*HEADER    VIRAL PROTEIN                           27-FEB-14   2MLG              
*TITLE     STF76 FROM THE SULFOLOBUS ISLANDICUS PLASMID-VIRUS PSSVX              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: STF76;                                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SULFOLOBUS ISLANDICUS;                          
*SOURCE   3 ORGANISM_TAXID: 426118;                                              
*SOURCE   4 STRAIN: M.16.4 / KAMCHATKA #3;                                       
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR: PET-30A(+)                                 
*KEYWDS    WINGED HELIX DOMAIN, VIRAL PROTEIN                                    
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    L.RUSSO                                                               
*REVDAT   1   12-MAR-14 2MLG    0                                                


   loop_
      _Atom_shift_assign_ID
      _Residue_seq_code
      _Residue_label
      _Atom_name
      _Atom_type
      _Chem_shift_value
      _Chem_shift_value_error
      _Chem_shift_ambiguity_code

         1    3   LYS  CA    C  57.000 0.300   1  
         2    3   LYS  H     H   8.368 0.020   1  
         3    3   LYS  HA    H   4.022 0.020   1  
         8    3   LYS  N     N 125.699 0.300   1  
        28    7   SER  CA    C  57.119 0.300   1  
        29    7   SER  H     H   8.615 0.020   1  
        30    7   SER  HA    H   4.279 0.020   1  
        33    7   SER  N     N 120.078 0.300   1  
        34    8   LEU  CA    C  58.493 0.300   1  
        35    8   LEU  H     H   8.719 0.020   1  
        36    8   LEU  HA    H   3.923 0.020   1  
        41    8   LEU  N     N 124.468 0.300   1  
        42    9   THR  CA    C  68.469 0.300   1  
        43    9   THR  H     H   7.986 0.020   1  
        44    9   THR  HA    H   3.344 0.020   1  
        47    9   THR  N     N 115.018 0.300   1  
        48   10   GLN  CA    C  59.628 0.300   1  
        49   10   GLN  H     H   7.398 0.020   1  
        50   10   GLN  HA    H   3.729 0.020   1  
        53   10   GLN  N     N 120.628 0.300   1  
        54   11   LEU  CA    C  58.553 0.300   1  
        55   11   LEU  H     H   8.324 0.020   1  
        56   11   LEU  HA    H   3.959 0.020   1  
        61   11   LEU  N     N 121.103 0.300   1  
        62   12   ILE  CA    C  66.319 0.300   1  
        63   12   ILE  H     H   8.149 0.020   1  
        64   12   ILE  HA    H   3.226 0.020   1  
        70   12   ILE  N     N 119.788 0.300   1  
        71   13   LEU  CA    C  58.911 0.300   1  
        72   13   LEU  H     H   7.847 0.020   1  
        73   13   LEU  HA    H   3.692 0.020   1  
        76   13   LEU  N     N 119.842 0.300   1  
        77   14   ILE  CA    C  65.243 0.300   1  
        78   14   ILE  H     H   8.323 0.020   1  
        79   14   ILE  HA    H   3.519 0.020   1  
        82   14   ILE  N     N 123.069 0.300   1  
        83   15   ARG  CA    C  57.717 0.300   1  
        84   15   ARG  H     H   7.796 0.020   1  
        85   15   ARG  HA    H   3.619 0.020   1  
        90   15   ARG  N     N 124.216 0.300   1  
        91   16   LEU  CA    C  56.641 0.300   1  
        92   16   LEU  H     H   8.450 0.020   1  
        93   16   LEU  HA    H   4.371 0.020   1  
        98   16   LEU  N     N 118.657 0.300   1  
        99   17   SER  CA    C  61.540 0.300   1  
       100   17   SER  H     H   7.864 0.020   1  
       101   17   SER  HA    H   3.949 0.020   1  
       104   17   SER  N     N 116.873 0.300   1  
       105   18   ASN  CA    C  55.626 0.300   1  
       106   18   ASN  H     H   7.804 0.020   1  
       107   18   ASN  HA    H   4.491 0.020   1  
       110   18   ASN  N     N 118.994 0.300   1  
       111   19   ARG  CA    C  54.610 0.300   1  
       112   19   ARG  H     H   8.343 0.020   1  
       113   19   ARG  HA    H   4.297 0.020   1  
       116   19   ARG  N     N 117.557 0.300   1  
       122   21   CYS  CA    C  58.254 0.300   1  
