  221    H    ARG  27           HN       ARG  27  12.688   5.168  -2.824
  222    HA   ARG  27           HA       ARG  27  12.731   3.432  -5.088
  223    HB2  ARG  27           2HB      ARG  27  13.918   3.077  -2.901
  224    HB3  ARG  27           3HB      ARG  27  12.345   2.668  -2.177
  225    HG2  ARG  27           2HG      ARG  27  12.145   0.845  -3.913
  226    HG3  ARG  27           3HG      ARG  27  13.842   1.175  -4.339
  227    HD2  ARG  27           2HD      ARG  27  14.448   0.770  -1.940
  228    HD3  ARG  27           3HD      ARG  27  12.767   0.272  -1.650
  229    HE   ARG  27           HE       ARG  27  14.843  -1.207  -3.102
  230   HH11  ARG  27          2HH1      ARG  27  11.425  -0.912  -2.285
  231   HH12  ARG  27          1HH1      ARG  27  11.065  -2.580  -2.663
  232   HH21  ARG  27          2HH2      ARG  27  14.362  -3.375  -3.584
  233   HH22  ARG  27          1HH2      ARG  27  12.729  -3.975  -3.399
  234    H    ILE  28           HN       ILE  28  10.279   4.078  -2.571
  235    HA   ILE  28           HA       ILE  28   8.400   2.117  -3.359
  236    HB   ILE  28           HB       ILE  28   7.899   4.876  -2.164
  237   HG12  ILE  28          2HG1      ILE  28   8.176   2.166  -0.829
  238   HG13  ILE  28          3HG1      ILE  28   9.418   3.441  -0.843
  239   HG21  ILE  28          1HG2      ILE  28   5.760   3.934  -1.391
  240   HG22  ILE  28          2HG2      ILE  28   5.874   3.914  -3.166
  241   HG23  ILE  28          3HG2      ILE  28   6.122   2.414  -2.240
  242   HD11  ILE  28          3HD1      ILE  28   6.663   3.654   0.397
  243   HD12  ILE  28          1HD1      ILE  28   8.184   3.422   1.284
  244   HD13  ILE  28          2HD1      ILE  28   7.907   4.928   0.384
  245    H    MET  29           HN       MET  29   8.764   5.538  -4.325
  246    HA   MET  29           HA       MET  29   6.531   5.543  -6.106
  247    HB2  MET  29           2HB      MET  29   9.000   7.304  -6.040
  248    HB3  MET  29           3HB      MET  29   7.524   7.630  -6.979
  249    HG2  MET  29           2HG      MET  29   6.237   7.705  -4.867
  250    HG3  MET  29           3HG      MET  29   7.740   7.462  -3.963
  251    HE1  MET  29           3HE      MET  29   9.776   9.209  -5.766
  252    HE2  MET  29           1HE      MET  29   9.738  10.753  -4.885
  253    HE3  MET  29           2HE      MET  29   9.773   9.220  -3.986
  254    H    ASP  30           HN       ASP  30   9.897   4.604  -6.446
  255    HA   ASP  30           HA       ASP  30  10.066   4.660  -9.284
  256    HB2  ASP  30           2HB      ASP  30  12.028   4.479  -7.842
  257    HB3  ASP  30           3HB      ASP  30  11.475   2.897  -7.252
  258    HD2  ASP  30           2HD      ASP  30  13.042   3.086 -10.909
  259    H    MET  31           HN       MET  31   8.811   2.240  -7.014
  260    HA   MET  31           HA       MET  31   8.567   0.171  -9.019
  261    HB2  MET  31           2HB      MET  31   7.368   0.524  -6.261
  262    HB3  MET  31           3HB      MET  31   7.101  -0.912  -7.278
  263    HG2  MET  31           2HG      MET  31   9.477  -1.405  -7.263
  264    HG3  MET  31           3HG      MET  31   9.808   0.074  -6.347
  265    HE1  MET  31           3HE      MET  31   7.372   0.143  -4.300
  266    HE2  MET  31           1HE      MET  31   8.088  -0.687  -2.899
  267    HE3  MET  31           2HE      MET  31   9.062   0.466  -3.839
  268    H    GLY  32           HN       GLY  32   6.704   2.959  -8.157
  269    HA2  GLY  32           1HA      GLY  32   5.045   3.552  -9.917
  270    HA3  GLY  32           2HA      GLY  32   4.447   1.882  -9.788
  271    H    ILE  33           HN       ILE  33   5.202   2.509  -6.720
  272    HA   ILE  33           HA       ILE  33   2.425   3.127  -6.072
  273    HB   ILE  33           HB       ILE  33   4.796   2.584  -4.240
  274   HG12  ILE  33          2HG1      ILE  33   3.377   0.454  -3.816
  275   HG13  ILE  33          3HG1      ILE  33   2.609   0.848  -5.373
  276   HG21  ILE  33          1HG2      ILE  33   3.108   2.317  -2.465
  277   HG22  ILE  33          2HG2      ILE  33   3.071   3.958  -3.152
  278   HG23  ILE  33          3HG2      ILE  33   1.829   2.770  -3.615
  279   HD11  ILE  33          3HD1      ILE  33   5.560   0.351  -4.921
  280   HD12  ILE  33          1HD1      ILE  33   4.419  -0.791  -5.663
  281   HD13  ILE  33          2HD1      ILE  33   4.790   0.743  -6.478
  282    H    THR  34           HN       THR  34   2.017   5.218  -6.571
  283    HA   THR  34           HA       THR  34   3.597   7.237  -5.055
  284    HB   THR  34           HB       THR  34   2.693   8.859  -6.816
  285    HG1  THR  34           1HG      THR  34   2.110   7.841  -8.809
  286   HG21  THR  34          3HG2      THR  34   4.575   6.661  -7.741
  287   HG22  THR  34          1HG2      THR  34   4.442   8.283  -8.457
  288   HG23  THR  34          2HG2      THR  34   5.031   8.094  -6.789
  289    H    ARG  35           HN       ARG  35   2.309   9.158  -4.365
  290    HA   ARG  35           HA       ARG  35  -0.001   8.274  -2.947
  291    HB2  ARG  35           2HB      ARG  35  -0.263  10.611  -2.288
  292    HB3  ARG  35           3HB      ARG  35   1.425  10.071  -2.130
  293    HG2  ARG  35           2HG      ARG  35   2.004  11.220  -4.200
  294    HG3  ARG  35           3HG      ARG  35   0.311  11.728  -4.406
  295    HD2  ARG  35           2HD      ARG  35   0.470  12.918  -2.209
  296    HD3  ARG  35           3HD      ARG  35   2.200  12.515  -2.166
  297    HE   ARG  35           HE       ARG  35   2.351  13.795  -4.349
  298   HH11  ARG  35          2HH1      ARG  35  -0.105  14.479  -1.911
  299   HH12  ARG  35          1HH1      ARG  35  -0.325  16.139  -2.419
  300   HH21  ARG  35          2HH2      ARG  35   2.036  15.946  -5.019
  301   HH22  ARG  35          1HH2      ARG  35   0.890  16.969  -4.182
  302    H    GLY  36           HN       GLY  36  -2.174   8.588  -3.259
  303    HA2  GLY  36           1HA      GLY  36  -4.063   9.422  -4.405
  304    HA3  GLY  36           2HA      GLY  36  -3.014   9.948  -5.741
  305    H    CYS  37           HN       CYS  37  -1.803   7.034  -5.259
  306    HA   CYS  37           HA       CYS  37  -3.543   5.838  -7.311
  307    HB2  CYS  37           2HB      CYS  37  -0.918   4.927  -6.102
  308    HB3  CYS  37           3HB      CYS  37  -1.779   4.116  -7.435
  309    HG   CYS  37           HG       CYS  37   0.332   5.345  -8.357
  310    H    GLU  38           HN       GLU  38  -4.618   3.922  -7.113
  311    HA   GLU  38           HA       GLU  38  -5.435   3.270  -4.382
  312    HB2  GLU  38           2HB      GLU  38  -6.385   1.769  -6.802
  313    HB3  GLU  38           3HB      GLU  38  -7.269   2.227  -5.327
  314    HG2  GLU  38           2HG      GLU  38  -8.247   3.649  -6.814
  315    HG3  GLU  38           3HG      GLU  38  -6.894   4.669  -6.277
  316    HE2  GLU  38           2HE      GLU  38  -7.038   3.521 -10.037
  317    H    ILE  39           HN       ILE  39  -4.816   1.567  -3.242
  318    HA   ILE  39           HA       ILE  39  -3.257  -0.550  -4.633
  319    HB   ILE  39           HB       ILE  39  -2.912   0.522  -1.804
  320   HG12  ILE  39          2HG1      ILE  39  -1.132   0.651  -4.254
  321   HG13  ILE  39          3HG1      ILE  39  -1.962   2.011  -3.461
  322   HG21  ILE  39          1HG2      ILE  39  -1.045  -1.070  -1.628
  323   HG22  ILE  39          2HG2      ILE  39  -2.590  -1.907  -1.905
  324   HG23  ILE  39          3HG2      ILE  39  -1.434  -1.703  -3.244
  325   HD11  ILE  39          3HD1      ILE  39   0.232   0.314  -2.246
  326   HD12  ILE  39          1HD1      ILE  39   0.426   1.963  -2.877
  327   HD13  ILE  39          2HD1      ILE  39  -0.598   1.675  -1.454
  328    H    TYR  40           HN       TYR  40  -4.459  -2.347  -4.733
  329    HA   TYR  40           HA       TYR  40  -6.343  -2.918  -2.532
  330    HB2  TYR  40           2HB      TYR  40  -7.176  -3.227  -4.799
  331    HB3  TYR  40           3HB      TYR  40  -5.827  -4.309  -5.184
  332    HD1  TYR  40           2HD      TYR  40  -8.781  -3.987  -2.902
  333    HD2  TYR  40           1HD      TYR  40  -6.051  -6.625  -4.838
  334    HE1  TYR  40           2HE      TYR  40 -10.098  -5.913  -2.134
  335    HE2  TYR  40           1HE      TYR  40  -7.361  -8.552  -4.061
  336    HH   TYR  40           HH       TYR  40 -10.308  -8.178  -2.095
  337    H    ILE  41           HN       ILE  41  -5.719  -4.100  -0.835
  338    HA   ILE  41           HA       ILE  41  -3.216  -5.564  -0.883
  339    HB   ILE  41           HB       ILE  41  -5.409  -5.791   1.209
  340   HG12  ILE  41          2HG1      ILE  41  -4.895  -3.418   0.843
  341   HG13  ILE  41          3HG1      ILE  41  -4.305  -3.982   2.425
  342   HG21  ILE  41          1HG2      ILE  41  -3.519  -6.336   2.698
  343   HG22  ILE  41          2HG2      ILE  41  -3.602  -7.459   1.321
  344   HG23  ILE  41          3HG2      ILE  41  -2.392  -6.154   1.333
  345   HD11  ILE  41          3HD1      ILE  41  -2.623  -3.585  -0.063
  346   HD12  ILE  41          1HD1      ILE  41  -2.669  -2.498   1.341
  347   HD13  ILE  41          2HD1      ILE  41  -2.034  -4.146   1.521
  348    H    ARG  42           HN       ARG  42  -3.114  -7.339  -2.133
  349    HA   ARG  42           HA       ARG  42  -5.589  -8.853  -2.619
  350    HB2  ARG  42           2HB      ARG  42  -3.974  -8.013  -4.412
  351    HB3  ARG  42           3HB      ARG  42  -2.861  -9.286  -3.855
  352    HG2  ARG  42           2HG      ARG  42  -5.337 -10.553  -4.278
  353    HG3  ARG  42           3HG      ARG  42  -5.096  -9.461  -5.663
  354    HD2  ARG  42           2HD      ARG  42  -2.656 -10.462  -5.616
  355    HD3  ARG  42           3HD      ARG  42  -3.449 -11.797  -4.752
  356    HE   ARG  42           HE       ARG  42  -5.068 -11.538  -6.887
  357   HH11  ARG  42          2HH1      ARG  42  -1.585 -11.809  -6.543
  358   HH12  ARG  42          1HH1      ARG  42  -1.344 -12.457  -8.150
  359   HH21  ARG  42          2HH2      ARG  42  -4.742 -12.318  -9.018
  360   HH22  ARG  42          1HH2      ARG  42  -3.133 -12.746  -9.553
  361    H    LYS  43           HN       LYS  43  -2.182  -9.568  -1.678
  362    HA   LYS  43           HA       LYS  43  -3.227 -11.879  -0.133
  363    HB2  LYS  43           2HB      LYS  43  -0.882 -11.959  -2.061
  364    HB3  LYS  43           3HB      LYS  43  -1.322 -13.256  -0.924
  365    HG2  LYS  43           2HG      LYS  43  -3.056 -12.255  -3.193
  366    HG3  LYS  43           3HG      LYS  43  -2.032 -13.712  -3.239
  367    HD2  LYS  43           2HD      LYS  43  -3.341 -14.538  -1.224
  368    HD3  LYS  43           3HD      LYS  43  -4.469 -13.194  -1.518
  369    HE2  LYS  43           2HE      LYS  43  -4.804 -14.041  -3.838
  370    HE3  LYS  43           3HE      LYS  43  -3.767 -15.430  -3.447
  371    HZ1  LYS  43           3HZ      LYS  43  -6.303 -14.759  -2.116
  372    HZ2  LYS  43           1HZ      LYS  43  -6.087 -15.963  -3.221
  373    HZ3  LYS  43           2HZ      LYS  43  -5.340 -16.049  -1.755
  374    H    VAL  44           HN       VAL  44  -2.241 -12.203   1.795
  375    HA   VAL  44           HA       VAL  44   0.332 -10.772   2.268
  376    HB   VAL  44           HB       VAL  44  -1.754 -11.563   4.339
  377   HG11  VAL  44          1HG1      VAL  44  -0.345 -10.307   5.921
  378   HG12  VAL  44          2HG1      VAL  44   0.544 -11.666   5.196
  379   HG13  VAL  44          3HG1      VAL  44   0.836 -10.005   4.626
  380   HG21  VAL  44          3HG2      VAL  44  -2.503  -9.679   2.961
  381   HG22  VAL  44          1HG2      VAL  44  -2.124  -9.147   4.616
  382   HG23  VAL  44          2HG2      VAL  44  -0.979  -8.822   3.294
  383    H    ALA  45           HN       ALA  45   2.008 -12.135   2.322
  384    HA   ALA  45           HA       ALA  45   1.626 -14.957   2.228
  385    HB1  ALA  45           1HB      ALA  45   4.081 -15.078   2.333
  386    HB2  ALA  45           2HB      ALA  45   3.540 -13.822   1.194
  387    HB3  ALA  45           3HB      ALA  45   4.144 -13.363   2.804
  388    HA   PRO  46           HA       PRO  46   1.413 -16.005   6.514
  389    HB2  PRO  46           2HB      PRO  46   2.494 -18.684   5.835
  390    HB3  PRO  46           3HB      PRO  46   0.848 -18.199   6.356
  391    HG2  PRO  46           2HG      PRO  46   1.427 -19.046   3.861
  392    HG3  PRO  46           3HG      PRO  46   0.067 -17.940   4.240
  393    HD2  PRO  46           2HD      PRO  46   2.800 -17.372   3.082
  394    HD3  PRO  46           3HD      PRO  46   1.220 -16.622   2.702
  395    H    LEU  47           HN       LEU  47   3.182 -14.539   6.943
  396    HA   LEU  47           HA       LEU  47   5.369 -15.680   8.325
  397    HB2  LEU  47           2HB      LEU  47   6.076 -16.231   5.966
  398    HB3  LEU  47           3HB      LEU  47   6.133 -14.481   5.643
  399    HG   LEU  47           HG       LEU  47   7.781 -15.709   7.842
  400   HD11  LEU  47          1HD1      LEU  47   9.633 -15.935   6.230
  401   HD12  LEU  47          2HD1      LEU  47   8.261 -16.978   5.790
  402   HD13  LEU  47          3HD1      LEU  47   8.540 -15.456   4.911
  403   HD21  LEU  47          3HD2      LEU  47   7.585 -13.259   7.761
  404   HD22  LEU  47          1HD2      LEU  47   9.243 -13.778   7.381
  405   HD23  LEU  47          2HD2      LEU  47   8.152 -13.267   6.074
  406    H    GLY  48           HN       GLY  48   4.149 -13.026   6.318
  407    HA2  GLY  48           1HA      GLY  48   3.552 -11.038   7.822
  408    HA3  GLY  48           2HA      GLY  48   5.272 -11.086   8.272
  409    H    ASP  49           HN       ASP  49   6.134 -11.912   5.609
  410    HA   ASP  49           HA       ASP  49   5.257  -9.745   3.825
  411    HB2  ASP  49           2HB      ASP  49   7.386  -8.780   3.481
  412    HB3  ASP  49           3HB      ASP  49   7.202  -8.881   5.245
  413    HD2  ASP  49           2HD      ASP  49  10.222 -10.704   3.581
  414    HA   PRO  50           HA       PRO  50   6.308  -8.970   2.030
  415    HB2  PRO  50           2HB      PRO  50   5.994  -8.933  -0.661
  416    HB3  PRO  50           3HB      PRO  50   7.562  -9.387   0.081
  417    HG2  PRO  50           2HG      PRO  50   5.426 -11.169  -0.995
  418    HG3  PRO  50           3HG      PRO  50   7.196 -11.249  -1.274
  419    HD2  PRO  50           2HD      PRO  50   5.783 -12.763   0.591
  420    HD3  PRO  50           3HD      PRO  50   7.523 -12.363   0.725
  421    H    ILE  51           HN       ILE  51   4.638  -7.534   1.086
  422    HA   ILE  51           HA       ILE  51   1.948  -8.741   1.317
  423    HB   ILE  51           HB       ILE  51   2.662  -5.801   0.985
  424   HG12  ILE  51          2HG1      ILE  51   3.806  -6.632   2.971
  425   HG13  ILE  51          3HG1      ILE  51   2.451  -5.566   3.414
  426   HG21  ILE  51          1HG2      ILE  51   0.439  -5.434   1.980
  427   HG22  ILE  51          2HG2      ILE  51   0.334  -6.416   0.501
  428   HG23  ILE  51          3HG2      ILE  51   0.201  -7.193   2.097
  429   HD11  ILE  51          3HD1      ILE  51   2.439  -8.591   3.512
  430   HD12  ILE  51          1HD1      ILE  51   2.582  -7.512   4.914
  431   HD13  ILE  51          2HD1      ILE  51   1.086  -7.525   3.957
  432    H    GLN  52           HN       GLN  52   1.001  -9.405  -0.530
  433    HA   GLN  52           HA       GLN  52   1.994  -8.325  -3.078
  434    HB2  GLN  52           2HB      GLN  52   1.670 -10.764  -2.767
  435    HB3  GLN  52           3HB      GLN  52  -0.073 -10.476  -2.550
  436    HG2  GLN  52           2HG      GLN  52  -0.263  -9.639  -4.807
  437    HG3  GLN  52           3HG      GLN  52   1.496  -9.754  -5.035
  438   HE21  GLN  52          1HE2      GLN  52   2.471 -11.766  -5.338
  439   HE22  GLN  52          2HE2      GLN  52   1.540 -13.196  -5.728
  440    H    ILE  53           HN       ILE  53   1.141  -6.574  -3.896
  441    HA   ILE  53           HA       ILE  53  -1.691  -5.961  -3.223
  442    HB   ILE  53           HB       ILE  53  -1.021  -3.547  -3.308
  443   HG12  ILE  53          2HG1      ILE  53   1.793  -4.686  -3.382
  444   HG13  ILE  53          3HG1      ILE  53   0.975  -3.852  -4.725
  445   HG21  ILE  53          1HG2      ILE  53   0.093  -3.505  -1.111
  446   HG22  ILE  53          2HG2      ILE  53  -1.202  -4.724  -1.158
  447   HG23  ILE  53          3HG2      ILE  53   0.500  -5.228  -1.284
  448   HD11  ILE  53          3HD1      ILE  53   1.689  -2.635  -2.047
  449   HD12  ILE  53          1HD1      ILE  53   2.550  -2.355  -3.574
  450   HD13  ILE  53          2HD1      ILE  53   0.873  -1.801  -3.391
  451    H    ASN  54           HN       ASN  54  -2.801  -4.565  -4.738
  452    HA   ASN  54           HA       ASN  54  -1.724  -4.821  -7.501
  453    HB2  ASN  54           2HB      ASN  54  -4.548  -4.735  -6.425
  454    HB3  ASN  54           3HB      ASN  54  -4.182  -4.375  -8.126
  455   HD21  ASN  54          1HD2      ASN  54  -1.989  -6.272  -8.358
  456   HD22  ASN  54          2HD2      ASN  54  -2.712  -7.867  -8.389
  457    H    VAL  55           HN       VAL  55  -0.765  -3.014  -8.106
  458    HA   VAL  55           HA       VAL  55  -2.165  -0.444  -7.532
  459    HB   VAL  55           HB       VAL  55   0.843  -0.809  -7.791
  460   HG11  VAL  55          1HG1      VAL  55   0.956   1.505  -6.957
  461   HG12  VAL  55          2HG1      VAL  55   0.018   1.399  -8.464
  462   HG13  VAL  55          3HG1      VAL  55  -0.821   1.569  -6.903
  463   HG21  VAL  55          3HG2      VAL  55   0.051  -1.888  -5.745
  464   HG22  VAL  55          1HG2      VAL  55   0.974  -0.415  -5.371
  465   HG23  VAL  55          2HG2      VAL  55  -0.802  -0.397  -5.280
  466    H    ARG  56           HN       ARG  56  -2.473   0.877  -9.262
  467    HA   ARG  56           HA       ARG  56  -2.575   1.580 -11.433
  468    HB2  ARG  56           2HB      ARG  56  -0.061  -0.072 -11.858
  469    HB3  ARG  56           3HB      ARG  56  -0.719   1.154 -12.970
  470    HG2  ARG  56           2HG      ARG  56   0.224   1.724 -10.151
  471    HG3  ARG  56           3HG      ARG  56   1.218   1.932 -11.613
  472    HD2  ARG  56           2HD      ARG  56  -0.391   3.560 -12.487
  473    HD3  ARG  56           3HD      ARG  56  -1.414   3.334 -11.052
  474    HE   ARG  56           HE       ARG  56   0.208   4.453  -9.723
  475   HH11  ARG  56          2HH1      ARG  56   1.034   4.350 -13.144
  476   HH12  ARG  56          1HH1      ARG  56   2.225   5.624 -13.024
  477   HH21  ARG  56          2HH2      ARG  56   1.775   6.115  -9.582
  478   HH22  ARG  56          1HH2      ARG  56   2.644   6.622 -11.012
  479    H    GLY  57           HN       GLY  57  -1.136  -1.659 -11.887
  480    HA2  GLY  57           1HA      GLY  57  -3.611  -2.975 -12.407
  481    HA3  GLY  57           2HA      GLY  57  -2.835  -2.512 -13.939
  482    H    TYR  58           HN       TYR  58  -0.870  -3.119 -11.137
  483    HA   TYR  58           HA       TYR  58   0.066  -5.635 -12.436
  484    HB2  TYR  58           2HB      TYR  58   1.687  -3.545 -10.934
  485    HB3  TYR  58           3HB      TYR  58   2.320  -5.066 -11.586
  486    HD1  TYR  58           1HD      TYR  58   1.148  -1.683 -12.422
  487    HD2  TYR  58           2HD      TYR  58   2.699  -5.334 -13.974
  488    HE1  TYR  58           1HE      TYR  58   1.656  -0.560 -14.546
  489    HE2  TYR  58           2HE      TYR  58   3.209  -4.215 -16.098
  490    HH   TYR  58           HH       TYR  58   3.153  -2.282 -17.285
  491    H    GLU  59           HN       GLU  59   0.827  -7.301 -11.097
  492    HA   GLU  59           HA       GLU  59  -0.008  -7.227  -8.281
  493    HB2  GLU  59           2HB      GLU  59   1.548  -9.329  -9.826
  494    HB3  GLU  59           3HB      GLU  59   0.817  -9.518  -8.214
  495    HG2  GLU  59           2HG      GLU  59  -1.388  -9.414  -9.113
  496    HG3  GLU  59           3HG      GLU  59  -0.781  -8.920 -10.709
  497    HE2  GLU  59           2HE      GLU  59  -0.713 -12.223 -11.617
  498    H    LEU  60           HN       LEU  60   1.272  -6.148  -6.892
  499    HA   LEU  60           HA       LEU  60   4.198  -6.149  -7.456
  500    HB2  LEU  60           2HB      LEU  60   2.474  -4.087  -6.053
  501    HB3  LEU  60           3HB      LEU  60   4.249  -4.023  -6.170
  502    HG   LEU  60           HG       LEU  60   2.323  -3.944  -8.507
  503   HD11  LEU  60          1HD1      LEU  60   2.997  -1.588  -8.702
  504   HD12  LEU  60          2HD1      LEU  60   2.221  -1.915  -7.136
  505   HD13  LEU  60          3HD1      LEU  60   3.990  -1.752  -7.235
  506   HD21  LEU  60          3HD2      LEU  60   4.485  -4.964  -9.070
  507   HD22  LEU  60          1HD2      LEU  60   4.317  -3.365  -9.832
  508   HD23  LEU  60          2HD2      LEU  60   5.332  -3.556  -8.384
  509    H    SER  61           HN       SER  61   5.647  -6.342  -5.734
  510    HA   SER  61           HA       SER  61   4.425  -7.500  -3.281
  511    HB2  SER  61           2HB      SER  61   6.748  -8.611  -3.086
  512    HB3  SER  61           3HB      SER  61   5.621  -9.241  -4.311
  513    HG   SER  61           HG       SER  61   7.743  -8.913  -5.139
  514    H    LEU  62           HN       LEU  62   4.422  -6.051  -1.713
  515    HA   LEU  62           HA       LEU  62   6.802  -4.289  -1.419
  516    HB2  LEU  62           2HB      LEU  62   3.915  -3.947  -0.945
  517    HB3  LEU  62           3HB      LEU  62   4.947  -3.376   0.389
  518    HG   LEU  62           HG       LEU  62   4.369  -1.580  -1.178
  519   HD11  LEU  62          1HD1      LEU  62   6.651  -0.730  -1.546
  520   HD12  LEU  62          2HD1      LEU  62   6.489  -1.488   0.055
  521   HD13  LEU  62          3HD1      LEU  62   7.301  -2.363  -1.264
  522   HD21  LEU  62          3HD2      LEU  62   4.162  -2.920  -3.222
  523   HD22  LEU  62          1HD2      LEU  62   5.290  -1.566  -3.461
  524   HD23  LEU  62          2HD2      LEU  62   5.917  -3.212  -3.216
  525    H    ARG  63           HN       ARG  63   8.103  -4.485   0.336
  526    HA   ARG  63           HA       ARG  63   7.687  -6.756   2.073
  527    HB2  ARG  63           2HB      ARG  63   9.828  -5.007   1.390
  528    HB3  ARG  63           3HB      ARG  63   9.619  -4.952   3.156
  529    HG2  ARG  63           2HG      ARG  63  11.218  -6.676   2.525
  530    HG3  ARG  63           3HG      ARG  63   9.760  -7.402   3.243
  531    HD2  ARG  63           2HD      ARG  63   8.898  -7.778   0.915
  532    HD3  ARG  63           3HD      ARG  63  10.474  -7.234   0.302
  533    HE   ARG  63           HE       ARG  63  10.106  -9.618   2.054
  534   HH11  ARG  63          2HH1      ARG  63  11.641  -7.939  -0.633
  535   HH12  ARG  63          1HH1      ARG  63  12.696  -9.276  -1.029
  536   HH21  ARG  63          2HH2      ARG  63  11.487 -11.350   1.542
  537   HH22  ARG  63          1HH2      ARG  63  12.607 -11.212   0.206
  538    H    LYS  64           HN       LYS  64   7.377  -6.732   4.352
  539    HA   LYS  64           HA       LYS  64   5.283  -4.992   5.146
  540    HB2  LYS  64           2HB      LYS  64   5.543  -5.985   7.370
  541    HB3  LYS  64           3HB      LYS  64   5.547  -7.216   6.086
  542    HG2  LYS  64           2HG      LYS  64   7.250  -8.007   7.376
  543    HG3  LYS  64           3HG      LYS  64   8.174  -6.925   6.307
  544    HD2  LYS  64           2HD      LYS  64   8.907  -6.563   8.572
  545    HD3  LYS  64           3HD      LYS  64   7.977  -5.138   8.050
  546    HE2  LYS  64           2HE      LYS  64   5.979  -6.074   9.198
  547    HE3  LYS  64           3HE      LYS  64   6.984  -7.415   9.791
  548    HZ1  LYS  64           3HZ      LYS  64   7.403  -4.565  10.388
  549    HZ2  LYS  64           1HZ      LYS  64   6.766  -5.678  11.422
  550    HZ3  LYS  64           2HZ      LYS  64   8.337  -5.808  10.938
  551    H    SER  65           HN       SER  65   8.769  -4.817   5.492
  552    HA   SER  65           HA       SER  65   8.925  -2.825   7.505
  553    HB2  SER  65           2HB      SER  65  10.810  -3.168   5.149
  554    HB3  SER  65           3HB      SER  65  11.191  -2.558   6.777
  555    HG   SER  65           HG       SER  65  11.808  -4.756   6.483
  556    H    ALA  66           HN       ALA  66   8.703  -2.592   3.939
  557    HA   ALA  66           HA       ALA  66   8.715   0.303   3.985
  558    HB1  ALA  66           1HB      ALA  66   8.167   0.104   1.591
  559    HB2  ALA  66           2HB      ALA  66   9.519  -0.960   2.037
  560    HB3  ALA  66           3HB      ALA  66   7.892  -1.640   1.800
  561    H    ALA  67           HN       ALA  67   6.262  -2.262   3.843
  562    HA   ALA  67           HA       ALA  67   4.052  -0.617   3.203
  563    HB1  ALA  67           1HB      ALA  67   2.678  -2.467   4.068
  564    HB2  ALA  67           2HB      ALA  67   4.013  -3.066   3.056
  565    HB3  ALA  67           3HB      ALA  67   4.120  -3.180   4.830
  566    H    GLU  68           HN       GLU  68   5.611  -1.319   6.317
  567    HA   GLU  68           HA       GLU  68   3.423  -0.126   7.819
  568    HB2  GLU  68           2HB      GLU  68   4.883  -0.457   9.771
  569    HB3  GLU  68           3HB      GLU  68   4.684  -1.938   8.804
  570    HG2  GLU  68           2HG      GLU  68   6.880  -1.589   7.798
  571    HG3  GLU  68           3HG      GLU  68   7.079  -0.088   8.727
  572    HE2  GLU  68           2HE      GLU  68   8.401  -1.887  11.310
  573    H    MET  69           HN       MET  69   5.640   1.290   5.859
  574    HA   MET  69           HA       MET  69   5.562   3.731   7.562
  575    HB2  MET  69           2HB      MET  69   7.675   4.457   6.678
  576    HB3  MET  69           3HB      MET  69   7.857   2.837   7.393
  577    HG2  MET  69           2HG      MET  69   7.581   1.958   4.998
  578    HG3  MET  69           3HG      MET  69   7.866   3.631   4.487
  579    HE1  MET  69           3HE      MET  69   9.880   4.479   6.952
  580    HE2  MET  69           1HE      MET  69  11.449   4.255   6.148
  581    HE3  MET  69           2HE      MET  69  10.101   5.009   5.267
  582    H    ILE  70           HN       ILE  70   4.129   2.315   5.056
  583    HA   ILE  70           HA       ILE  70   3.982   4.781   3.420
  584    HB   ILE  70           HB       ILE  70   2.757   2.026   2.987
  585   HG12  ILE  70          2HG1      ILE  70   5.011   3.457   1.547
  586   HG13  ILE  70          3HG1      ILE  70   5.201   2.117   2.703
  587   HG21  ILE  70          1HG2      ILE  70   2.104   2.864   0.767
  588   HG22  ILE  70          2HG2      ILE  70   1.335   3.803   2.067
  589   HG23  ILE  70          3HG2      ILE  70   2.731   4.474   1.191
  590   HD11  ILE  70          3HD1      ILE  70   3.761   1.981   0.041
  591   HD12  ILE  70          1HD1      ILE  70   5.376   1.323   0.381
  592   HD13  ILE  70          2HD1      ILE  70   3.954   0.641   1.197
  593    H    GLU  71           HN       GLU  71   2.485   6.258   3.951
  594    HA   GLU  71           HA       GLU  71   0.342   5.550   5.820
  595    HB2  GLU  71           2HB      GLU  71   1.747   7.716   5.757
  596    HB3  GLU  71           3HB      GLU  71   0.708   8.187   4.391
  597    HG2  GLU  71           2HG      GLU  71  -0.239   9.206   6.276
  598    HG3  GLU  71           3HG      GLU  71  -1.262   7.791   5.944
  599    HE2  GLU  71           2HE      GLU  71  -0.779   6.837   9.201
  600    H    VAL  72           HN       VAL  72  -1.636   4.880   5.207
  601    HA   VAL  72           HA       VAL  72  -2.474   5.578   2.443
  602    HB   VAL  72           HB       VAL  72  -3.590   3.361   2.290
  603   HG11  VAL  72          1HG1      VAL  72  -1.548   2.058   1.869
  604   HG12  VAL  72          2HG1      VAL  72  -1.390   3.728   1.278
  605   HG13  VAL  72          3HG1      VAL  72  -0.602   3.243   2.799
  606   HG21  VAL  72          3HG2      VAL  72  -3.821   2.899   4.684
  607   HG22  VAL  72          1HG2      VAL  72  -2.970   1.573   3.859
  608   HG23  VAL  72          2HG2      VAL  72  -2.054   2.746   4.831
  609    H    GLU  73           HN       GLU  73  -4.809   5.254   2.054
  610    HA   GLU  73           HA       GLU  73  -6.450   5.830   4.473
  611    HB2  GLU  73           2HB      GLU  73  -6.011   7.917   3.260
  612    HB3  GLU  73           3HB      GLU  73  -6.611   7.178   1.757
  613    HG2  GLU  73           2HG      GLU  73  -8.252   8.685   2.810
  614    HG3  GLU  73           3HG      GLU  73  -8.838   7.014   2.666
  615    HE2  GLU  73           2HE      GLU  73  -9.088   6.660   6.095
  616    H    LEU  74           HN       LEU  74  -8.659   5.131   4.313
  617    HA   LEU  74           HA       LEU  74  -8.746   2.586   2.894
  618    HB2  LEU  74           2HB      LEU  74  -9.958   3.775   5.233
  619    HB3  LEU  74           3HB      LEU  74 -11.203   3.040   4.194
  620    HG   LEU  74           HG       LEU  74 -10.425   1.496   5.923
  621   HD11  LEU  74          1HD1      LEU  74  -9.913  -0.422   4.465
  622   HD12  LEU  74          2HD1      LEU  74 -11.191   0.600   3.771
  623   HD13  LEU  74          3HD1      LEU  74  -9.533   0.695   3.135
  624   HD21  LEU  74          3HD2      LEU  74  -8.144   2.354   6.186
  625   HD22  LEU  74          1HD2      LEU  74  -8.134   0.603   5.877
  626   HD23  LEU  74          2HD2      LEU  74  -7.720   1.737   4.571
  627    H    GLU  75           HN       GLU  75 -10.643   1.823   1.828
  628    HA   GLU  75           HA       GLU  75 -11.527   3.486  -0.325
  629    HB2  GLU  75           2HB      GLU  75 -13.086   1.517  -0.711
  630    HB3  GLU  75           3HB      GLU  75 -11.355   1.111  -0.629
  631    HG2  GLU  75           2HG      GLU  75 -11.603   0.357   1.665
  632    HG3  GLU  75           3HG      GLU  75 -13.307   0.860   1.677
  633    HE2  GLU  75           2HE      GLU  75 -14.309  -2.080   0.236
  634    H    HIS  76           HN       HIS  76 -13.925   3.658  -0.873
  635    HA   HIS  76           HA       HIS  76 -15.648   3.841   1.519
  636    HB2  HIS  76           2HB      HIS  76 -15.126   6.078  -0.430
  637    HB3  HIS  76           3HB      HIS  76 -16.683   5.944   0.408
  638    HD1  HIS  76           1HD      HIS  76 -16.112   5.422   3.220
  639    HD2  HIS  76           2HD      HIS  76 -13.569   7.816   0.925
  640    HE1  HIS  76           1HE      HIS  76 -14.824   6.860   4.860
  641    HE2  HIS  76           2HE      HIS  76 -13.281   8.313   3.463
  642    H    HIS  77           HN       HIS  77 -16.566   1.899   0.797
  643    HA   HIS  77           HA       HIS  77 -17.890   1.866  -1.806
  644    HB2  HIS  77           2HB      HIS  77 -17.533  -0.052   0.451
  645    HB3  HIS  77           3HB      HIS  77 -18.975  -0.251  -0.562
  646    HD1  HIS  77           1HD      HIS  77 -15.408  -1.053  -0.429
  647    HD2  HIS  77           2HD      HIS  77 -18.294  -0.558  -3.406
  648    HE1  HIS  77           1HE      HIS  77 -14.459  -2.119  -2.524
  649    HE2  HIS  77           2HE      HIS  77 -16.217  -1.817  -4.328
  650    H    HIS  78           HN       HIS  78 -20.180   1.723  -2.099
  651    HA   HIS  78           HA       HIS  78 -21.501   3.521  -0.148
  652    HB2  HIS  78           2HB      HIS  78 -22.165   2.897  -3.044
  653    HB3  HIS  78           3HB      HIS  78 -23.039   4.043  -2.010
  654    HD1  HIS  78           1HD      HIS  78 -20.334   3.871  -4.411
  655    HD2  HIS  78           2HD      HIS  78 -21.198   6.203  -1.053
  656    HE1  HIS  78           1HE      HIS  78 -18.837   5.906  -4.560
  657    HE2  HIS  78           2HE      HIS  78 -19.363   7.321  -2.519
  658    H    HIS  79           HN       HIS  79 -23.345   3.018   0.886
  659    HA   HIS  79           HA       HIS  79 -23.960   0.241   1.156
  660    HB2  HIS  79           2HB      HIS  79 -25.809   1.015   2.618
  661    HB3  HIS  79           3HB      HIS  79 -24.224   1.686   3.045
  662    HD1  HIS  79           1HD      HIS  79 -24.301   4.060   3.644
  663    HD2  HIS  79           2HD      HIS  79 -27.290   3.065   0.906
  664    HE1  HIS  79           1HE      HIS  79 -25.656   6.169   3.282
  665    HE2  HIS  79           2HE      HIS  79 -27.476   5.560   1.620
  666    H    HIS  80           HN       HIS  80 -26.041  -0.786   0.855
  667    HA   HIS  80           HA       HIS  80 -26.835  -0.302  -1.917
  668    HB2  HIS  80           2HB      HIS  80 -27.783  -2.450   0.009
  669    HB3  HIS  80           3HB      HIS  80 -27.963  -2.443  -1.756
  670    HD1  HIS  80           1HD      HIS  80 -26.137  -4.187   0.608
  671    HD2  HIS  80           2HD      HIS  80 -25.001  -2.081  -2.818
  672    HE1  HIS  80           1HE      HIS  80 -23.871  -5.098  -0.064
  673    HE2  HIS  80           2HE      HIS  80 -23.184  -3.816  -2.144
  674    H    HIS  81           HN       HIS  81 -28.074   0.393   1.240
  675    HA   HIS  81           HA       HIS  81 -30.676   1.129  -0.012
  676    HB2  HIS  81           2HB      HIS  81 -30.883  -0.908   1.395