       123   21   CYS  H     H   7.950 0.020   1  
       124   21   CYS  HA    H   4.902 0.020   1  
       127   21   CYS  N     N 117.667 0.300   1  
       128   22   GLN  CA    C  53.714 0.300   1  
       129   22   GLN  H     H   8.615 0.020   1  
       130   22   GLN  HA    H   5.104 0.020   1  
       131   22   GLN  N     N 121.882 0.300   1  
       132   23   THR  CA    C  60.763 0.300   1  
       133   23   THR  H     H   9.557 0.020   1  
       134   23   THR  HA    H   4.847 0.020   1  
       136   23   THR  N     N 116.183 0.300   1  
       137   24   LEU  CA    C  59.270 0.300   1  
       138   24   LEU  H     H   9.257 0.020   1  
       139   24   LEU  HA    H   3.777 0.020   1  
       144   24   LEU  N     N 123.325 0.300   1  
       145   25   GLU  CA    C  61.241 0.300   1  
       146   25   GLU  H     H   9.030 0.020   1  
       147   25   GLU  HA    H   3.923 0.020   1  
       150   25   GLU  N     N 120.097 0.300   1  
       151   26   GLU  CA    C  59.270 0.300   1  
       152   26   GLU  H     H   7.734 0.020   1  
       153   26   GLU  HA    H   3.912 0.020   1  
       156   26   GLU  N     N 122.438 0.300   1  
       157   27   LEU  CA    C  58.314 0.300   1  
       158   27   LEU  H     H   8.350 0.020   1  
       159   27   LEU  HA    H   4.132 0.020   1  
       164   27   LEU  N     N 123.263 0.300   1  
       165   28   GLU  CA    C  60.942 0.300   1  
       166   28   GLU  H     H   9.362 0.020   1  
       167   28   GLU  HA    H   3.601 0.020   1  
       170   28   GLU  N     N 129.504 0.300   1  
       171   29   GLU  CA    C  59.389 0.300   1  
       172   29   GLU  H     H   7.741 0.020   1  
       173   29   GLU  HA    H   3.857 0.020   1  
       176   29   GLU  N     N 121.392 0.300   1  
       177   30   PHE  CA    C  60.823 0.300   1  
       178   30   PHE  H     H   7.392 0.020   1  
       179   30   PHE  HA    H   4.297 0.020   1  
       182   30   PHE  N     N 117.204 0.300   1  
       183   31   THR  CA    C  63.989 0.300   1  
       184   31   THR  H     H   8.220 0.020   1  
       185   31   THR  HA    H   3.472 0.020   1  
       188   31   THR  N     N 107.601 0.300   1  
       189   32   GLN  CA    C  57.478 0.300   1  
       190   32   GLN  H     H   7.974 0.020   1  
       191   32   GLN  HA    H   3.729 0.020   1  
       194   32   GLN  N     N 116.862 0.300   1  
       200   34   LYS  CA    C  56.283 0.300   1  
       201   34   LYS  H     H   8.194 0.020   1  
       202   34   LYS  HA    H   4.059 0.020   1  
       207   34   LYS  N     N 121.107 0.300   1  
       208   35   ARG  CA    C  61.002 0.300   1  
       209   35   ARG  H     H   8.690 0.020   1  
       210   35   ARG  HA    H   4.269 0.020   1  
       217   35   ARG  N     N 126.754 0.300   1  
       218   36   GLU  CA    C  60.619 0.300   1  
       219   36   GLU  H     H   9.236 0.020   1  
       220   36   GLU  HA    H   3.857 0.020   1  
       221   36   GLU  N     N 117.537 0.300   1  
       222   37   VAL  CA    C  65.064 0.300   1  
       223   37   VAL  H     H   6.681 0.020   1  
       224   37   VAL  HA    H   3.674 0.020   1  
       228   37   VAL  N     N 121.054 0.300   1  
       229   38   LEU  CA    C  58.792 0.300   1  
       230   38   LEU  H     H   8.140 0.020   1  
       231   38   LEU  HA    H   3.619 0.020   1  
       234   38   LEU  N     N 126.417 0.300   1  
       235   39   LEU  CA    C  58.911 0.300   1  
       236   39   LEU  H     H   8.492 0.020   1  
       237   39   LEU  HA    H   3.766 0.020   1  
       242   39   LEU  N     N 120.272 0.300   1  
       243   40   VAL  CA    C  66.916 0.300   1  
       244   40   VAL  H     H   7.508 0.020   1  
       245   40   VAL  HA    H   3.601 0.020   1  
       249   40   VAL  N     N 122.614 0.300   1  
       250   41   THR  CA    C  67.812 0.300   1  
       251   41   THR  H     H   7.626 0.020   1  
       252   41   THR  HA    H   3.678 0.020   1  
       254   41   THR  N     N 120.141 0.300   1  
       255   42   LEU  CA    C  58.433 0.300   1  