  677    HB3  HIS  81           3HB      HIS  81 -30.248   0.004   2.777
  678    HD1  HIS  81           1HD      HIS  81 -33.245  -0.123   0.456
  679    HD2  HIS  81           2HD      HIS  81 -32.134   1.482   4.148
  680    HE1  HIS  81           1HE      HIS  81 -35.364   0.816   1.483
  681    HE2  HIS  81           2HE      HIS  81 -34.681   1.785   3.726
  Start of MODEL   19
    1    H1   MET   1           HN       MET   1   0.329   1.898  13.839
    2    HA   MET   1           HA       MET   1  -0.544   4.590  13.550
    3    HB2  MET   1           2HB      MET   1   0.557   5.221  11.433
    4    HB3  MET   1           3HB      MET   1   1.710   5.091  12.783
    5    HG2  MET   1           2HG      MET   1   2.424   2.895  11.967
    6    HG3  MET   1           3HG      MET   1   1.262   3.001  10.635
    7    HE1  MET   1           3HE      MET   1   1.436   6.001   9.712
    8    HE2  MET   1           1HE      MET   1   2.695   5.914   8.459
    9    HE3  MET   1           2HE      MET   1   1.479   4.623   8.588
   10    H    PHE   2           HN       PHE   2  -1.253   4.779  10.934
   11    HA   PHE   2           HA       PHE   2  -2.571   2.165  10.369
   12    HB2  PHE   2           2HB      PHE   2  -4.109   4.019  11.069
   13    HB3  PHE   2           3HB      PHE   2  -3.576   4.936   9.650
   14    HD1  PHE   2           2HD      PHE   2  -5.048   1.628  10.577
   15    HD2  PHE   2           1HD      PHE   2  -4.760   4.721   7.662
   16    HE1  PHE   2           2HE      PHE   2  -6.760   0.509   9.221
   17    HE2  PHE   2           1HE      PHE   2  -6.472   3.601   6.303
   18    HZ   PHE   2           HZ       PHE   2  -7.476   1.493   7.084
   19    H    SER   3           HN       SER   3  -0.890   1.421   9.082
   20    HA   SER   3           HA       SER   3  -0.398   3.025   6.620
   21    HB2  SER   3           2HB      SER   3   1.827   1.953   6.560
   22    HB3  SER   3           3HB      SER   3   1.586   2.879   8.062
   23    HG   SER   3           HG       SER   3   2.489   0.794   8.436
   24    H    LEU   4           HN       LEU   4   0.695   1.382   4.930
   25    HA   LEU   4           HA       LEU   4  -1.353  -0.461   4.143
   26    HB2  LEU   4           2HB      LEU   4   0.343   0.750   2.686
   27    HB3  LEU   4           3HB      LEU   4   1.539  -0.445   3.243
   28    HG   LEU   4           HG       LEU   4   0.189  -2.245   2.263
   29   HD11  LEU   4          1HD1      LEU   4  -1.703  -1.707   0.787
   30   HD12  LEU   4          2HD1      LEU   4  -2.017  -1.193   2.460
   31   HD13  LEU   4          3HD1      LEU   4  -1.558   0.009   1.230
   32   HD21  LEU   4          3HD2      LEU   4   1.971  -1.185   0.951
   33   HD22  LEU   4          1HD2      LEU   4   0.629  -1.703  -0.096
   34   HD23  LEU   4          2HD2      LEU   4   0.809   0.013   0.334
   35    H    ARG   5           HN       ARG   5   1.322  -0.628   6.288
   36    HA   ARG   5           HA       ARG   5   1.735  -3.472   6.315
   37    HB2  ARG   5           2HB      ARG   5   3.428  -2.014   7.152
   38    HB3  ARG   5           3HB      ARG   5   2.281  -1.199   8.241
   39    HG2  ARG   5           2HG      ARG   5   3.701  -2.554   9.570
   40    HG3  ARG   5           3HG      ARG   5   2.104  -3.338   9.523
   41    HD2  ARG   5           2HD      ARG   5   4.225  -4.136   7.551
   42    HD3  ARG   5           3HD      ARG   5   4.284  -4.756   9.215
   43    HE   ARG   5           HE       ARG   5   1.813  -5.073   7.602
   44   HH11  ARG   5          2HH1      ARG   5   4.570  -6.449   9.309
   45   HH12  ARG   5          1HH1      ARG   5   3.941  -8.081   9.268
   46   HH21  ARG   5          2HH2      ARG   5   0.991  -7.192   7.560
   47   HH22  ARG   5          1HH2      ARG   5   1.905  -8.503   8.273
   48    H    ASP   6           HN       ASP   6  -0.508  -1.255   7.899
   49    HA   ASP   6           HA       ASP   6  -1.324  -3.310   9.832
   50    HB2  ASP   6           2HB      ASP   6  -2.403  -0.502   9.417
   51    HB3  ASP   6           3HB      ASP   6  -2.697  -1.562  10.813
   52    HD2  ASP   6           2HD      ASP   6   0.642   0.520  10.662
   53    H    ALA   7           HN       ALA   7  -2.261  -2.192   6.718
   54    HA   ALA   7           HA       ALA   7  -5.093  -2.735   7.013
   55    HB1  ALA   7           1HB      ALA   7  -5.174  -2.355   4.584
   56    HB2  ALA   7           2HB      ALA   7  -4.252  -1.079   5.412
   57    HB3  ALA   7           3HB      ALA   7  -3.396  -2.363   4.525
   58    H    LYS   8           HN       LYS   8  -6.147  -4.261   5.292
   59    HA   LYS   8           HA       LYS   8  -4.723  -6.871   5.551
   60    HB2  LYS   8           2HB      LYS   8  -7.700  -6.296   5.718
   61    HB3  LYS   8           3HB      LYS   8  -6.955  -7.912   5.759
   62    HG2  LYS   8           2HG      LYS   8  -6.639  -5.706   7.808
   63    HG3  LYS   8           3HG      LYS   8  -7.542  -7.228   7.998
   64    HD2  LYS   8           2HD      LYS   8  -5.340  -8.428   7.552
   65    HD3  LYS   8           3HD      LYS   8  -4.551  -6.843   7.742
   66    HE2  LYS   8           2HE      LYS   8  -4.468  -8.012   9.852
   67    HE3  LYS   8           3HE      LYS   8  -5.597  -6.647   9.995
   68    HZ1  LYS   8           3HZ      LYS   8  -6.356  -9.457   9.534
   69    HZ2  LYS   8           1HZ      LYS   8  -6.493  -8.647  10.963
   70    HZ3  LYS   8           2HZ      LYS   8  -7.403  -8.190   9.667
   71    H    CYS   9           HN       CYS   9  -5.363  -8.528   3.978
   72    HA   CYS   9           HA       CYS   9  -5.381  -7.421   1.310
   73    HB2  CYS   9           2HB      CYS   9  -5.494  -9.832   0.634
   74    HB3  CYS   9           3HB      CYS   9  -4.119  -9.398   1.681
   75    HG   CYS   9           HG       CYS   9  -4.932 -11.818   2.235
   76    H    GLY  10           HN       GLY  10  -6.960  -7.633  -0.298
   77    HA2  GLY  10           1HA      GLY  10  -9.141  -8.119  -1.069
   78    HA3  GLY  10           2HA      GLY  10  -9.645  -8.479   0.597
   79    H    GLN  11           HN       GLN  11  -8.025  -5.875   1.233
   80    HA   GLN  11           HA       GLN  11 -10.381  -4.121   0.951
   81    HB2  GLN  11           2HB      GLN  11  -7.806  -3.805   2.528
   82    HB3  GLN  11           3HB      GLN  11  -9.190  -2.687   2.567
   83    HG2  GLN  11           2HG      GLN  11 -10.602  -4.453   3.490
   84    HG3  GLN  11           3HG      GLN  11  -9.238  -5.590   3.424
   85   HE21  GLN  11          1HE2      GLN  11 -10.842  -4.683   5.727
   86   HE22  GLN  11          2HE2      GLN  11  -9.699  -3.990   6.859
   87    H    THR  12           HN       THR  12 -10.102  -1.890   0.319
   88    HA   THR  12           HA       THR  12  -7.826  -1.535  -1.565
   89    HB   THR  12           HB       THR  12 -10.605  -0.317  -1.809
   90    HG1  THR  12           1HG      THR  12 -10.831  -1.878  -3.503
   91   HG21  THR  12          3HG2      THR  12  -8.269  -0.471  -3.750
   92   HG22  THR  12          1HG2      THR  12  -9.861   0.243  -4.095
   93   HG23  THR  12          2HG2      THR  12  -8.803   0.983  -2.872
   94    H    VAL  13           HN       VAL  13  -6.456  -0.021  -0.943
   95    HA   VAL  13           HA       VAL  13  -7.523   2.210   0.715
   96    HB   VAL  13           HB       VAL  13  -5.291   2.359   1.770
   97   HG11  VAL  13          1HG1      VAL  13  -5.465   0.362   3.194
   98   HG12  VAL  13          2HG1      VAL  13  -7.062   1.072   2.871
   99   HG13  VAL  13          3HG1      VAL  13  -6.547  -0.393   2.002
  100   HG21  VAL  13          3HG2      VAL  13  -3.963   1.382  -0.042
  101   HG22  VAL  13          1HG2      VAL  13  -3.657   0.542   1.495
  102   HG23  VAL  13          2HG2      VAL  13  -4.702  -0.209   0.266
  103    H    LYS  14           HN       LYS  14  -5.988   4.178   0.595
  104    HA   LYS  14           HA       LYS  14  -4.741   4.321  -2.100
  105    HB2  LYS  14           2HB      LYS  14  -6.884   5.496  -2.140
  106    HB3  LYS  14           3HB      LYS  14  -6.399   6.450  -0.718
  107    HG2  LYS  14           2HG      LYS  14  -4.710   7.582  -1.949
  108    HG3  LYS  14           3HG      LYS  14  -4.886   6.476  -3.332
  109    HD2  LYS  14           2HD      LYS  14  -5.953   8.708  -3.664
  110    HD3  LYS  14           3HD      LYS  14  -7.070   7.331  -3.828
  111    HE2  LYS  14           2HE      LYS  14  -7.935   7.712  -1.597
  112    HE3  LYS  14           3HE      LYS  14  -6.745   9.003  -1.321
  113    HZ1  LYS  14           3HZ      LYS  14  -8.883   9.047  -3.343
  114    HZ2  LYS  14           1HZ      LYS  14  -8.888   9.882  -1.922
  115    HZ3  LYS  14           2HZ      LYS  14  -7.779  10.245  -3.088
  116    H    VAL  15           HN       VAL  15  -2.731   5.154  -2.154
  117    HA   VAL  15           HA       VAL  15  -1.408   5.689   0.367
  118    HB   VAL  15           HB       VAL  15  -0.395   6.084  -2.473
  119   HG11  VAL  15          1HG1      VAL  15   1.839   5.970  -1.453
  120   HG12  VAL  15          2HG1      VAL  15   0.893   7.328  -0.801
  121   HG13  VAL  15          3HG1      VAL  15   1.096   5.843   0.159
  122   HG21  VAL  15          3HG2      VAL  15  -1.101   3.776  -2.063
  123   HG22  VAL  15          1HG2      VAL  15   0.671   3.891  -2.191
  124   HG23  VAL  15          2HG2      VAL  15  -0.095   3.724  -0.594
  125    H    VAL  16           HN       VAL  16  -1.426   7.574   1.413
  126    HA   VAL  16           HA       VAL  16  -2.031   9.980  -0.219
  127    HB   VAL  16           HB       VAL  16  -2.788  10.965   2.017
  128   HG11  VAL  16          1HG1      VAL  16  -5.020   9.941   1.843
  129   HG12  VAL  16          2HG1      VAL  16  -4.339  10.296   0.239
  130   HG13  VAL  16          3HG1      VAL  16  -4.337   8.627   0.859
  131   HG21  VAL  16          3HG2      VAL  16  -1.758   9.293   3.484
  132   HG22  VAL  16          1HG2      VAL  16  -3.518   9.360   3.734
  133   HG23  VAL  16          2HG2      VAL  16  -2.805   8.032   2.789
  134    H    LYS  17           HN       LYS  17   0.143   8.616   2.170
  135    HA   LYS  17           HA       LYS  17   1.882  10.979   1.751
  136    HB2  LYS  17           2HB      LYS  17   0.464  11.164   3.886
  137    HB3  LYS  17           3HB      LYS  17   1.445   9.815   4.505
  138    HG2  LYS  17           2HG      LYS  17   3.461  11.141   4.308
  139    HG3  LYS  17           3HG      LYS  17   2.545  12.475   3.564
  140    HD2  LYS  17           2HD      LYS  17   1.151  12.571   5.653
  141    HD3  LYS  17           3HD      LYS  17   2.265  11.390   6.382
  142    HE2  LYS  17           2HE      LYS  17   4.135  12.953   6.052
  143    HE3  LYS  17           3HE      LYS  17   3.023  14.133   5.323
  144    HZ1  LYS  17           3HZ      LYS  17   2.874  13.116   8.083
  145    HZ2  LYS  17           1HZ      LYS  17   3.427  14.602   7.635
  146    HZ3  LYS  17           2HZ      LYS  17   1.842  14.209   7.406
  147    H    LEU  18           HN       LEU  18   4.038  10.500   1.681
  148    HA   LEU  18           HA       LEU  18   4.692   7.604   1.917
  149    HB2  LEU  18           2HB      LEU  18   5.906   9.832   0.265
  150    HB3  LEU  18           3HB      LEU  18   6.654   8.228   0.454
  151    HG   LEU  18           HG       LEU  18   3.959   8.812  -0.811
  152   HD11  LEU  18          1HD1      LEU  18   5.069   8.101  -2.892
  153   HD12  LEU  18          2HD1      LEU  18   5.871   9.521  -2.182
  154   HD13  LEU  18          3HD1      LEU  18   6.601   7.907  -2.009
  155   HD21  LEU  18          3HD2      LEU  18   3.996   6.650   0.357
  156   HD22  LEU  18          1HD2      LEU  18   3.970   6.423  -1.408
  157   HD23  LEU  18          2HD2      LEU  18   5.488   6.205  -0.506
  158    H    HIS  19           HN       HIS  19   5.715   7.095   3.737
  159    HA   HIS  19           HA       HIS  19   7.261   9.162   5.154
  160    HB2  HIS  19           2HB      HIS  19   6.547   6.304   5.894
  161    HB3  HIS  19           3HB      HIS  19   7.450   7.424   6.930
  162    HD1  HIS  19           1HD      HIS  19   6.134   9.386   8.015
  163    HD2  HIS  19           2HD      HIS  19   3.776   6.724   5.824
  164    HE1  HIS  19           1HE      HIS  19   3.736   9.877   8.657
  165    HE2  HIS  19           2HE      HIS  19   2.305   8.259   7.327
  166    H    GLY  20           HN       GLY  20   9.381   8.396   6.182
  167    HA2  GLY  20           1HA      GLY  20  11.255   6.828   5.899
  168    HA3  GLY  20           2HA      GLY  20  10.877   6.796   4.161
  169    H    THR  21           HN       THR  21  13.408   7.303   4.730
  170    HA   THR  21           HA       THR  21  13.927  10.119   5.142
  171    HB   THR  21           HB       THR  21  16.282   9.373   4.350
  172    HG1  THR  21           1HG      THR  21  16.532   7.071   4.451
  173   HG21  THR  21          3HG2      THR  21  15.002   8.034   6.758
  174   HG22  THR  21          1HG2      THR  21  16.745   8.284   6.514
  175   HG23  THR  21          2HG2      THR  21  15.665   9.684   6.711
  176    H    GLY  22           HN       GLY  22  15.138   8.182   2.391
  177    HA2  GLY  22           1HA      GLY  22  13.781  10.015   0.520
  178    HA3  GLY  22           2HA      GLY  22  15.560   9.999   0.501
  179    H    ALA  23           HN       ALA  23  16.339   7.503   0.701
  180    HA   ALA  23           HA       ALA  23  15.753   6.370  -1.834
  181    HB1  ALA  23           1HB      ALA  23  17.084   4.451  -1.057
  182    HB2  ALA  23           2HB      ALA  23  17.866   5.993  -0.643
  183    HB3  ALA  23           3HB      ALA  23  17.000   5.070   0.609
  184    H    LEU  24           HN       LEU  24  14.417   5.816   1.395
  185    HA   LEU  24           HA       LEU  24  12.965   3.443   0.794
  186    HB2  LEU  24           2HB      LEU  24  12.612   5.657   2.809
  187    HB3  LEU  24           3HB      LEU  24  11.411   4.352   2.657
  188    HG   LEU  24           HG       LEU  24  12.900   3.852   4.471
  189   HD11  LEU  24          1HD1      LEU  24  13.754   1.656   3.763
  190   HD12  LEU  24          2HD1      LEU  24  12.132   1.970   3.102
  191   HD13  LEU  24          3HD1      LEU  24  13.565   2.134   2.060
  192   HD21  LEU  24          3HD2      LEU  24  14.816   5.219   3.792
  193   HD22  LEU  24          1HD2      LEU  24  15.324   3.557   4.170
  194   HD23  LEU  24          2HD2      LEU  24  15.173   4.075   2.475
  195    H    LYS  25           HN       LYS  25  11.999   6.894   0.734
  196    HA   LYS  25           HA       LYS  25   9.368   6.538  -0.183
  197    HB2  LYS  25           2HB      LYS  25  11.365   8.762  -0.693
  198    HB3  LYS  25           3HB      LYS  25   9.645   8.848  -1.146
  199    HG2  LYS  25           2HG      LYS  25   9.009   8.629   1.207
  200    HG3  LYS  25           3HG      LYS  25  10.727   8.528   1.665
  201    HD2  LYS  25           2HD      LYS  25   9.762  10.807   1.968
  202    HD3  LYS  25           3HD      LYS  25  11.132  10.770   0.831
  203    HE2  LYS  25           2HE      LYS  25   9.435  10.608  -1.040
  204    HE3  LYS  25           3HE      LYS  25   8.175  10.926   0.172
  205    HZ1  LYS  25           3HZ      LYS  25  10.422  12.715  -0.472
  206    HZ2  LYS  25           1HZ      LYS  25   8.858  12.930  -0.946
  207    HZ3  LYS  25           2HZ      LYS  25   9.253  13.010   0.653
  208    H    ARG  26           HN       ARG  26  12.363   7.136  -2.077
  209    HA   ARG  26           HA       ARG  26  11.012   7.037  -4.581
  210    HB2  ARG  26           2HB      ARG  26  13.915   6.826  -3.801
  211    HB3  ARG  26           3HB      ARG  26  13.373   6.704  -5.492
  212    HG2  ARG  26           2HG      ARG  26  12.226   8.924  -5.182
  213    HG3  ARG  26           3HG      ARG  26  13.040   9.045  -3.604
  214    HD2  ARG  26           2HD      ARG  26  15.209   8.987  -4.654
  215    HD3  ARG  26           3HD      ARG  26  14.481   8.659  -6.241
  216    HE   ARG  26           HE       ARG  26  13.380  11.064  -5.252
  217   HH11  ARG  26          2HH1      ARG  26  16.496   9.799  -6.284
  218   HH12  ARG  26          1HH1      ARG  26  17.067  11.342  -6.880
  219   HH21  ARG  26          2HH2      ARG  26  14.114  13.063  -6.050
  220   HH22  ARG  26          1HH2      ARG  26  15.714  13.194  -6.746
  221    H    ARG  27           HN       ARG  27  12.594   4.505  -2.634
  222    HA   ARG  27           HA       ARG  27  12.599   2.448  -4.561
  223    HB2  ARG  27           2HB      ARG  27  13.647   2.109  -2.432