       256   42   LEU  H     H   8.644 0.020   1  
       257   42   LEU  HA    H   3.629 0.020   1 
       262   42   LEU  N     N 123.404 0.300   1  
       263   43   THR  CA    C  67.573 0.300   1  
       264   43   THR  H     H   8.169 0.020   1  
       265   43   THR  HA    H   3.839 0.020   1  
       268   43   THR  N     N 119.278 0.300   1  
       269   44   ARG  CA    C  59.867 0.300   1  
       270   44   ARG  H     H   7.748 0.020   1  
       271   44   ARG  HA    H   4.004 0.020   1  
       276   44   ARG  N     N 124.625 0.300   1  
       277   45   LEU  CA    C  58.135 0.300   1  
       278   45   LEU  H     H   7.963 0.020   1  
       279   45   LEU  HA    H   3.894 0.020   1  
       284   45   LEU  N     N 120.115 0.300   1  
       285   46   HIS  CA    C  59.688 0.300   1  
       286   46   HIS  H     H   8.454 0.020   1  
       287   46   HIS  HA    H   4.407 0.020   1  
       290   46   HIS  N     N 123.297 0.300   1  
       291   47   GLN  CA    C  59.270 0.300   1  
       292   47   GLN  H     H   8.626 0.020   1  
       293   47   GLN  HA    H   3.821 0.020   1  
       298   47   GLN  N     N 124.648 0.300   1  
       299   48   ARG  CA    C  56.641 0.300   1  
       300   48   ARG  H     H   7.628 0.020   1  
       301   48   ARG  HA    H   4.169 0.020   1  
       304   48   ARG  N     N 117.047 0.300   1  
       310   50   VAL  CA    C  64.168 0.300   1  
       311   50   VAL  H     H   7.787 0.020   1  
       312   50   VAL  HA    H   3.801 0.020   1  
       316   50   VAL  N     N 118.932 0.300   1  
       317   51   ILE  CA    C  58.075 0.300   1  
       318   51   ILE  H     H   6.766 0.020   1  
       319   51   ILE  HA    H   5.214 0.020   1  
       323   51   ILE  N     N 110.494 0.300   1  
       324   52   TYR  CA    C  55.805 0.300   1  
       325   52   TYR  H     H   9.025 0.020   1  
       326   52   TYR  HA    H   4.884 0.020   1  
       329   52   TYR  N     N 120.330 0.300   1  
       330   53   ARG  CA    C  53.834 0.300   1  
       331   53   ARG  H     H   8.511 0.020   1  
       332   53   ARG  HA    H   4.957 0.020   1  
       337   53   ARG  N     N 120.608 0.300   1  
       344   55   TRP  CA    C  56.462 0.300   1  
       345   55   TRP  H     H   8.457 0.020   1  
       346   55   TRP  HA    H   4.996 0.020   1  
       349   55   TRP  N     N 121.803 0.300   1  
       350   56   ARG  CA    C  55.088 0.300   1  
       351   56   ARG  H     H   9.555 0.020   1  
       352   56   ARG  HA    H   4.462 0.020   1  
       355   56   ARG  N     N 127.059 0.300   1  
       356   57   HIS  CA    C  55.984 0.300   1  
       357   57   HIS  H     H   9.019 0.020   1  
       358   57   HIS  HA    H   5.089 0.020   1  
       361   57   HIS  N     N 127.930 0.300   1  
       362   58   PHE  CA    C  58.195 0.300   1  
       363   58   PHE  H     H   8.707 0.020   1  
       364   58   PHE  HA    H   4.627 0.020   1  
       367   58   PHE  N     N 125.912 0.300   1  
       368   59   SER  CA    C  58.433 0.300   1  
       369   59   SER  H     H   8.829 0.020   1  
       370   59   SER  HA    H   3.727 0.020   1  
       373   59   SER  N     N 124.434 0.300   1  
       395   63   TYR  CA    C  56.522 0.300   1  
       396   63   TYR  H     H   8.883 0.020   1  
       397   63   TYR  HA    H   4.902 0.020   1  
       400   63   TYR  N     N 122.435 0.300   1  
       401   64   ARG  CA    C  56.402 0.300   1  
       402   64   ARG  H     H   9.197 0.020   1  
       403   64   ARG  HA    H   3.766 0.020   1  
       406   64   ARG  N     N 127.580 0.300   1  
       407   65   GLU  CA    C  53.834 0.300   1  
       408   65   GLU  H     H   8.525 0.020   1  
       409   65   GLU  HA    H   4.426 0.020   1  
       410   65   GLU  N     N 124.048 0.300   1  
       411   66   TYR  CA    C  57.358 0.300   1  
       412   66   TYR  H     H   8.578 0.020   1  
       413   66   TYR  HA    H   4.536 0.020   1  
       415   66   TYR  N     N 121.860 0.300   1  