  224    HB3  ARG  27           3HB      ARG  27  12.118   2.399  -1.568
  225    HG2  ARG  27           2HG      ARG  27  12.599   0.051  -1.527
  226    HG3  ARG  27           3HG      ARG  27  11.203   0.329  -2.594
  227    HD2  ARG  27           2HD      ARG  27  12.770   0.258  -4.548
  228    HD3  ARG  27           3HD      ARG  27  14.071  -0.198  -3.428
  229    HE   ARG  27           HE       ARG  27  11.643  -1.864  -3.408
  230   HH11  ARG  27          2HH1      ARG  27  14.986  -1.463  -4.464
  231   HH12  ARG  27          1HH1      ARG  27  15.199  -3.157  -4.836
  232   HH21  ARG  27          2HH2      ARG  27  11.932  -4.060  -3.906
  233   HH22  ARG  27          1HH2      ARG  27  13.469  -4.628  -4.520
  234    H    ILE  28           HN       ILE  28  10.021   3.641  -2.437
  235    HA   ILE  28           HA       ILE  28   8.123   1.630  -3.296
  236    HB   ILE  28           HB       ILE  28   7.746   4.225  -1.747
  237   HG12  ILE  28          2HG1      ILE  28   7.961   1.361  -0.768
  238   HG13  ILE  28          3HG1      ILE  28   9.263   2.572  -0.687
  239   HG21  ILE  28          1HG2      ILE  28   5.607   3.258  -1.023
  240   HG22  ILE  28          2HG2      ILE  28   5.664   3.464  -2.788
  241   HG23  ILE  28          3HG2      ILE  28   5.890   1.850  -2.071
  242   HD11  ILE  28          3HD1      ILE  28   6.577   2.751   0.701
  243   HD12  ILE  28          1HD1      ILE  28   8.121   2.344   1.480
  244   HD13  ILE  28          2HD1      ILE  28   7.880   3.960   0.784
  245    H    MET  29           HN       MET  29   8.494   5.155  -3.832
  246    HA   MET  29           HA       MET  29   6.132   5.396  -5.406
  247    HB2  MET  29           2HB      MET  29   6.949   7.614  -5.959
  248    HB3  MET  29           3HB      MET  29   7.189   7.270  -4.229
  249    HG2  MET  29           2HG      MET  29   9.217   8.155  -4.635
  250    HG3  MET  29           3HG      MET  29   9.581   6.500  -5.154
  251    HE1  MET  29           3HE      MET  29   9.013  10.190  -6.167
  252    HE2  MET  29           1HE      MET  29   8.782  10.105  -7.929
  253    HE3  MET  29           2HE      MET  29   7.538   9.453  -6.836
  254    H    ASP  30           HN       ASP  30   9.451   4.558  -6.229
  255    HA   ASP  30           HA       ASP  30   9.300   4.966  -9.038
  256    HB2  ASP  30           2HB      ASP  30  11.397   4.553  -7.834
  257    HB3  ASP  30           3HB      ASP  30  10.863   2.903  -7.445
  258    HD2  ASP  30           2HD      ASP  30  12.029   3.630 -11.183
  259    H    MET  31           HN       MET  31   7.834   2.585  -6.982
  260    HA   MET  31           HA       MET  31   7.389   0.715  -9.207
  261    HB2  MET  31           2HB      MET  31   6.548   0.671  -6.294
  262    HB3  MET  31           3HB      MET  31   6.173  -0.608  -7.474
  263    HG2  MET  31           2HG      MET  31   8.571  -1.008  -7.805
  264    HG3  MET  31           3HG      MET  31   8.952   0.272  -6.641
  265    HE1  MET  31           3HE      MET  31   6.655  -0.167  -4.460
  266    HE2  MET  31           1HE      MET  31   7.500  -1.216  -3.300
  267    HE3  MET  31           2HE      MET  31   8.359   0.147  -4.055
  268    H    GLY  32           HN       GLY  32   6.096   3.609  -8.536
  269    HA2  GLY  32           1HA      GLY  32   4.196   4.287  -9.869
  270    HA3  GLY  32           2HA      GLY  32   3.452   2.702  -9.560
  271    H    ILE  33           HN       ILE  33   4.811   3.558  -6.702
  272    HA   ILE  33           HA       ILE  33   2.223   4.452  -5.647
  273    HB   ILE  33           HB       ILE  33   4.817   4.048  -4.118
  274   HG12  ILE  33          2HG1      ILE  33   4.347   2.005  -5.351
  275   HG13  ILE  33          3HG1      ILE  33   4.025   1.774  -3.616
  276   HG21  ILE  33          1HG2      ILE  33   3.311   3.668  -2.209
  277   HG22  ILE  33          2HG2      ILE  33   3.048   5.269  -2.938
  278   HG23  ILE  33          3HG2      ILE  33   1.906   3.944  -3.265
  279   HD11  ILE  33          3HD1      ILE  33   1.948   2.269  -5.761
  280   HD12  ILE  33          1HD1      ILE  33   2.294   0.705  -4.995
  281   HD13  ILE  33          2HD1      ILE  33   1.626   2.035  -4.026
  282    H    THR  34           HN       THR  34   2.276   6.536  -6.809
  283    HA   THR  34           HA       THR  34   4.461   8.333  -5.931
  284    HB   THR  34           HB       THR  34   3.673   9.760  -7.870
  285    HG1  THR  34           1HG      THR  34   2.319   8.666  -9.393
  286   HG21  THR  34          3HG2      THR  34   4.509   6.912  -8.516
  287   HG22  THR  34          1HG2      THR  34   4.689   8.317  -9.591
  288   HG23  THR  34          2HG2      THR  34   5.600   8.244  -8.065
  289    H    ARG  35           HN       ARG  35   1.931   7.655  -4.401
  290    HA   ARG  35           HA       ARG  35   0.609   8.795  -2.919
  291    HB2  ARG  35           2HB      ARG  35   2.550  10.331  -2.697
  292    HB3  ARG  35           3HB      ARG  35   1.884  11.318  -4.020
  293    HG2  ARG  35           2HG      ARG  35  -0.108  11.782  -2.662
  294    HG3  ARG  35           3HG      ARG  35   0.577  10.812  -1.336
  295    HD2  ARG  35           2HD      ARG  35   2.558  12.341  -1.323
  296    HD3  ARG  35           3HD      ARG  35   1.733  13.352  -2.529
  297    HE   ARG  35           HE       ARG  35   0.220  12.832  -0.080
  298   HH11  ARG  35          2HH1      ARG  35   2.443  14.961  -1.784
  299   HH12  ARG  35          1HH1      ARG  35   2.054  16.357  -0.807
  300   HH21  ARG  35          2HH2      ARG  35  -0.277  14.667   1.191
  301   HH22  ARG  35          1HH2      ARG  35   0.519  16.191   0.874
  302    H    GLY  36           HN       GLY  36  -1.523   8.859  -3.213
  303    HA2  GLY  36           1HA      GLY  36  -3.533   9.699  -4.144
  304    HA3  GLY  36           2HA      GLY  36  -2.603  10.447  -5.463
  305    H    CYS  37           HN       CYS  37  -1.725   7.253  -4.615
  306    HA   CYS  37           HA       CYS  37  -3.101   6.216  -7.043
  307    HB2  CYS  37           2HB      CYS  37  -1.303   4.423  -6.867
  308    HB3  CYS  37           3HB      CYS  37  -0.757   6.056  -7.323
  309    HG   CYS  37           HG       CYS  37   1.049   4.899  -5.826
  310    H    GLU  38           HN       GLU  38  -4.548   4.577  -6.841
  311    HA   GLU  38           HA       GLU  38  -5.272   3.756  -4.147
  312    HB2  GLU  38           2HB      GLU  38  -6.339   2.887  -6.849
  313    HB3  GLU  38           3HB      GLU  38  -7.027   2.426  -5.273
  314    HG2  GLU  38           2HG      GLU  38  -7.319   4.899  -4.819
  315    HG3  GLU  38           3HG      GLU  38  -6.913   5.172  -6.527
  316    HE2  GLU  38           2HE      GLU  38  -9.957   3.603  -7.514
  317    H    ILE  39           HN       ILE  39  -5.045   1.825  -3.194
  318    HA   ILE  39           HA       ILE  39  -3.198  -0.084  -4.534
  319    HB   ILE  39           HB       ILE  39  -3.541   0.539  -1.571
  320   HG12  ILE  39          2HG1      ILE  39  -2.351   2.291  -2.809
  321   HG13  ILE  39          3HG1      ILE  39  -1.286   1.433  -1.670
  322   HG21  ILE  39          1HG2      ILE  39  -1.654  -0.999  -1.215
  323   HG22  ILE  39          2HG2      ILE  39  -3.040  -1.830  -1.960
  324   HG23  ILE  39          3HG2      ILE  39  -1.634  -1.375  -2.954
  325   HD11  ILE  39          3HD1      ILE  39  -1.427   0.982  -4.659
  326   HD12  ILE  39          1HD1      ILE  39  -0.146   1.866  -3.803
  327   HD13  ILE  39          2HD1      ILE  39  -0.360   0.125  -3.520
  328    H    TYR  40           HN       TYR  40  -4.298  -1.832  -5.177
  329    HA   TYR  40           HA       TYR  40  -6.513  -2.830  -3.496
  330    HB2  TYR  40           2HB      TYR  40  -6.725  -2.782  -5.984
  331    HB3  TYR  40           3HB      TYR  40  -5.376  -3.924  -6.093
  332    HD1  TYR  40           1HD      TYR  40  -8.914  -3.517  -5.168
  333    HD2  TYR  40           2HD      TYR  40  -5.676  -6.270  -5.475
  334    HE1  TYR  40           1HE      TYR  40 -10.483  -5.392  -4.929
  335    HE2  TYR  40           2HE      TYR  40  -7.243  -8.142  -5.239
  336    HH   TYR  40           HH       TYR  40  -9.401  -8.781  -4.970
  337    H    ILE  41           HN       ILE  41  -5.702  -3.758  -1.673
  338    HA   ILE  41           HA       ILE  41  -3.169  -5.135  -1.677
  339    HB   ILE  41           HB       ILE  41  -5.334  -5.333   0.445
  340   HG12  ILE  41          2HG1      ILE  41  -3.164  -3.228   0.162
  341   HG13  ILE  41          3HG1      ILE  41  -4.887  -2.969  -0.204
  342   HG21  ILE  41          1HG2      ILE  41  -3.403  -5.651   1.946
  343   HG22  ILE  41          2HG2      ILE  41  -3.431  -6.882   0.660
  344   HG23  ILE  41          3HG2      ILE  41  -2.299  -5.512   0.556
  345   HD11  ILE  41          3HD1      ILE  41  -3.731  -3.692   2.498
  346   HD12  ILE  41          1HD1      ILE  41  -4.303  -2.082   2.014
  347   HD13  ILE  41          2HD1      ILE  41  -5.453  -3.431   2.132
  348    H    ARG  42           HN       ARG  42  -2.908  -6.980  -2.721
  349    HA   ARG  42           HA       ARG  42  -5.215  -8.649  -3.322
  350    HB2  ARG  42           2HB      ARG  42  -3.598  -8.250  -5.063
  351    HB3  ARG  42           3HB      ARG  42  -2.268  -8.823  -4.028
  352    HG2  ARG  42           2HG      ARG  42  -2.719 -10.557  -5.572
  353    HG3  ARG  42           3HG      ARG  42  -3.405 -11.080  -4.015
  354    HD2  ARG  42           2HD      ARG  42  -5.029 -11.611  -5.653
  355    HD3  ARG  42           3HD      ARG  42  -5.624 -10.153  -4.829
  356    HE   ARG  42           HE       ARG  42  -4.960  -8.845  -6.758
  357   HH11  ARG  42          2HH1      ARG  42  -4.929 -12.347  -7.148
  358   HH12  ARG  42          1HH1      ARG  42  -4.994 -12.280  -8.895
  359   HH21  ARG  42          2HH2      ARG  42  -5.028  -8.767  -9.035
  360   HH22  ARG  42          1HH2      ARG  42  -5.050 -10.250  -9.964
  361    H    LYS  43           HN       LYS  43  -2.076  -9.133  -1.604
  362    HA   LYS  43           HA       LYS  43  -3.278 -11.421  -0.190
  363    HB2  LYS  43           2HB      LYS  43  -2.495 -12.192  -2.464
  364    HB3  LYS  43           3HB      LYS  43  -0.845 -11.745  -1.970
  365    HG2  LYS  43           2HG      LYS  43  -0.884 -13.404  -0.204
  366    HG3  LYS  43           3HG      LYS  43  -2.577 -13.805  -0.582
  367    HD2  LYS  43           2HD      LYS  43  -1.862 -14.436  -2.885
  368    HD3  LYS  43           3HD      LYS  43  -0.174 -14.149  -2.402
  369    HE2  LYS  43           2HE      LYS  43  -0.327 -15.907  -0.723
  370    HE3  LYS  43           3HE      LYS  43  -2.041 -16.164  -1.118
  371    HZ1  LYS  43           3HZ      LYS  43   0.223 -16.559  -2.965
  372    HZ2  LYS  43           1HZ      LYS  43  -0.627 -17.758  -2.214
  373    HZ3  LYS  43           2HZ      LYS  43  -1.368 -16.797  -3.332
  374    H    VAL  44           HN       VAL  44  -2.375 -11.778   1.757
  375    HA   VAL  44           HA       VAL  44   0.178 -10.356   2.341
  376    HB   VAL  44           HB       VAL  44  -2.046 -11.100   4.283
  377   HG11  VAL  44          1HG1      VAL  44  -0.773  -9.775   5.920
  378   HG12  VAL  44          2HG1      VAL  44   0.180 -11.145   5.309
  379   HG13  VAL  44          3HG1      VAL  44   0.498  -9.501   4.708
  380   HG21  VAL  44          3HG2      VAL  44  -2.711  -9.270   2.793
  381   HG22  VAL  44          1HG2      VAL  44  -2.460  -8.680   4.452
  382   HG23  VAL  44          2HG2      VAL  44  -1.225  -8.384   3.207
  383    H    ALA  45           HN       ALA  45   1.856 -11.677   2.595
  384    HA   ALA  45           HA       ALA  45   1.510 -14.527   2.692
  385    HB1  ALA  45           1HB      ALA  45   3.967 -14.581   2.837
  386    HB2  ALA  45           2HB      ALA  45   3.416 -13.451   1.578
  387    HB3  ALA  45           3HB      ALA  45   3.986 -12.829   3.145
  388    HA   PRO  46           HA       PRO  46   1.119 -15.355   6.977
  389    HB2  PRO  46           2HB      PRO  46   2.896 -17.740   6.537
  390    HB3  PRO  46           3HB      PRO  46   1.194 -17.638   7.093
  391    HG2  PRO  46           2HG      PRO  46   1.832 -18.498   4.658
  392    HG3  PRO  46           3HG      PRO  46   0.320 -17.588   4.980
  393    HD2  PRO  46           2HD      PRO  46   2.921 -16.702   3.726
  394    HD3  PRO  46           3HD      PRO  46   1.241 -16.227   3.331
  395    H    LEU  47           HN       LEU  47   4.237 -14.953   5.502
  396    HA   LEU  47           HA       LEU  47   5.684 -15.102   8.054
  397    HB2  LEU  47           2HB      LEU  47   6.659 -14.078   5.376
  398    HB3  LEU  47           3HB      LEU  47   7.640 -14.618   6.760
  399    HG   LEU  47           HG       LEU  47   5.850 -16.373   5.066
  400   HD11  LEU  47          1HD1      LEU  47   7.952 -17.326   4.214
  401   HD12  LEU  47          2HD1      LEU  47   7.826 -15.591   3.845
  402   HD13  LEU  47          3HD1      LEU  47   8.873 -16.145   5.174
  403   HD21  LEU  47          3HD2      LEU  47   6.028 -17.147   7.385
  404   HD22  LEU  47          1HD2      LEU  47   6.900 -18.237   6.283
  405   HD23  LEU  47          2HD2      LEU  47   7.803 -17.074   7.279
  406    H    GLY  48           HN       GLY  48   3.581 -12.964   6.771
  407    HA2  GLY  48           1HA      GLY  48   3.166 -10.847   7.767
  408    HA3  GLY  48           2HA      GLY  48   4.896 -10.703   8.156
  409    H    ASP  49           HN       ASP  49   5.792 -11.582   5.566
  410    HA   ASP  49           HA       ASP  49   4.618  -9.806   3.580
  411    HB2  ASP  49           2HB      ASP  49   6.530  -8.446   3.177
  412    HB3  ASP  49           3HB      ASP  49   6.158  -8.324   4.910
  413    HD2  ASP  49           2HD      ASP  49   9.737  -8.854   4.421
  414    HA   PRO  50           HA       PRO  50   6.295  -8.899   1.719
  415    HB2  PRO  50           2HB      PRO  50   5.809  -9.231  -0.955
  416    HB3  PRO  50           3HB      PRO  50   7.432  -9.481  -0.232
  417    HG2  PRO  50           2HG      PRO  50   5.358 -11.528  -0.885
  418    HG3  PRO  50           3HG      PRO  50   7.098 -11.529  -1.319
  419    HD2  PRO  50           2HD      PRO  50   6.097 -12.912   0.805
  420    HD3  PRO  50           3HD      PRO  50   7.712 -12.144   0.853
  421    H    ILE  51           HN       ILE  51   4.615  -7.501   1.243
  422    HA   ILE  51           HA       ILE  51   1.928  -8.717   1.270
  423    HB   ILE  51           HB       ILE  51   2.790  -5.806   1.515
  424   HG12  ILE  51          2HG1      ILE  51   1.795  -7.790   3.588
  425   HG13  ILE  51          3HG1      ILE  51   3.467  -7.202   3.419
  426   HG21  ILE  51          1HG2      ILE  51   0.454  -5.389   2.180
  427   HG22  ILE  51          2HG2      ILE  51   0.550  -6.042   0.528
  428   HG23  ILE  51          3HG2      ILE  51   0.061  -7.097   1.875
  429   HD11  ILE  51          3HD1      ILE  51   1.050  -5.514   4.115
  430   HD12  ILE  51          1HD1      ILE  51   2.300  -6.054   5.257
  431   HD13  ILE  51          2HD1      ILE  51   2.722  -4.929   3.949
  432    H    GLN  52           HN       GLN  52   1.095  -9.218  -0.615
  433    HA   GLN  52           HA       GLN  52   2.190  -8.020  -3.056
  434    HB2  GLN  52           2HB      GLN  52   1.547 -10.528  -2.512
  435    HB3  GLN  52           3HB      GLN  52  -0.075  -9.986  -3.009
  436    HG2  GLN  52           2HG      GLN  52   0.824  -9.272  -5.171
  437    HG3  GLN  52           3HG      GLN  52   2.445  -9.805  -4.675
  438   HE21  GLN  52          1HE2      GLN  52   2.734 -11.365  -6.227
  439   HE22  GLN  52          2HE2      GLN  52   1.792 -12.839  -6.288
  440    H    ILE  53           HN       ILE  53   1.373  -6.157  -3.759
  441    HA   ILE  53           HA       ILE  53  -1.556  -5.771  -3.435
  442    HB   ILE  53           HB       ILE  53  -1.120  -3.320  -3.366
  443   HG12  ILE  53          2HG1      ILE  53   1.785  -4.139  -3.063
  444   HG13  ILE  53          3HG1      ILE  53   1.073  -3.379  -4.507
  445   HG21  ILE  53          1HG2      ILE  53  -0.317  -3.263  -1.040
  446   HG22  ILE  53          2HG2      ILE  53  -1.461  -4.602  -1.301
  447   HG23  ILE  53          3HG2      ILE  53   0.286  -4.929  -1.208
  448   HD11  ILE  53          3HD1      ILE  53   1.235  -2.146  -1.746
  449   HD12  ILE  53          1HD1      ILE  53   2.268  -1.728  -3.129
  450   HD13  ILE  53          2HD1      ILE  53   0.527  -1.387  -3.192
  451    H    ASN  54           HN       ASN  54  -2.665  -4.714  -5.094
  452    HA   ASN  54           HA       ASN  54  -1.315  -4.955  -7.710
  453    HB2  ASN  54           2HB      ASN  54  -4.226  -4.739  -6.900
  454    HB3  ASN  54           3HB      ASN  54  -3.678  -4.639  -8.588
  455   HD21  ASN  54          1HD2      ASN  54  -1.506  -6.547  -8.279
  456   HD22  ASN  54          2HD2      ASN  54  -2.246  -8.129  -8.149
  457    H    VAL  55           HN       VAL  55  -0.305  -3.230  -8.362
  458    HA   VAL  55           HA       VAL  55  -1.617  -0.594  -7.928
  459    HB   VAL  55           HB       VAL  55   1.325  -1.207  -8.391
  460   HG11  VAL  55          1HG1      VAL  55   1.686   1.185  -7.934
  461   HG12  VAL  55          2HG1      VAL  55   0.649   0.944  -9.359
  462   HG13  VAL  55          3HG1      VAL  55  -0.072   1.423  -7.804
  463   HG21  VAL  55          3HG2      VAL  55   0.559  -1.883  -6.164
  464   HG22  VAL  55          1HG2      VAL  55   1.630  -0.466  -6.067
  465   HG23  VAL  55          2HG2      VAL  55  -0.129  -0.263  -5.902
  466    H    ARG  56           HN       ARG  56  -2.531   0.196  -9.648
  467    HA   ARG  56           HA       ARG  56  -3.010   0.745 -11.797
  468    HB2  ARG  56           2HB      ARG  56  -0.171  -0.065 -12.491
  469    HB3  ARG  56           3HB      ARG  56  -1.259   0.979 -13.438
  470    HG2  ARG  56           2HG      ARG  56   0.136   1.579 -10.831
  471    HG3  ARG  56           3HG      ARG  56   0.270   2.430 -12.389
  472    HD2  ARG  56           2HD      ARG  56  -2.175   2.351 -10.597
  473    HD3  ARG  56           3HD      ARG  56  -1.050   3.715 -10.773
  474    HE   ARG  56           HE       ARG  56  -2.555   2.717 -13.131
  475   HH11  ARG  56          2HH1      ARG  56  -1.658   5.264 -10.886
  476   HH12  ARG  56          1HH1      ARG  56  -2.555   6.507 -11.729
  477   HH21  ARG  56          2HH2      ARG  56  -3.786   4.332 -14.200
  478   HH22  ARG  56          1HH2      ARG  56  -3.763   5.977 -13.610
  479    H    GLY  57           HN       GLY  57  -2.778  -2.232 -10.717
  480    HA2  GLY  57           1HA      GLY  57  -4.083  -3.958 -11.778
  481    HA3  GLY  57           2HA      GLY  57  -3.504  -3.387 -13.359
  482    H    TYR  58           HN       TYR  58  -0.829  -3.199 -11.506
  483    HA   TYR  58           HA       TYR  58   0.076  -5.874 -12.411
  484    HB2  TYR  58           2HB      TYR  58   1.584  -3.393 -11.521
  485    HB3  TYR  58           3HB      TYR  58   2.359  -4.932 -11.935
  486    HD1  TYR  58           1HD      TYR  58   0.472  -2.049 -13.285
  487    HD2  TYR  58           2HD      TYR  58   2.588  -5.624 -14.246
  488    HE1  TYR  58           1HE      TYR  58   0.521  -1.386 -15.649
  489    HE2  TYR  58           2HE      TYR  58   2.642  -4.958 -16.607
  490    HH   TYR  58           HH       TYR  58   2.058  -3.403 -18.154
  491    H    GLU  59           HN       GLU  59   1.400  -7.205 -11.003
  492    HA   GLU  59           HA       GLU  59   0.643  -6.851  -8.150
  493    HB2  GLU  59           2HB      GLU  59   1.869  -9.305  -9.442
  494    HB3  GLU  59           3HB      GLU  59   1.121  -9.179  -7.833
  495    HG2  GLU  59           2HG      GLU  59  -0.497 -10.267  -9.071
  496    HG3  GLU  59           3HG      GLU  59  -1.030  -8.573  -9.129
  497    HE2  GLU  59           2HE      GLU  59   0.795  -9.397 -12.507
  498    H    LEU  60           HN       LEU  60   2.144  -5.895  -6.920
  499    HA   LEU  60           HA       LEU  60   4.956  -6.747  -7.325
  500    HB2  LEU  60           2HB      LEU  60   5.610  -4.370  -6.690
  501    HB3  LEU  60           3HB      LEU  60   5.010  -4.653  -8.343
  502    HG   LEU  60           HG       LEU  60   2.717  -3.905  -7.305
  503   HD11  LEU  60          1HD1      LEU  60   2.976  -2.176  -5.578
  504   HD12  LEU  60          2HD1      LEU  60   3.508  -3.769  -4.994
  505   HD13  LEU  60          3HD1      LEU  60   4.712  -2.548  -5.471
  506   HD21  LEU  60          3HD2      LEU  60   3.920  -2.778  -9.117
  507   HD22  LEU  60          1HD2      LEU  60   3.220  -1.597  -7.986
  508   HD23  LEU  60          2HD2      LEU  60   4.959  -1.959  -7.926
  509    H    SER  61           HN       SER  61   6.305  -6.493  -5.403
  510    HA   SER  61           HA       SER  61   4.598  -7.125  -3.048
  511    HB2  SER  61           2HB      SER  61   7.465  -7.976  -3.597
  512    HB3  SER  61           3HB      SER  61   6.380  -8.590  -2.325
  513    HG   SER  61           HG       SER  61   6.495  -9.987  -4.149
  514    H    LEU  62           HN       LEU  62   4.780  -6.041  -1.202
  515    HA   LEU  62           HA       LEU  62   7.101  -4.201  -0.888
  516    HB2  LEU  62           2HB      LEU  62   4.226  -4.035  -0.081
  517    HB3  LEU  62           3HB      LEU  62   5.446  -3.299   0.987
  518    HG   LEU  62           HG       LEU  62   4.497  -1.632  -0.484
  519   HD11  LEU  62          1HD1      LEU  62   6.567  -0.757  -1.486
  520   HD12  LEU  62          2HD1      LEU  62   6.859  -1.420   0.138
  521   HD13  LEU  62          3HD1      LEU  62   7.328  -2.355  -1.303
  522   HD21  LEU  62          3HD2      LEU  62   3.804  -3.088  -2.327
  523   HD22  LEU  62          1HD2      LEU  62   4.781  -1.727  -2.925
  524   HD23  LEU  62          2HD2      LEU  62   5.508  -3.343  -2.775
  525    H    ARG  63           HN       ARG  63   8.336  -4.302   0.943
  526    HA   ARG  63           HA       ARG  63   8.126  -6.724   2.550
  527    HB2  ARG  63           2HB      ARG  63   9.952  -4.307   2.776
  528    HB3  ARG  63           3HB      ARG  63  10.121  -5.821   3.695
  529    HG2  ARG  63           2HG      ARG  63  10.213  -5.658   0.674
  530    HG3  ARG  63           3HG      ARG  63  11.653  -5.600   1.721
  531    HD2  ARG  63           2HD      ARG  63   9.638  -7.866   1.743
  532    HD3  ARG  63           3HD      ARG  63  11.117  -7.868   0.758
  533    HE   ARG  63           HE       ARG  63  11.249  -7.559   3.714
  534   HH11  ARG  63          2HH1      ARG  63  11.999  -9.364   0.784
  535   HH12  ARG  63          1HH1      ARG  63  13.196 -10.374   1.563
  536   HH21  ARG  63          2HH2      ARG  63  12.835  -8.851   4.712
  537   HH22  ARG  63          1HH2      ARG  63  13.671 -10.082   3.791
  538    H    LYS  64           HN       LYS  64   8.097  -6.634   4.967
  539    HA   LYS  64           HA       LYS  64   5.713  -5.378   5.792
  540    HB2  LYS  64           2HB      LYS  64   6.287  -6.066   8.063
  541    HB3  LYS  64           3HB      LYS  64   6.588  -7.368   6.889
  542    HG2  LYS  64           2HG      LYS  64   8.941  -5.707   7.375
  543    HG3  LYS  64           3HG      LYS  64   8.323  -6.491   8.849
  544    HD2  LYS  64           2HD      LYS  64   8.876  -7.956   6.255
  545    HD3  LYS  64           3HD      LYS  64  10.046  -7.815   7.590
  546    HE2  LYS  64           2HE      LYS  64   8.471  -8.937   9.099
  547    HE3  LYS  64           3HE      LYS  64   7.281  -9.056   7.785
  548    HZ1  LYS  64           3HZ      LYS  64   9.944 -10.313   7.803
  549    HZ2  LYS  64           1HZ      LYS  64   8.512 -11.091   8.053
  550    HZ3  LYS  64           2HZ      LYS  64   8.839 -10.422   6.583
  551    H    SER  65           HN       SER  65   9.105  -4.303   6.152
  552    HA   SER  65           HA       SER  65   8.405  -2.060   7.834
  553    HB2  SER  65           2HB      SER  65  10.884  -2.584   6.153
  554    HB3  SER  65           3HB      SER  65  10.719  -1.321   7.397
  555    HG   SER  65           HG       SER  65  11.723  -3.230   8.195
  556    H    ALA  66           HN       ALA  66   8.762  -2.595   4.349
  557    HA   ALA  66           HA       ALA  66   8.753   0.194   3.649
  558    HB1  ALA  66           1HB      ALA  66   8.379  -0.619   1.358
  559    HB2  ALA  66           2HB      ALA  66   9.668  -1.538   2.171
  560    HB3  ALA  66           3HB      ALA  66   8.045  -2.249   1.991
  561    H    ALA  67           HN       ALA  67   6.256  -2.304   3.991
  562    HA   ALA  67           HA       ALA  67   4.067  -0.861   2.932
  563    HB1  ALA  67           1HB      ALA  67   2.687  -2.366   4.310
  564    HB2  ALA  67           2HB      ALA  67   4.003  -3.254   3.507
  565    HB3  ALA  67           3HB      ALA  67   4.131  -2.842   5.234
  566    H    GLU  68           HN       GLU  68   5.660  -0.774   6.060
  567    HA   GLU  68           HA       GLU  68   3.545   0.696   7.369
  568    HB2  GLU  68           2HB      GLU  68   5.131  -0.851   8.499
  569    HB3  GLU  68           3HB      GLU  68   6.441   0.308   8.171
  570    HG2  GLU  68           2HG      GLU  68   5.262   1.996   9.501
  571    HG3  GLU  68           3HG      GLU  68   3.980   0.817   9.848
  572    HE2  GLU  68           2HE      GLU  68   7.522   0.125  11.546
  573    H    MET  69           HN       MET  69   6.155   1.524   5.274
  574    HA   MET  69           HA       MET  69   6.365   4.281   6.215
  575    HB2  MET  69           2HB      MET  69   7.360   2.938   3.679
  576    HB3  MET  69           3HB      MET  69   7.755   4.596   4.193
  577    HG2  MET  69           2HG      MET  69   8.460   2.065   5.699
  578    HG3  MET  69           3HG      MET  69   9.563   2.995   4.670
  579    HE1  MET  69           3HE      MET  69  11.295   3.120   6.681
  580    HE2  MET  69           1HE      MET  69  10.886   3.715   8.306
  581    HE3  MET  69           2HE      MET  69  10.171   2.200   7.709
  582    H    ILE  70           HN       ILE  70   4.125   2.507   4.454
  583    HA   ILE  70           HA       ILE  70   3.416   4.773   2.695
  584    HB   ILE  70           HB       ILE  70   2.334   1.928   2.766
  585   HG12  ILE  70          2HG1      ILE  70   4.292   3.241   0.854
  586   HG13  ILE  70          3HG1      ILE  70   4.723   2.085   2.138
  587   HG21  ILE  70          1HG2      ILE  70   1.353   2.488   0.581
  588   HG22  ILE  70          2HG2      ILE  70   0.730   3.551   1.864
  589   HG23  ILE  70          3HG2      ILE  70   1.966   4.151   0.732
  590   HD11  ILE  70          3HD1      ILE  70   2.946   1.516  -0.246
  591   HD12  ILE  70          1HD1      ILE  70   4.629   0.983  -0.060
  592   HD13  ILE  70          2HD1      ILE  70   3.378   0.359   1.036
  593    H    GLU  71           HN       GLU  71   2.230   6.242   3.714
  594    HA   GLU  71           HA       GLU  71   0.241   5.566   5.727
  595    HB2  GLU  71           2HB      GLU  71   1.556   7.691   5.662
  596    HB3  GLU  71           3HB      GLU  71   0.684   8.139   4.177
  597    HG2  GLU  71           2HG      GLU  71  -0.453   9.313   5.801
  598    HG3  GLU  71           3HG      GLU  71  -1.444   7.849   5.620
  599    HE2  GLU  71           2HE      GLU  71  -1.184   7.495   9.023
  600    H    VAL  72           HN       VAL  72  -1.738   4.778   5.266
  601    HA   VAL  72           HA       VAL  72  -2.844   5.434   2.584
  602    HB   VAL  72           HB       VAL  72  -3.886   3.200   2.521
  603   HG11  VAL  72          1HG1      VAL  72  -1.857   1.894   2.059
  604   HG12  VAL  72          2HG1      VAL  72  -1.728   3.549   1.423
  605   HG13  VAL  72          3HG1      VAL  72  -0.884   3.102   2.926
  606   HG21  VAL  72          3HG2      VAL  72  -4.036   2.790   4.932
  607   HG22  VAL  72          1HG2      VAL  72  -3.207   1.448   4.110
  608   HG23  VAL  72          2HG2      VAL  72  -2.264   2.648   5.026
  609    H    GLU  73           HN       GLU  73  -5.253   4.638   2.544
  610    HA   GLU  73           HA       GLU  73  -6.685   5.045   5.066
  611    HB2  GLU  73           2HB      GLU  73  -6.373   7.348   4.293
  612    HB3  GLU  73           3HB      GLU  73  -7.032   6.914   2.697
  613    HG2  GLU  73           2HG      GLU  73  -8.673   8.101   4.074
  614    HG3  GLU  73           3HG      GLU  73  -9.202   6.449   3.689
  615    HE2  GLU  73           2HE      GLU  73  -8.506   7.396   7.475
  616    H    LEU  74           HN       LEU  74  -8.766   4.155   4.991
  617    HA   LEU  74           HA       LEU  74  -9.113   2.187   2.870
  618    HB2  LEU  74           2HB      LEU  74 -10.112   2.671   5.572
  619    HB3  LEU  74           3HB      LEU  74 -11.408   2.177   4.454
  620    HG   LEU  74           HG       LEU  74 -10.509   0.261   5.635
  621   HD11  LEU  74          1HD1      LEU  74  -9.960  -1.156   3.703
  622   HD12  LEU  74          2HD1      LEU  74 -11.298  -0.044   3.336
  623   HD13  LEU  74          3HD1      LEU  74  -9.661   0.298   2.723
  624   HD21  LEU  74          3HD2      LEU  74  -8.264   1.121   6.096
  625   HD22  LEU  74          1HD2      LEU  74  -8.188  -0.476   5.318
  626   HD23  LEU  74          2HD2      LEU  74  -7.854   0.989   4.369
  627    H    GLU  75           HN       GLU  75 -10.640   2.145   1.272
  628    HA   GLU  75           HA       GLU  75 -12.106   4.639   0.796
  629    HB2  GLU  75           2HB      GLU  75 -12.833   3.528  -1.298
  630    HB3  GLU  75           3HB      GLU  75 -11.066   3.621  -1.111
  631    HG2  GLU  75           2HG      GLU  75 -11.368   1.498  -1.955
  632    HG3  GLU  75           3HG      GLU  75 -11.266   1.205  -0.206
  633    HE2  GLU  75           2HE      GLU  75 -14.833   0.731  -1.920
  634    H    HIS  76           HN       HIS  76 -12.583   1.806   2.525
  635    HA   HIS  76           HA       HIS  76 -15.507   1.746   2.085
  636    HB2  HIS  76           2HB      HIS  76 -14.012  -0.329   2.186
  637    HB3  HIS  76           3HB      HIS  76 -13.857  -0.005   3.923
  638    HD1  HIS  76           1HD      HIS  76 -16.387  -1.009   1.302
  639    HD2  HIS  76           2HD      HIS  76 -16.038  -0.777   5.459
  640    HE1  HIS  76           1HE      HIS  76 -18.403  -2.221   2.248
  641    HE2  HIS  76           2HE      HIS  76 -18.182  -2.079   4.771
  642    H    HIS  77           HN       HIS  77 -16.207   3.641   3.068
  643    HA   HIS  77           HA       HIS  77 -15.809   3.748   6.022
  644    HB2  HIS  77           2HB      HIS  77 -15.702   5.954   3.964
  645    HB3  HIS  77           3HB      HIS  77 -16.172   6.301   5.638
  646    HD1  HIS  77           1HD      HIS  77 -13.862   7.835   5.220
  647    HD2  HIS  77           2HD      HIS  77 -13.436   3.720   5.820
  648    HE1  HIS  77           1HE      HIS  77 -11.460   7.470   5.929
  649    HE2  HIS  77           2HE      HIS  77 -11.206   4.973   6.295
  650    H    HIS  78           HN       HIS  78 -17.573   4.589   7.248
  651    HA   HIS  78           HA       HIS  78 -20.132   4.712   5.734
  652    HB2  HIS  78           2HB      HIS  78 -19.530   3.220   8.297
  653    HB3  HIS  78           3HB      HIS  78 -21.179   3.658   7.810
  654    HD1  HIS  78           1HD      HIS  78 -21.933   2.681   5.385
  655    HD2  HIS  78           2HD      HIS  78 -18.651   0.873   7.226
  656    HE1  HIS  78           1HE      HIS  78 -21.645   0.433   4.258
  657    HE2  HIS  78           2HE      HIS  78 -19.649  -0.666   5.378
  658    H    HIS  79           HN       HIS  79 -21.023   6.600   5.918
  659    HA   HIS  79           HA       HIS  79 -22.040   8.413   6.836
  660    HB2  HIS  79           2HB      HIS  79 -22.643   6.766   8.671
  661    HB3  HIS  79           3HB      HIS  79 -21.266   7.410   9.586
  662    HD1  HIS  79           1HD      HIS  79 -21.909   9.180  11.202
  663    HD2  HIS  79           2HD      HIS  79 -24.450   9.090   7.886
  664    HE1  HIS  79           1HE      HIS  79 -23.661  10.968  11.603
  665    HE2  HIS  79           2HE      HIS  79 -25.200  10.908   9.586
  666    H    HIS  80           HN       HIS  80 -18.798   7.781   7.065
  667    HA   HIS  80           HA       HIS  80 -18.266  10.660   7.283
  668    HB2  HIS  80           2HB      HIS  80 -18.004   9.816   9.613
  669    HB3  HIS  80           3HB      HIS  80 -16.800   8.651   9.032
  670    HD1  HIS  80           1HD      HIS  80 -14.446   9.411   9.255
  671    HD2  HIS  80           2HD      HIS  80 -17.106  12.619   8.955
  672    HE1  HIS  80           1HE      HIS  80 -13.050  11.512   9.504
  673    HE2  HIS  80           2HE      HIS  80 -14.671  13.458   9.316
  674    H    HIS  81           HN       HIS  81 -17.412  10.929   5.327
  675    HA   HIS  81           HA       HIS  81 -15.917   8.767   4.061
  676    HB2  HIS  81           2HB      HIS  81 -17.559  10.269   2.876
  677    HB3  HIS  81           3HB      HIS  81 -16.398  11.594   3.076
  678    HD1  HIS  81           1HD      HIS  81 -14.798  11.904   1.204
  679    HD2  HIS  81           2HD      HIS  81 -16.338   8.021   1.333
  680    HE1  HIS  81           1HE      HIS  81 -13.898  10.714  -0.849
  681    HE2  HIS  81           2HE      HIS  81 -14.835   8.360  -0.761
  Start of MODEL   20
    1    H1   MET   1           HN       MET   1  -3.018   5.538  13.965
    2    HA   MET   1           HA       MET   1  -1.468   6.371  11.742
    3    HB2  MET   1           2HB      MET   1   0.450   6.294  13.243
    4    HB3  MET   1           3HB      MET   1   0.042   4.627  13.716
    5    HG2  MET   1           2HG      MET   1   1.901   4.711  12.106
    6    HG3  MET   1           3HG      MET   1   0.498   3.837  11.468
    7    HE1  MET   1           3HE      MET   1   1.391   3.984   9.002
    8    HE2  MET   1           1HE      MET   1   1.946   5.486   8.229
    9    HE3  MET   1           2HE      MET   1   2.851   4.806   9.601
   10    H    PHE   2           HN       PHE   2  -2.585   5.322  10.264
   11    HA   PHE   2           HA       PHE   2  -2.996   2.394  10.646
   12    HB2  PHE   2           2HB      PHE   2  -5.079   3.679  10.337
   13    HB3  PHE   2           3HB      PHE   2  -4.449   4.337   8.818
   14    HD1  PHE   2           2HD      PHE   2  -5.322   1.122  10.495
   15    HD2  PHE   2           1HD      PHE   2  -4.802   3.192   6.811
   16    HE1  PHE   2           2HE      PHE   2  -6.232  -0.809   9.282
   17    HE2  PHE   2           1HE      PHE   2  -5.702   1.259   5.594
   18    HZ   PHE   2           HZ       PHE   2  -6.420  -0.747   6.827
   19    H    SER   3           HN       SER   3  -1.465   1.262   9.661
   20    HA   SER   3           HA       SER   3  -0.014   2.534   7.420
   21    HB2  SER   3           2HB      SER   3   0.650  -0.047   8.875
   22    HB3  SER   3           3HB      SER   3   1.730   0.968   7.889
   23    HG   SER   3           HG       SER   3   2.022   1.290  10.148
   24    H    LEU   4           HN       LEU   4   0.534   1.282   5.522
   25    HA   LEU   4           HA       LEU   4  -1.622  -0.158   4.350
   26    HB2  LEU   4           2HB      LEU   4   0.387   1.030   3.273
   27    HB3  LEU   4           3HB      LEU   4   1.291  -0.464   3.616
   28    HG   LEU   4           HG       LEU   4   0.446  -0.247   1.288
   29   HD11  LEU   4          1HD1      LEU   4  -0.381  -2.549   1.100
   30   HD12  LEU   4          2HD1      LEU   4   0.991  -2.431   2.223
   31   HD13  LEU   4          3HD1      LEU   4  -0.666  -2.585   2.853
   32   HD21  LEU   4          3HD2      LEU   4  -1.674   0.866   1.785
   33   HD22  LEU   4          1HD2      LEU   4  -1.943  -0.622   0.848
   34   HD23  LEU   4          2HD2      LEU   4  -2.265  -0.604   2.597
   35    H    ARG   5           HN       ARG   5   1.353  -1.123   5.970
   36    HA   ARG   5           HA       ARG   5   1.340  -3.865   5.961
   37    HB2  ARG   5           2HB      ARG   5   2.967  -2.481   7.135
   38    HB3  ARG   5           3HB      ARG   5   1.724  -1.956   8.295
   39    HG2  ARG   5           2HG      ARG   5   1.540  -4.525   8.792
   40    HG3  ARG   5           3HG      ARG   5   3.177  -4.561   8.093
   41    HD2  ARG   5           2HD      ARG   5   3.237  -4.269  10.543
   42    HD3  ARG   5           3HD      ARG   5   3.921  -2.865   9.696
   43    HE   ARG   5           HE       ARG   5   1.081  -2.628  10.325
   44   HH11  ARG   5          2HH1      ARG   5   4.361  -2.099  11.512
   45   HH12  ARG   5          1HH1      ARG   5   3.881  -0.838  12.624
   46   HH21  ARG   5          2HH2      ARG   5   0.479  -0.978  11.746
   47   HH22  ARG   5          1HH2      ARG   5   1.680  -0.203  12.756
   48    H    ASP   6           HN       ASP   6  -1.084  -1.791   7.416
   49    HA   ASP   6           HA       ASP   6  -2.118  -4.044   9.035
   50    HB2  ASP   6           2HB      ASP   6  -2.749  -1.074   9.068
   51    HB3  ASP   6           3HB      ASP   6  -3.517  -2.287  10.115
   52    HD2  ASP   6           2HD      ASP   6  -0.408  -2.745  11.836
   53    H    ALA   7           HN       ALA   7  -2.546  -2.827   5.982
   54    HA   ALA   7           HA       ALA   7  -5.437  -2.923   5.856
   55    HB1  ALA   7           1HB      ALA   7  -5.100  -2.855   3.421
   56    HB2  ALA   7           2HB      ALA   7  -4.110  -1.629   4.248
   57    HB3  ALA   7           3HB      ALA   7  -3.358  -3.129   3.655
   58    H    LYS   8           HN       LYS   8  -6.742  -4.525   4.866
   59    HA   LYS   8           HA       LYS   8  -5.603  -7.231   5.238
   60    HB2  LYS   8           2HB      LYS   8  -8.292  -6.020   5.533
   61    HB3  LYS   8           3HB      LYS   8  -8.247  -7.670   4.869
   62    HG2  LYS   8           2HG      LYS   8  -8.535  -7.730   7.281
   63    HG3  LYS   8           3HG      LYS   8  -6.957  -8.414   6.827
   64    HD2  LYS   8           2HD      LYS   8  -6.636  -7.036   8.760
   65    HD3  LYS   8           3HD      LYS   8  -5.921  -6.197   7.362
   66    HE2  LYS   8           2HE      LYS   8  -7.891  -4.768   7.180
   67    HE3  LYS   8           3HE      LYS   8  -8.671  -5.639   8.518
   68    HZ1  LYS   8           3HZ      LYS   8  -6.184  -4.076   8.710
   69    HZ2  LYS   8           1HZ      LYS   8  -7.664  -3.597   9.255
   70    HZ3  LYS   8           2HZ      LYS   8  -6.908  -4.884   9.953
   71    H    CYS   9           HN       CYS   9  -6.543  -8.949   3.789
   72    HA   CYS   9           HA       CYS   9  -5.673  -8.226   1.113
   73    HB2  CYS   9           2HB      CYS   9  -6.100 -10.720   0.751
   74    HB3  CYS   9           3HB      CYS   9  -4.859 -10.262   1.945
   75    HG   CYS   9           HG       CYS   9  -6.121 -12.406   2.749
   76    H    GLY  10           HN       GLY  10  -8.307  -7.165   2.090
   77    HA2  GLY  10           1HA      GLY  10  -9.769  -7.876  -0.361
   78    HA3  GLY  10           2HA      GLY  10 -10.591  -8.213   1.179
   79    H    GLN  11           HN       GLN  11  -8.389  -5.557   1.073
   80    HA   GLN  11           HA       GLN  11 -10.729  -3.714   1.129
   81    HB2  GLN  11           2HB      GLN  11  -8.081  -3.597   2.604
   82    HB3  GLN  11           3HB      GLN  11  -9.270  -2.273   2.569
   83    HG2  GLN  11           2HG      GLN  11 -10.902  -3.648   3.700
   84    HG3  GLN  11           3HG      GLN  11  -9.818  -5.055   3.627
   85   HE21  GLN  11          1HE2      GLN  11 -11.056  -3.635   5.944
   86   HE22  GLN  11          2HE2      GLN  11  -9.716  -3.178   6.975
   87    H    THR  12           HN       THR  12 -10.671  -1.855  -0.061
   88    HA   THR  12           HA       THR  12  -8.433  -1.550  -1.942
   89    HB   THR  12           HB       THR  12 -10.986   0.083  -1.636
   90    HG1  THR  12           1HG      THR  12 -11.595  -1.109  -3.522
   91   HG21  THR  12          3HG2      THR  12  -8.920   0.025  -3.867
   92   HG22  THR  12          1HG2      THR  12 -10.436   0.953  -3.881
   93   HG23  THR  12          2HG2      THR  12  -9.164   1.351  -2.705
   94    H    VAL  13           HN       VAL  13  -6.712  -0.364  -1.447
   95    HA   VAL  13           HA       VAL  13  -7.052   1.702   0.664
   96    HB   VAL  13           HB       VAL  13  -4.640   1.386   1.164
   97   HG11  VAL  13          1HG1      VAL  13  -4.864  -0.770   2.324
   98   HG12  VAL  13          2HG1      VAL  13  -6.340   0.210   2.478
   99   HG13  VAL  13          3HG1      VAL  13  -6.290  -1.154   1.335
  100   HG21  VAL  13          3HG2      VAL  13  -3.924   0.541  -1.023
  101   HG22  VAL  13          1HG2      VAL  13  -3.450  -0.576   0.278
  102   HG23  VAL  13          2HG2      VAL  13  -4.848  -0.956  -0.754
  103    H    LYS  14           HN       LYS  14  -5.906   3.641   0.464
  104    HA   LYS  14           HA       LYS  14  -4.899   4.223  -2.278
  105    HB2  LYS  14           2HB      LYS  14  -7.188   5.039  -2.002
  106    HB3  LYS  14           3HB      LYS  14  -6.714   5.891  -0.512
  107    HG2  LYS  14           2HG      LYS  14  -5.248   7.353  -1.809
  108    HG3  LYS  14           3HG      LYS  14  -5.703   6.496  -3.300
  109    HD2  LYS  14           2HD      LYS  14  -6.999   8.581  -2.990
  110    HD3  LYS  14           3HD      LYS  14  -8.038   7.136  -2.987
  111    HE2  LYS  14           2HE      LYS  14  -7.779   7.200  -0.422
  112    HE3  LYS  14           3HE      LYS  14  -7.178   8.855  -0.659
  113    HZ1  LYS  14           3HZ      LYS  14  -9.806   7.845  -1.520
  114    HZ2  LYS  14           1HZ      LYS  14  -9.532   8.818  -0.218
  115    HZ3  LYS  14           2HZ      LYS  14  -9.249   9.382  -1.741
  116    H    VAL  15           HN       VAL  15  -2.846   4.872  -2.185
  117    HA   VAL  15           HA       VAL  15  -1.616   5.448   0.362
  118    HB   VAL  15           HB       VAL  15  -0.534   5.712  -2.470
  119   HG11  VAL  15          1HG1      VAL  15   1.693   5.763  -1.427
  120   HG12  VAL  15          2HG1      VAL  15   0.696   7.139  -0.902
  121   HG13  VAL  15          3HG1      VAL  15   0.938   5.749   0.183
  122   HG21  VAL  15          3HG2      VAL  15  -1.158   3.422  -1.870
  123   HG22  VAL  15          1HG2      VAL  15   0.609   3.591  -1.990
  124   HG23  VAL  15          2HG2      VAL  15  -0.171   3.533  -0.393
  125    H    VAL  16           HN       VAL  16  -1.298   7.380   1.327
  126    HA   VAL  16           HA       VAL  16  -1.952   9.744  -0.349
  127    HB   VAL  16           HB       VAL  16  -2.549  10.887   1.836
  128   HG11  VAL  16          1HG1      VAL  16  -4.810   9.917   1.877
  129   HG12  VAL  16          2HG1      VAL  16  -4.219  10.118   0.212
  130   HG13  VAL  16          3HG1      VAL  16  -4.220   8.506   0.968
  131   HG21  VAL  16          3HG2      VAL  16  -1.479   9.311   3.378
  132   HG22  VAL  16          1HG2      VAL  16  -3.218   9.453   3.720
  133   HG23  VAL  16          2HG2      VAL  16  -2.599   8.030   2.853
  134    H    LYS  17           HN       LYS  17   0.189   8.519   2.229
  135    HA   LYS  17           HA       LYS  17   2.144  10.550   1.325
  136    HB2  LYS  17           2HB      LYS  17   0.982  11.471   3.310
  137    HB3  LYS  17           3HB      LYS  17   1.472  10.034   4.239
  138    HG2  LYS  17           2HG      LYS  17   3.582  10.775   4.529
  139    HG3  LYS  17           3HG      LYS  17   3.670  11.487   2.899
  140    HD2  LYS  17           2HD      LYS  17   3.774  13.141   4.797
  141    HD3  LYS  17           3HD      LYS  17   2.494  13.444   3.598
  142    HE2  LYS  17           2HE      LYS  17   0.844  12.409   5.086
  143    HE3  LYS  17           3HE      LYS  17   2.119  12.078   6.278
  144    HZ1  LYS  17           3HZ      LYS  17   1.276  14.748   5.370
  145    HZ2  LYS  17           1HZ      LYS  17   0.891  14.060   6.818
  146    HZ3  LYS  17           2HZ      LYS  17   2.459  14.439   6.478
  147    H    LEU  18           HN       LEU  18   4.339   9.977   1.728
  148    HA   LEU  18           HA       LEU  18   4.676   7.106   2.461
  149    HB2  LEU  18           2HB      LEU  18   6.090   8.712   0.315
  150    HB3  LEU  18           3HB      LEU  18   6.535   7.063   0.820
  151    HG   LEU  18           HG       LEU  18   3.855   7.833  -0.367
  152   HD11  LEU  18          1HD1      LEU  18   4.677   6.751  -2.417
  153   HD12  LEU  18          2HD1      LEU  18   5.675   8.158  -1.982
  154   HD13  LEU  18          3HD1      LEU  18   6.266   6.512  -1.653
  155   HD21  LEU  18          3HD2      LEU  18   3.820   5.838   1.068
  156   HD22  LEU  18          1HD2      LEU  18   3.594   5.401  -0.642
  157   HD23  LEU  18          2HD2      LEU  18   5.172   5.143   0.140
  158    H    HIS  19           HN       HIS  19   5.758   6.967   4.314
  159    HA   HIS  19           HA       HIS  19   7.528   9.179   5.113
  160    HB2  HIS  19           2HB      HIS  19   6.902   6.609   6.605
  161    HB3  HIS  19           3HB      HIS  19   7.656   8.074   7.261
  162    HD1  HIS  19           1HD      HIS  19   4.890   6.584   8.131
  163    HD2  HIS  19           2HD      HIS  19   5.327  10.179   6.053
  164    HE1  HIS  19           1HE      HIS  19   2.753   7.882   8.515
  165    HE2  HIS  19           2HE      HIS  19   3.022  10.071   7.257
  166    H    GLY  20           HN       GLY  20   9.695   8.561   6.096
  167    HA2  GLY  20           1HA      GLY  20  11.203   6.482   6.119
  168    HA3  GLY  20           2HA      GLY  20  10.932   6.489   4.361
  169    H    THR  21           HN       THR  21  13.416   6.523   4.768
  170    HA   THR  21           HA       THR  21  14.437   9.227   5.307
  171    HB   THR  21           HB       THR  21  16.091   6.841   4.440
  172    HG1  THR  21           1HG      THR  21  16.158   6.293   6.691
  173   HG21  THR  21          3HG2      THR  21  16.609   9.159   6.342
  174   HG22  THR  21          1HG2      THR  21  17.774   7.884   5.920
  175   HG23  THR  21          2HG2      THR  21  17.217   9.023   4.674
  176    H    GLY  22           HN       GLY  22  12.754   8.713   2.932
  177    HA2  GLY  22           1HA      GLY  22  12.739   9.797   0.893
  178    HA3  GLY  22           2HA      GLY  22  14.462  10.185   1.101
  179    H    ALA  23           HN       ALA  23  15.838   7.968   1.099
  180    HA   ALA  23           HA       ALA  23  15.811   7.123  -1.588
  181    HB1  ALA  23           1HB      ALA  23  17.443   5.424  -0.869
  182    HB2  ALA  23           2HB      ALA  23  17.788   7.005  -0.132
  183    HB3  ALA  23           3HB      ALA  23  17.008   5.726   0.829
  184    H    LEU  24           HN       LEU  24  14.347   5.678   1.308
  185    HA   LEU  24           HA       LEU  24  13.548   3.260  -0.079
  186    HB2  LEU  24           2HB      LEU  24  13.978   3.633   2.435
  187    HB3  LEU  24           3HB      LEU  24  12.342   4.331   2.470
  188    HG   LEU  24           HG       LEU  24  12.534   1.934   3.207
  189   HD11  LEU  24          1HD1      LEU  24  10.511   1.186   2.025
  190   HD12  LEU  24          2HD1      LEU  24  10.395   2.893   2.505
  191   HD13  LEU  24          3HD1      LEU  24  10.750   2.464   0.814
  192   HD21  LEU  24          3HD2      LEU  24  14.192   1.201   1.555
  193   HD22  LEU  24          1HD2      LEU  24  12.723   0.202   1.469
  194   HD23  LEU  24          2HD2      LEU  24  13.012   1.462   0.247
  195    H    LYS  25           HN       LYS  25  11.911   6.300   0.925
  196    HA   LYS  25           HA       LYS  25   9.330   5.412   0.064
  197    HB2  LYS  25           2HB      LYS  25   8.727   7.849   0.226
  198    HB3  LYS  25           3HB      LYS  25   9.378   7.095   1.701
  199    HG2  LYS  25           2HG      LYS  25  10.518   9.039   1.773
  200    HG3  LYS  25           3HG      LYS  25  11.644   8.108   0.758
  201    HD2  LYS  25           2HD      LYS  25  11.292  10.351  -0.142
  202    HD3  LYS  25           3HD      LYS  25  10.669   9.108  -1.254
  203    HE2  LYS  25           2HE      LYS  25   8.414   9.562  -0.648
  204    HE3  LYS  25           3HE      LYS  25   8.910  10.544   0.748
  205    HZ1  LYS  25           3HZ      LYS  25   9.360  11.232  -2.078
  206    HZ2  LYS  25           1HZ      LYS  25   8.220  11.904  -1.095
  207    HZ3  LYS  25           2HZ      LYS  25   9.821  12.143  -0.783
  208    H    ARG  26           HN       ARG  26  11.989   7.049  -1.587
  209    HA   ARG  26           HA       ARG  26  10.438   7.612  -3.958
  210    HB2  ARG  26           2HB      ARG  26  12.611   8.737  -3.391
  211    HB3  ARG  26           3HB      ARG  26  13.438   7.208  -3.770
  212    HG2  ARG  26           2HG      ARG  26  12.265   7.343  -6.044
  213    HG3  ARG  26           3HG      ARG  26  11.899   9.031  -5.617
  214    HD2  ARG  26           2HD      ARG  26  14.306   9.476  -5.344
  215    HD3  ARG  26           3HD      ARG  26  14.663   7.793  -5.790
  216    HE   ARG  26           HE       ARG  26  13.874   9.976  -7.562
  217   HH11  ARG  26          2HH1      ARG  26  14.267   6.487  -7.162
  218   HH12  ARG  26          1HH1      ARG  26  14.251   6.166  -8.880
  219   HH21  ARG  26          2HH2      ARG  26  13.807   9.533  -9.790
  220   HH22  ARG  26          1HH2      ARG  26  13.990   7.890 -10.367
  221    H    ARG  27           HN       ARG  27  12.455   4.928  -2.803
  222    HA   ARG  27           HA       ARG  27  12.581   3.396  -5.165
  223    HB2  ARG  27           2HB      ARG  27  13.852   2.948  -3.085
  224    HB3  ARG  27           3HB      ARG  27  12.344   2.435  -2.291
  225    HG2  ARG  27           2HG      ARG  27  13.509   0.468  -2.915
  226    HG3  ARG  27           3HG      ARG  27  12.148   0.644  -4.047
  227    HD2  ARG  27           2HD      ARG  27  13.662   1.609  -5.724
  228    HD3  ARG  27           3HD      ARG  27  15.023   1.452  -4.592
  229    HE   ARG  27           HE       ARG  27  13.486  -0.930  -5.499
  230   HH11  ARG  27          2HH1      ARG  27  16.523   0.832  -5.181
  231   HH12  ARG  27          1HH1      ARG  27  17.504  -0.524  -5.686
  232   HH21  ARG  27          2HH2      ARG  27  14.785  -2.686  -6.146
  233   HH22  ARG  27          1HH2      ARG  27  16.523  -2.509  -6.230
  234    H    ILE  28           HN       ILE  28  10.047   3.716  -2.711
  235    HA   ILE  28           HA       ILE  28   8.388   1.590  -3.617
  236    HB   ILE  28           HB       ILE  28   7.574   4.191  -2.255
  237   HG12  ILE  28          2HG1      ILE  28   8.280   1.505  -1.030
  238   HG13  ILE  28          3HG1      ILE  28   9.346   2.931  -1.050
  239   HG21  ILE  28          1HG2      ILE  28   5.637   2.900  -1.458
  240   HG22  ILE  28          2HG2      ILE  28   5.687   2.962  -3.234
  241   HG23  ILE  28          3HG2      ILE  28   6.200   1.487  -2.381
  242   HD11  ILE  28          3HD1      ILE  28   6.638   2.751   0.299
  243   HD12  ILE  28          1HD1      ILE  28   8.211   2.696   1.121
  244   HD13  ILE  28          2HD1      ILE  28   7.706   4.176   0.281
  245    H    MET  29           HN       MET  29   8.404   5.099  -4.353
  246    HA   MET  29           HA       MET  29   6.155   4.979  -6.128
  247    HB2  MET  29           2HB      MET  29   8.386   7.007  -5.796
  248    HB3  MET  29           3HB      MET  29   6.995   7.233  -6.883
  249    HG2  MET  29           2HG      MET  29   5.477   7.051  -4.959
  250    HG3  MET  29           3HG      MET  29   6.869   6.852  -3.883
  251    HE1  MET  29           3HE      MET  29   8.956   8.883  -5.239
  252    HE2  MET  29           1HE      MET  29   8.668  10.340  -4.261
  253    HE3  MET  29           2HE      MET  29   8.707   8.742  -3.481
  254    H    ASP  30           HN       ASP  30   9.628   4.604  -6.543
  255    HA   ASP  30           HA       ASP  30   9.746   4.874  -9.364
  256    HB2  ASP  30           2HB      ASP  30  11.705   4.892  -7.863
  257    HB3  ASP  30           3HB      ASP  30  11.445   3.171  -7.507
  258    HD2  ASP  30           2HD      ASP  30  13.265   2.287 -10.266
  259    H    MET  31           HN       MET  31   8.554   2.305  -7.323
  260    HA   MET  31           HA       MET  31   8.648   0.334  -9.497
  261    HB2  MET  31           2HB      MET  31   7.552   0.257  -6.673
  262    HB3  MET  31           3HB      MET  31   7.440  -1.101  -7.817
  263    HG2  MET  31           2HG      MET  31   9.876  -1.219  -7.938
  264    HG3  MET  31           3HG      MET  31  10.013   0.165  -6.840
  265    HE1  MET  31           3HE      MET  31   7.637  -0.433  -4.771
  266    HE2  MET  31           1HE      MET  31   8.519  -1.307  -3.498
  267    HE3  MET  31           2HE      MET  31   9.261   0.107  -4.280
  268    H    GLY  32           HN       GLY  32   6.442   2.698  -8.190
  269    HA2  GLY  32           1HA      GLY  32   4.645   3.058 -10.024
  270    HA3  GLY  32           2HA      GLY  32   4.180   1.394  -9.603
  271    H    ILE  33           HN       ILE  33   4.896   1.830  -6.741
  272    HA   ILE  33           HA       ILE  33   2.270   2.728  -5.946
  273    HB   ILE  33           HB       ILE  33   4.670   2.062  -4.198
  274   HG12  ILE  33          2HG1      ILE  33   3.196  -0.064  -3.824
  275   HG13  ILE  33          3HG1      ILE  33   2.498   0.372  -5.403
  276   HG21  ILE  33          1HG2      ILE  33   3.001   1.753  -2.412
  277   HG22  ILE  33          2HG2      ILE  33   2.968   3.412  -3.053
  278   HG23  ILE  33          3HG2      ILE  33   1.712   2.247  -3.534
  279   HD11  ILE  33          3HD1      ILE  33   5.423  -0.173  -4.840
  280   HD12  ILE  33          1HD1      ILE  33   4.301  -1.284  -5.652
  281   HD13  ILE  33          2HD1      ILE  33   4.724   0.261  -6.419
  282    H    THR  34           HN       THR  34   1.926   4.859  -6.293
  283    HA   THR  34           HA       THR  34   3.953   6.735  -5.193
  284    HB   THR  34           HB       THR  34   2.785   8.388  -6.788
  285    HG1  THR  34           1HG      THR  34   1.737   7.336  -8.560
  286   HG21  THR  34          3HG2      THR  34   4.297   6.032  -7.968
  287   HG22  THR  34          1HG2      THR  34   4.113   7.631  -8.724
  288   HG23  THR  34          2HG2      THR  34   5.026   7.466  -7.207
  289    H    ARG  35           HN       ARG  35   2.897   8.960  -4.673
  290    HA   ARG  35           HA       ARG  35   0.806   8.469  -2.706
  291    HB2  ARG  35           2HB      ARG  35   1.031  10.973  -2.371
  292    HB3  ARG  35           3HB      ARG  35   2.502  10.012  -2.087
  293    HG2  ARG  35           2HG      ARG  35   3.235  10.606  -4.418
  294    HG3  ARG  35           3HG      ARG  35   1.849  11.721  -4.503
  295    HD2  ARG  35           2HD      ARG  35   4.059  11.836  -2.429
  296    HD3  ARG  35           3HD      ARG  35   3.977  12.844  -3.889
  297    HE   ARG  35           HE       ARG  35   1.981  12.933  -1.675
  298   HH11  ARG  35          2HH1      ARG  35   3.795  14.454  -4.290
  299   HH12  ARG  35          1HH1      ARG  35   3.197  16.058  -3.941
  300   HH21  ARG  35          2HH2      ARG  35   1.241  15.045  -1.214
  301   HH22  ARG  35          1HH2      ARG  35   1.756  16.391  -2.204
  302    H    GLY  36           HN       GLY  36  -1.305   8.520  -3.068
  303    HA2  GLY  36           1HA      GLY  36  -3.298   9.420  -3.941
  304    HA3  GLY  36           2HA      GLY  36  -2.361  10.291  -5.176
  305    H    CYS  37           HN       CYS  37  -1.908   6.862  -4.445
  306    HA   CYS  37           HA       CYS  37  -3.162   6.249  -7.076
  307    HB2  CYS  37           2HB      CYS  37  -1.640   4.414  -7.297
  308    HB3  CYS  37           3HB      CYS  37  -0.704   5.889  -6.947
  309    HG   CYS  37           HG       CYS  37   0.445   3.822  -5.839
  310    H    GLU  38           HN       GLU  38  -4.325   4.282  -7.255
  311    HA   GLU  38           HA       GLU  38  -5.546   3.434  -4.694
  312    HB2  GLU  38           2HB      GLU  38  -6.347   2.878  -7.571
  313    HB3  GLU  38           3HB      GLU  38  -7.266   2.415  -6.119
  314    HG2  GLU  38           2HG      GLU  38  -7.730   4.683  -5.581
  315    HG3  GLU  38           3HG      GLU  38  -6.570   5.278  -6.788
  316    HE2  GLU  38           2HE      GLU  38 -10.242   4.715  -7.906
  317    H    ILE  39           HN       ILE  39  -5.253   1.453  -3.843
  318    HA   ILE  39           HA       ILE  39  -3.782  -0.535  -5.477
  319    HB   ILE  39           HB       ILE  39  -3.113   0.301  -2.627
  320   HG12  ILE  39          2HG1      ILE  39  -1.514   0.440  -5.201
  321   HG13  ILE  39          3HG1      ILE  39  -2.220   1.817  -4.319
  322   HG21  ILE  39          1HG2      ILE  39  -1.349  -1.416  -2.717
  323   HG22  ILE  39          2HG2      ILE  39  -2.965  -2.136  -2.898
  324   HG23  ILE  39          3HG2      ILE  39  -1.922  -1.919  -4.324
  325   HD11  ILE  39          3HD1      ILE  39  -0.056  -0.035  -3.291
  326   HD12  ILE  39          1HD1      ILE  39   0.192   1.621  -3.884
  327   HD13  ILE  39          2HD1      ILE  39  -0.760   1.342  -2.410
  328    H    TYR  40           HN       TYR  40  -4.591  -2.524  -5.348
  329    HA   TYR  40           HA       TYR  40  -6.530  -3.090  -3.175
  330    HB2  TYR  40           2HB      TYR  40  -7.305  -3.484  -5.480
  331    HB3  TYR  40           3HB      TYR  40  -5.950  -4.594  -5.750
  332    HD1  TYR  40           1HD      TYR  40  -8.971  -4.090  -3.608
  333    HD2  TYR  40           2HD      TYR  40  -6.176  -6.879  -5.210
  334    HE1  TYR  40           1HE      TYR  40 -10.319  -5.942  -2.728
  335    HE2  TYR  40           2HE      TYR  40  -7.525  -8.735  -4.334
  336    HH   TYR  40           HH       TYR  40  -9.395  -9.351  -3.194
  337    H    ILE  41           HN       ILE  41  -5.848  -4.216  -1.464
  338    HA   ILE  41           HA       ILE  41  -3.250  -5.534  -1.529
  339    HB   ILE  41           HB       ILE  41  -5.356  -5.565   0.667
  340   HG12  ILE  41          2HG1      ILE  41  -4.743  -3.271   0.146
  341   HG13  ILE  41          3HG1      ILE  41  -4.036  -3.760   1.705
  342   HG21  ILE  41          1HG2      ILE  41  -3.455  -6.112   2.141
  343   HG22  ILE  41          2HG2      ILE  41  -3.658  -7.334   0.864
  344   HG23  ILE  41          3HG2      ILE  41  -2.368  -6.115   0.734
  345   HD11  ILE  41          3HD1      ILE  41  -2.577  -3.620  -0.943
  346   HD12  ILE  41          1HD1      ILE  41  -2.441  -2.443   0.379
  347   HD13  ILE  41          2HD1      ILE  41  -1.872  -4.108   0.616
  348    H    ARG  42           HN       ARG  42  -2.929  -7.541  -2.224
  349    HA   ARG  42           HA       ARG  42  -5.285  -9.228  -2.721
  350    HB2  ARG  42           2HB      ARG  42  -3.645  -8.848  -4.507
  351    HB3  ARG  42           3HB      ARG  42  -2.368  -9.556  -3.487
  352    HG2  ARG  42           2HG      ARG  42  -3.081 -11.168  -5.132
  353    HG3  ARG  42           3HG      ARG  42  -3.585 -11.708  -3.512
  354    HD2  ARG  42           2HD      ARG  42  -5.452 -10.152  -5.299
  355    HD3  ARG  42           3HD      ARG  42  -5.265 -11.911  -5.470
  356    HE   ARG  42           HE       ARG  42  -5.762 -11.389  -2.756
  357   HH11  ARG  42          2HH1      ARG  42  -7.386 -10.905  -5.836
  358   HH12  ARG  42          1HH1      ARG  42  -8.988 -11.146  -5.176
  359   HH21  ARG  42          2HH2      ARG  42  -7.858 -11.758  -1.912
  360   HH22  ARG  42          1HH2      ARG  42  -9.255 -11.629  -2.956
  361    H    LYS  43           HN       LYS  43  -2.121  -9.446  -1.024
  362    HA   LYS  43           HA       LYS  43  -3.312 -11.299   0.893
  363    HB2  LYS  43           2HB      LYS  43  -1.466 -12.214  -1.256
  364    HB3  LYS  43           3HB      LYS  43  -1.143 -12.812   0.389
  365    HG2  LYS  43           2HG      LYS  43  -3.458 -13.661   0.508
  366    HG3  LYS  43           3HG      LYS  43  -3.725 -13.116  -1.165
  367    HD2  LYS  43           2HD      LYS  43  -2.030 -14.627  -1.988
  368    HD3  LYS  43           3HD      LYS  43  -1.563 -15.075  -0.330
  369    HE2  LYS  43           2HE      LYS  43  -4.277 -15.582  -1.585
  370    HE3  LYS  43           3HE      LYS  43  -2.978 -16.785  -1.427
  371    HZ1  LYS  43           3HZ      LYS  43  -4.318 -15.410   0.803
  372    HZ2  LYS  43           1HZ      LYS  43  -4.579 -16.970   0.341
  373    HZ3  LYS  43           2HZ      LYS  43  -3.113 -16.526   0.949
  374    H    VAL  44           HN       VAL  44  -2.191 -11.429   2.807
  375    HA   VAL  44           HA       VAL  44   0.340  -9.860   2.937
  376    HB   VAL  44           HB       VAL  44  -1.728 -10.235   5.139
  377   HG11  VAL  44          1HG1      VAL  44  -0.387  -8.591   6.386
  378   HG12  VAL  44          2HG1      VAL  44   0.564 -10.041   5.985
  379   HG13  VAL  44          3HG1      VAL  44   0.788  -8.542   5.052
  380   HG21  VAL  44          3HG2      VAL  44  -2.558  -8.754   3.372
  381   HG22  VAL  44          1HG2      VAL  44  -2.212  -7.839   4.858
  382   HG23  VAL  44          2HG2      VAL  44  -1.078  -7.773   3.490
  383    H    ALA  45           HN       ALA  45   2.087 -10.991   3.559
  384    HA   ALA  45           HA       ALA  45   1.850 -13.820   3.994
  385    HB1  ALA  45           1HB      ALA  45   4.295 -13.750   4.250
  386    HB2  ALA  45           2HB      ALA  45   3.763 -12.807   2.838
  387    HB3  ALA  45           3HB      ALA  45   4.234 -11.974   4.339
  388    HA   PRO  46           HA       PRO  46   1.226 -14.140   8.312
  389    HB2  PRO  46           2HB      PRO  46   2.799 -16.403   8.851
  390    HB3  PRO  46           3HB      PRO  46   1.159 -16.424   8.124
  391    HG2  PRO  46           2HG      PRO  46   3.806 -16.535   6.756
  392    HG3  PRO  46           3HG      PRO  46   2.349 -17.542   6.466
  393    HD2  PRO  46           2HD      PRO  46   2.972 -15.480   4.856
  394    HD3  PRO  46           3HD      PRO  46   1.273 -15.770   5.337
  395    H    LEU  47           HN       LEU  47   4.538 -14.110   7.075
  396    HA   LEU  47           HA       LEU  47   5.600 -13.458   9.748
  397    HB2  LEU  47           2HB      LEU  47   7.796 -13.548   8.690
  398    HB3  LEU  47           3HB      LEU  47   6.860 -15.027   8.365
  399    HG   LEU  47           HG       LEU  47   6.967 -12.789   6.354
  400   HD11  LEU  47          1HD1      LEU  47   8.882 -13.914   5.285
  401   HD12  LEU  47          2HD1      LEU  47   9.296 -13.336   6.915
  402   HD13  LEU  47          3HD1      LEU  47   8.960 -15.063   6.641
  403   HD21  LEU  47          3HD2      LEU  47   5.312 -14.577   6.033
  404   HD22  LEU  47          1HD2      LEU  47   6.563 -14.633   4.770
  405   HD23  LEU  47          2HD2      LEU  47   6.608 -15.795   6.116
  406    H    GLY  48           HN       GLY  48   4.050 -11.804   7.371
  407    HA2  GLY  48           1HA      GLY  48   3.885  -9.374   7.816
  408    HA3  GLY  48           2HA      GLY  48   5.661  -9.353   7.891
  409    H    ASP  49           HN       ASP  49   6.793 -10.165   5.886
  410    HA   ASP  49           HA       ASP  49   5.280  -9.233   3.490
  411    HB2  ASP  49           2HB      ASP  49   7.311  -8.338   2.590
  412    HB3  ASP  49           3HB      ASP  49   7.138  -7.717   4.246
  413    HD2  ASP  49           2HD      ASP  49  10.020  -9.324   5.293
  414    HA   PRO  50           HA       PRO  50   6.448  -8.963   1.426
  415    HB2  PRO  50           2HB      PRO  50   5.793 -10.253  -1.087
  416    HB3  PRO  50           3HB      PRO  50   7.352  -9.525  -0.577
  417    HG2  PRO  50           2HG      PRO  50   6.888 -12.217  -1.020
  418    HG3  PRO  50           3HG      PRO  50   8.301 -11.521  -0.162
  419    HD2  PRO  50           2HD      PRO  50   5.783 -12.786   0.903
  420    HD3  PRO  50           3HD      PRO  50   7.445 -12.808   1.565
  421    H    ILE  51           HN       ILE  51   4.695  -7.708   0.914
  422    HA   ILE  51           HA       ILE  51   2.066  -9.025   1.183
  423    HB   ILE  51           HB       ILE  51   2.762  -6.059   1.076
  424   HG12  ILE  51          2HG1      ILE  51   1.882  -6.271   3.532
  425   HG13  ILE  51          3HG1      ILE  51   2.337  -7.981   3.347
  426   HG21  ILE  51          1HG2      ILE  51   0.442  -5.695   1.819
  427   HG22  ILE  51          2HG2      ILE  51   0.497  -6.536   0.253
  428   HG23  ILE  51          3HG2      ILE  51   0.144  -7.446   1.742
  429   HD11  ILE  51          3HD1      ILE  51   4.182  -5.603   3.009
  430   HD12  ILE  51          1HD1      ILE  51   4.142  -6.690   4.412
  431   HD13  ILE  51          2HD1      ILE  51   4.636  -7.315   2.825
  432    H    GLN  52           HN       GLN  52   0.814  -9.440  -0.538
  433    HA   GLN  52           HA       GLN  52   1.779  -8.660  -3.180
  434    HB2  GLN  52           2HB      GLN  52  -0.700 -10.200  -2.342
  435    HB3  GLN  52           3HB      GLN  52  -0.075 -10.039  -4.001
  436    HG2  GLN  52           2HG      GLN  52   1.295 -11.418  -1.677
  437    HG3  GLN  52           3HG      GLN  52   0.514 -12.202  -3.066
  438   HE21  GLN  52          1HE2      GLN  52   3.301 -10.410  -1.920
  439   HE22  GLN  52          2HE2      GLN  52   4.304 -10.673  -3.332
  440    H    ILE  53           HN       ILE  53   1.353  -6.705  -3.967
  441    HA   ILE  53           HA       ILE  53  -1.306  -5.534  -3.340
  442    HB   ILE  53           HB       ILE  53  -0.210  -3.285  -3.394
  443   HG12  ILE  53          2HG1      ILE  53   2.365  -3.505  -2.775
  444   HG13  ILE  53          3HG1      ILE  53   2.232  -4.973  -3.773
  445   HG21  ILE  53          1HG2      ILE  53   0.758  -3.423  -1.134
  446   HG22  ILE  53          2HG2      ILE  53  -0.724  -4.399  -1.270
  447   HG23  ILE  53          3HG2      ILE  53   0.870  -5.191  -1.293
  448   HD11  ILE  53          3HD1      ILE  53   1.547  -2.156  -4.653
  449   HD12  ILE  53          1HD1      ILE  53   3.008  -3.055  -5.108
  450   HD13  ILE  53          2HD1      ILE  53   1.417  -3.624  -5.650
  451    H    ASN  54           HN       ASN  54  -2.271  -4.228  -4.937
  452    HA   ASN  54           HA       ASN  54  -0.924  -4.332  -7.599
  453    HB2  ASN  54           2HB      ASN  54  -2.928  -5.830  -7.417
  454    HB3  ASN  54           3HB      ASN  54  -3.914  -4.394  -7.074
  455   HD21  ASN  54          1HD2      ASN  54  -3.846  -6.425  -9.332
  456   HD22  ASN  54          2HD2      ASN  54  -3.772  -5.455 -10.787
  457    H    VAL  55           HN       VAL  55  -0.204  -2.386  -8.049
  458    HA   VAL  55           HA       VAL  55  -1.710  -0.040  -7.019
  459    HB   VAL  55           HB       VAL  55   0.589  -0.256  -6.174
  460   HG11  VAL  55          1HG1      VAL  55   2.535  -0.032  -7.659
  461   HG12  VAL  55          2HG1      VAL  55   1.591  -1.492  -8.030
  462   HG13  VAL  55          3HG1      VAL  55   1.455  -0.055  -9.072
  463   HG21  VAL  55          3HG2      VAL  55  -0.373   1.967  -6.487
  464   HG22  VAL  55          1HG2      VAL  55   1.384   1.991  -6.762
  465   HG23  VAL  55          2HG2      VAL  55   0.267   2.021  -8.146
  466    H    ARG  56           HN       ARG  56  -2.641   1.334  -8.410
  467    HA   ARG  56           HA       ARG  56  -3.341   2.253 -10.391
  468    HB2  ARG  56           2HB      ARG  56  -0.598   1.434 -11.413
  469    HB3  ARG  56           3HB      ARG  56  -1.727   2.546 -12.225
  470    HG2  ARG  56           2HG      ARG  56  -0.494   3.055  -9.507
  471    HG3  ARG  56           3HG      ARG  56   0.167   3.663 -11.043
  472    HD2  ARG  56           2HD      ARG  56  -2.208   4.645 -11.406
  473    HD3  ARG  56           3HD      ARG  56  -2.410   4.388  -9.660
  474    HE   ARG  56           HE       ARG  56   0.009   5.841 -10.425
  475   HH11  ARG  56          2HH1      ARG  56  -3.348   6.015  -9.370
  476   HH12  ARG  56          1HH1      ARG  56  -3.234   7.685  -8.863
  477   HH21  ARG  56          2HH2      ARG  56   0.131   8.033  -9.812
  478   HH22  ARG  56          1HH2      ARG  56  -1.262   8.828  -9.114
  479    H    GLY  57           HN       GLY  57  -1.223  -0.027 -12.046
  480    HA2  GLY  57           1HA      GLY  57  -3.370  -2.017 -12.305
  481    HA3  GLY  57           2HA      GLY  57  -2.776  -1.271 -13.806
  482    H    TYR  58           HN       TYR  58  -0.864  -1.927 -10.899
  483    HA   TYR  58           HA       TYR  58   0.674  -3.987 -12.419
  484    HB2  TYR  58           2HB      TYR  58   1.574  -1.459 -12.148
  485    HB3  TYR  58           3HB      TYR  58   2.084  -2.092 -10.574
  486    HD1  TYR  58           2HD      TYR  58   2.328  -2.823 -14.240
  487    HD2  TYR  58           1HD      TYR  58   4.116  -3.234 -10.399
  488    HE1  TYR  58           2HE      TYR  58   4.333  -3.790 -15.277
  489    HE2  TYR  58           1HE      TYR  58   6.124  -4.194 -11.434
  490    HH   TYR  58           HH       TYR  58   6.415  -4.652 -14.952
  491    H    GLU  59           HN       GLU  59   1.022  -5.817 -11.222
  492    HA   GLU  59           HA       GLU  59   0.444  -5.571  -8.318
  493    HB2  GLU  59           2HB      GLU  59   0.214  -8.118  -8.482
  494    HB3  GLU  59           3HB      GLU  59  -1.076  -7.096  -9.160
  495    HG2  GLU  59           2HG      GLU  59  -0.011  -7.400 -11.411
  496    HG3  GLU  59           3HG      GLU  59   1.082  -8.586 -10.665
  497    HE2  GLU  59           2HE      GLU  59  -1.323 -11.028 -10.877
  498    H    LEU  60           HN       LEU  60   2.014  -5.656  -6.942
  499    HA   LEU  60           HA       LEU  60   4.543  -7.030  -7.698
  500    HB2  LEU  60           2HB      LEU  60   4.143  -4.238  -6.604
  501    HB3  LEU  60           3HB      LEU  60   5.682  -5.116  -6.435
  502    HG   LEU  60           HG       LEU  60   4.381  -4.498  -9.093
  503   HD11  LEU  60          1HD1      LEU  60   6.027  -2.672  -9.275
  504   HD12  LEU  60          2HD1      LEU  60   4.923  -2.414  -7.904
  505   HD13  LEU  60          3HD1      LEU  60   6.578  -3.004  -7.617
  506   HD21  LEU  60          3HD2      LEU  60   5.960  -6.385  -9.082
  507   HD22  LEU  60          1HD2      LEU  60   6.633  -4.995  -9.966
  508   HD23  LEU  60          2HD2      LEU  60   7.193  -5.354  -8.317
  509    H    SER  61           HN       SER  61   6.001  -7.268  -5.759
  510    HA   SER  61           HA       SER  61   4.397  -7.863  -3.342
  511    HB2  SER  61           2HB      SER  61   7.258  -8.575  -4.085
  512    HB3  SER  61           3HB      SER  61   6.432  -9.053  -2.582
  513    HG   SER  61           HG       SER  61   6.349 -10.685  -4.201
  514    H    LEU  62           HN       LEU  62   4.444  -6.564  -1.625
  515    HA   LEU  62           HA       LEU  62   6.439  -4.357  -1.636
  516    HB2  LEU  62           2HB      LEU  62   4.021  -3.772  -1.682
  517    HB3  LEU  62           3HB      LEU  62   3.819  -4.620  -0.130
  518    HG   LEU  62           HG       LEU  62   5.394  -3.008   0.909
  519   HD11  LEU  62          1HD1      LEU  62   5.964  -0.938  -0.296
  520   HD12  LEU  62          2HD1      LEU  62   6.640  -2.370  -1.106
  521   HD13  LEU  62          3HD1      LEU  62   5.186  -1.579  -1.761
  522   HD21  LEU  62          3HD2      LEU  62   2.965  -2.683   1.040
  523   HD22  LEU  62          1HD2      LEU  62   3.814  -1.122   0.960
  524   HD23  LEU  62          2HD2      LEU  62   3.001  -1.766  -0.485
  525    H    ARG  63           HN       ARG  63   7.576  -3.847   0.286
  526    HA   ARG  63           HA       ARG  63   8.143  -6.246   1.849
  527    HB2  ARG  63           2HB      ARG  63   9.662  -4.154   0.917
  528    HB3  ARG  63           3HB      ARG  63   9.458  -3.741   2.636
  529    HG2  ARG  63           2HG      ARG  63  11.501  -5.067   2.160
  530    HG3  ARG  63           3HG      ARG  63  10.395  -5.846   3.316
  531    HD2  ARG  63           2HD      ARG  63  11.313  -7.444   1.668
  532    HD3  ARG  63           3HD      ARG  63   9.543  -7.310   1.569
  533    HE   ARG  63           HE       ARG  63  10.081  -5.655  -0.353
  534   HH11  ARG  63          2HH1      ARG  63  11.887  -8.573   0.437
  535   HH12  ARG  63          1HH1      ARG  63  12.475  -8.797  -1.196
  536   HH21  ARG  63          2HH2      ARG  63  10.863  -5.932  -2.455
  537   HH22  ARG  63          1HH2      ARG  63  11.893  -7.296  -2.840
  538    H    LYS  64           HN       LYS  64   8.348  -6.206   4.139
  539    HA   LYS  64           HA       LYS  64   5.933  -5.455   5.427
  540    HB2  LYS  64           2HB      LYS  64   7.501  -7.339   5.965
  541    HB3  LYS  64           3HB      LYS  64   8.627  -6.135   6.638
  542    HG2  LYS  64           2HG      LYS  64   6.993  -5.534   8.341
  543    HG3  LYS  64           3HG      LYS  64   5.831  -6.693   7.653
  544    HD2  LYS  64           2HD      LYS  64   7.484  -8.511   8.028
  545    HD3  LYS  64           3HD      LYS  64   8.561  -7.331   8.812
  546    HE2  LYS  64           2HE      LYS  64   6.932  -6.935  10.557
  547    HE3  LYS  64           3HE      LYS  64   5.750  -7.981   9.740
  548    HZ1  LYS  64           3HZ      LYS  64   8.342  -8.853  10.835
  549    HZ2  LYS  64           1HZ      LYS  64   6.869  -9.126  11.523
  550    HZ3  LYS  64           2HZ      LYS  64   7.245  -9.824  10.077
  551    H    SER  65           HN       SER  65   9.247  -4.145   5.612
  552    HA   SER  65           HA       SER  65   8.640  -2.146   7.557
  553    HB2  SER  65           2HB      SER  65  10.817  -1.137   6.666
  554    HB3  SER  65           3HB      SER  65  10.911  -2.805   7.283
  555    HG   SER  65           HG       SER  65  11.960  -2.549   5.246
  556    H    ALA  66           HN       ALA  66   8.771  -2.132   3.995
  557    HA   ALA  66           HA       ALA  66   8.310   0.653   3.678
  558    HB1  ALA  66           1HB      ALA  66   7.662   0.072   1.375
  559    HB2  ALA  66           2HB      ALA  66   9.136  -0.792   1.872
  560    HB3  ALA  66           3HB      ALA  66   7.575  -1.645   1.834
  561    H    ALA  67           HN       ALA  67   6.112  -2.130   3.992
  562    HA   ALA  67           HA       ALA  67   3.748  -0.721   3.285
  563    HB1  ALA  67           1HB      ALA  67   2.550  -2.630   4.283
  564    HB2  ALA  67           2HB      ALA  67   3.903  -3.170   3.263
  565    HB3  ALA  67           3HB      ALA  67   4.064  -3.182   5.035
  566    H    GLU  68           HN       GLU  68   5.565  -0.839   6.305
  567    HA   GLU  68           HA       GLU  68   3.253   0.409   7.670
  568    HB2  GLU  68           2HB      GLU  68   4.498   0.092   9.739
  569    HB3  GLU  68           3HB      GLU  68   4.281  -1.432   8.846
  570    HG2  GLU  68           2HG      GLU  68   6.629  -1.131   7.984
  571    HG3  GLU  68           3HG      GLU  68   6.799   0.207   9.140
  572    HE2  GLU  68           2HE      GLU  68   6.638  -2.079  11.863
  573    H    MET  69           HN       MET  69   5.852   1.360   5.845
  574    HA   MET  69           HA       MET  69   6.173   3.904   7.330
  575    HB2  MET  69           2HB      MET  69   7.571   2.760   4.895
  576    HB3  MET  69           3HB      MET  69   7.830   4.416   5.494
  577    HG2  MET  69           2HG      MET  69   8.580   3.483   7.657
  578    HG3  MET  69           3HG      MET  69   8.381   1.848   7.004
  579    HE1  MET  69           3HE      MET  69  10.878   1.262   7.654
  580    HE2  MET  69           1HE      MET  69  12.284   2.245   7.187
  581    HE3  MET  69           2HE      MET  69  11.082   2.899   8.322
  582    H    ILE  70           HN       ILE  70   4.187   2.503   5.004
  583    HA   ILE  70           HA       ILE  70   3.833   4.992   3.480
  584    HB   ILE  70           HB       ILE  70   2.463   2.286   3.209
  585   HG12  ILE  70          2HG1      ILE  70   4.614   3.608   1.526
  586   HG13  ILE  70          3HG1      ILE  70   4.867   2.265   2.666
  587   HG21  ILE  70          1HG2      ILE  70   1.624   3.157   1.064
  588   HG22  ILE  70          2HG2      ILE  70   1.042   4.135   2.431
  589   HG23  ILE  70          3HG2      ILE  70   2.372   4.733   1.410
  590   HD11  ILE  70          3HD1      ILE  70   3.148   2.183   0.173
  591   HD12  ILE  70          1HD1      ILE  70   4.759   1.456   0.344
  592   HD13  ILE  70          2HD1      ILE  70   3.403   0.840   1.312
  593    H    GLU  71           HN       GLU  71   2.489   6.503   4.105
  594    HA   GLU  71           HA       GLU  71   0.332   6.005   6.007
  595    HB2  GLU  71           2HB      GLU  71   1.611   8.132   5.962
  596    HB3  GLU  71           3HB      GLU  71   0.991   8.450   4.323
  597    HG2  GLU  71           2HG      GLU  71  -1.001   9.163   5.076
  598    HG3  GLU  71           3HG      GLU  71  -1.088   7.917   6.339
  599    HE2  GLU  71           2HE      GLU  71   0.893  10.107   8.447
  600    H    VAL  72           HN       VAL  72  -1.504   5.018   5.339
  601    HA   VAL  72           HA       VAL  72  -2.392   5.634   2.569
  602    HB   VAL  72           HB       VAL  72  -3.476   3.378   2.551
  603   HG11  VAL  72          1HG1      VAL  72  -1.413   2.131   2.099
  604   HG12  VAL  72          2HG1      VAL  72  -1.340   3.778   1.432
  605   HG13  VAL  72          3HG1      VAL  72  -0.471   3.386   2.935
  606   HG21  VAL  72          3HG2      VAL  72  -3.597   3.017   4.971
  607   HG22  VAL  72          1HG2      VAL  72  -2.734   1.684   4.170
  608   HG23  VAL  72          2HG2      VAL  72  -1.821   2.929   5.053
  609    H    GLU  73           HN       GLU  73  -4.654   5.426   2.153
  610    HA   GLU  73           HA       GLU  73  -6.343   5.923   4.558
  611    HB2  GLU  73           2HB      GLU  73  -6.185   7.863   3.044
  612    HB3  GLU  73           3HB      GLU  73  -6.723   6.844   1.687
  613    HG2  GLU  73           2HG      GLU  73  -8.593   8.123   2.412
  614    HG3  GLU  73           3HG      GLU  73  -8.857   6.446   2.939
  615    HE2  GLU  73           2HE      GLU  73  -8.404   9.265   5.677
  616    H    LEU  74           HN       LEU  74  -7.892   4.456   4.939
  617    HA   LEU  74           HA       LEU  74  -8.255   2.242   3.066
  618    HB2  LEU  74           2HB      LEU  74  -8.287   2.253   5.691
  619    HB3  LEU  74           3HB      LEU  74  -9.979   2.765   5.477
  620    HG   LEU  74           HG       LEU  74  -9.725   0.342   5.879
  621   HD11  LEU  74          1HD1      LEU  74 -11.173  -0.429   4.045
  622   HD12  LEU  74          2HD1      LEU  74 -11.666   1.174   4.637
  623   HD13  LEU  74          3HD1      LEU  74 -10.761   1.027   3.112
  624   HD21  LEU  74          3HD2      LEU  74  -7.559   0.031   4.776
  625   HD22  LEU  74          1HD2      LEU  74  -8.772  -1.092   4.122
  626   HD23  LEU  74          2HD2      LEU  74  -8.310   0.354   3.195
  627    H    GLU  75           HN       GLU  75  -9.463   2.583   1.282
  628    HA   GLU  75           HA       GLU  75 -11.354   4.756   1.187
  629    HB2  GLU  75           2HB      GLU  75  -9.977   3.824  -0.742
  630    HB3  GLU  75           3HB      GLU  75 -11.153   2.490  -0.796
  631    HG2  GLU  75           2HG      GLU  75 -11.637   4.298  -2.421
  632    HG3  GLU  75           3HG      GLU  75 -12.954   4.018  -1.261
  633    HE2  GLU  75           2HE      GLU  75 -12.672   7.209   0.033
  634    H    HIS  76           HN       HIS  76 -13.190   4.715   2.216
  635    HA   HIS  76           HA       HIS  76 -14.345   2.230   3.132
  636    HB2  HIS  76           2HB      HIS  76 -15.436   5.065   3.237
  637    HB3  HIS  76           3HB      HIS  76 -16.040   3.677   4.160
  638    HD1  HIS  76           1HD      HIS  76 -13.305   6.233   4.074
  639    HD2  HIS  76           2HD      HIS  76 -14.401   2.887   6.327
  640    HE1  HIS  76           1HE      HIS  76 -11.900   6.307   6.187
  641    HE2  HIS  76           2HE      HIS  76 -12.572   4.273   7.543
  642    H    HIS  77           HN       HIS  77 -16.528   1.543   2.746
  643    HA   HIS  77           HA       HIS  77 -17.459   2.218   0.009
  644    HB2  HIS  77           2HB      HIS  77 -18.278  -0.050   1.858
  645    HB3  HIS  77           3HB      HIS  77 -18.857   0.207   0.202
  646    HD1  HIS  77           1HD      HIS  77 -17.023  -0.059  -1.739
  647    HD2  HIS  77           2HD      HIS  77 -15.881  -1.399   2.053
  648    HE1  HIS  77           1HE      HIS  77 -14.973  -1.508  -2.086
  649    HE2  HIS  77           2HE      HIS  77 -14.279  -2.309   0.216
  650    H    HIS  78           HN       HIS  78 -18.726   3.973   0.075
  651    HA   HIS  78           HA       HIS  78 -20.340   4.379   2.538
  652    HB2  HIS  78           2HB      HIS  78 -20.254   6.781   1.977
  653    HB3  HIS  78           3HB      HIS  78 -18.639   6.080   2.188
  654    HD1  HIS  78           1HD      HIS  78 -17.022   6.232   0.245
  655    HD2  HIS  78           2HD      HIS  78 -20.906   7.403  -0.772
  656    HE1  HIS  78           1HE      HIS  78 -16.870   7.262  -2.065
  657    HE2  HIS  78           2HE      HIS  78 -19.229   7.965  -2.680
  658    H    HIS  79           HN       HIS  79 -22.369   5.543   2.341
  659    HA   HIS  79           HA       HIS  79 -24.013   4.564   0.169
  660    HB2  HIS  79           2HB      HIS  79 -24.459   6.418   2.511
  661    HB3  HIS  79           3HB      HIS  79 -25.689   6.228   1.248
  662    HD1  HIS  79           1HD      HIS  79 -23.747   3.183   2.192
  663    HD2  HIS  79           2HD      HIS  79 -27.373   5.009   3.177
  664    HE1  HIS  79           1HE      HIS  79 -25.105   1.440   3.430
  665    HE2  HIS  79           2HE      HIS  79 -27.302   2.555   4.032
  666    H    HIS  80           HN       HIS  80 -24.405   5.501  -1.735
  667    HA   HIS  80           HA       HIS  80 -23.073   7.943  -2.466
  668    HB2  HIS  80           2HB      HIS  80 -24.026   7.633  -4.627
  669    HB3  HIS  80           3HB      HIS  80 -23.626   6.017  -4.015
  670    HD1  HIS  80           1HD      HIS  80 -26.569   8.258  -4.812
  671    HD2  HIS  80           2HD      HIS  80 -25.806   4.310  -3.663
  672    HE1  HIS  80           1HE      HIS  80 -28.754   7.002  -5.090
  673    HE2  HIS  80           2HE      HIS  80 -28.283   4.608  -4.391
  674    H    HIS  81           HN       HIS  81 -24.141   9.860  -3.343
  675    HA   HIS  81           HA       HIS  81 -26.862  10.295  -2.208
  676    HB2  HIS  81           2HB      HIS  81 -24.561  12.254  -2.465
  677    HB3  HIS  81           3HB      HIS  81 -26.237  12.741  -2.148
  678    HD1  HIS  81           1HD      HIS  81 -27.082  12.575   0.218
  679    HD2  HIS  81           2HD      HIS  81 -23.365  10.746  -0.311
  680    HE1  HIS  81           1HE      HIS  81 -26.250  11.985   2.537
  681    HE2  HIS  81           2HE      HIS  81 -23.992  10.872   2.210