       416   67   CYS  CA    C  53.177 0.300   1  
       417   67   CYS  H     H   8.313 0.020   1  
       418   67   CYS  HA    H   4.756 0.020   1  
       421   67   CYS  N     N 119.180 0.300   1  
       440   71   ARG  CA    C  56.940 0.300   1  
       441   71   ARG  H     H   8.334 0.020   1  
       442   71   ARG  HA    H   4.093 0.020   1  
       445   71   ARG  N     N 125.371 0.300   1  
       458   74   LEU  CA    C  55.865 0.300   1  
       459   74   LEU  H     H   8.038 0.020   1  
       460   74   LEU  HA    H   4.114 0.020   1  
       463   74   LEU  N     N 123.444 0.300   1  
       475   77   LEU  CA    C  56.343 0.300   1  
       476   77   LEU  H     H   7.902 0.020   1  
       477   77   LEU  HA    H   3.978 0.020   1  
       480   77   LEU  N     N 123.629 0.300   1  
       481   78   GLU  CA    C  57.239 0.300   1  
       482   78   GLU  H     H   7.994 0.020   1  
       483   78   GLU  HA    H   3.949 0.020   1  
       486   78   GLU  N     N 120.501 0.300   1  
       
stop_

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    LYS   3           H        LYS   3   5.542 -14.154 -10.545
    2    HA   LYS   3           HA       LYS   3   5.287 -11.975  -8.750
    3    HB2  LYS   3           1HB      LYS   3   3.049 -12.371 -10.670
    4    HB3  LYS   3           2HB      LYS   3   2.637 -12.092  -8.962
    5    HG2  LYS   3           1HG      LYS   3   2.587  -9.949  -9.947
    6    HG3  LYS   3           2HG      LYS   3   4.151 -10.031  -9.101
    7    HD2  LYS   3           1HD      LYS   3   5.344 -10.396 -11.126
    8    HD3  LYS   3           2HD      LYS   3   3.847 -10.726 -12.031
    9    HE2  LYS   3           1HE      LYS   3   4.615  -8.065 -10.796
   10    HE3  LYS   3           2HE      LYS   3   4.764  -8.483 -12.517
   11    HZ1  LYS   3           3HZ      LYS   3   2.243  -8.387 -10.991
   12    HZ2  LYS   3           1HZ      LYS   3   2.751  -7.253 -12.074
   13    HZ3  LYS   3           2HZ      LYS   3   2.380  -8.776 -12.587
   14    H    ALA   4           H        ALA   4   3.912 -15.017  -9.921
   15    HA   ALA   4           HA       ALA   4   2.629 -15.702  -7.451
   16    HB1  ALA   4           1HB      ALA   4   2.498 -17.972  -8.403
   17    HB2  ALA   4           2HB      ALA   4   2.012 -16.738  -9.590
   18    HB3  ALA   4           3HB      ALA   4   3.620 -17.492  -9.697
   19    H    LYS   5           H        LYS   5   5.916 -15.981  -8.574
   20    HA   LYS   5           HA       LYS   5   6.776 -18.010  -6.708
   21    HB2  LYS   5           1HB      LYS   5   8.243 -15.807  -8.160
   22    HB3  LYS   5           2HB      LYS   5   9.039 -17.032  -7.146
   23    HG2  LYS   5           1HG      LYS   5   8.200 -18.809  -8.624
   24    HG3  LYS   5           2HG      LYS   5   7.393 -17.589  -9.638
   25    HD2  LYS   5           1HD      LYS   5   9.573 -16.566 -10.148
   26    HD3  LYS   5           2HD      LYS   5  10.382 -17.786  -9.133
   27    HE2  LYS   5           1HE      LYS   5   9.562 -19.568 -10.601
   28    HE3  LYS   5           2HE      LYS   5   8.722 -18.365 -11.606
   29    HZ1  LYS   5           3HZ      LYS   5  11.640 -18.524 -11.203
   30    HZ2  LYS   5           1HZ      LYS   5  10.832 -19.001 -12.559
   31    HZ3  LYS   5           2HZ      LYS   5  10.861 -17.407 -12.134
   32    H    LEU   6           H        LEU   6   6.223 -14.577  -6.432
   33    HA   LEU   6           HA       LEU   6   7.554 -14.547  -3.765
   34    HB2  LEU   6           1HB      LEU   6   6.285 -12.468  -5.423
   35    HB3  LEU   6           2HB      LEU   6   7.141 -12.046  -3.922
   36    HG   LEU   6           HG       LEU   6   8.375 -13.212  -6.448
   37   HD11  LEU   6          1HD1      LEU   6   9.549 -10.998  -6.576
   38   HD12  LEU   6          2HD1      LEU   6   7.782 -10.798  -6.641
   39   HD13  LEU   6          3HD1      LEU   6   8.662 -10.462  -5.131
   40   HD21  LEU   6          3HD2      LEU   6   9.479 -14.055  -4.459
   41   HD22  LEU   6          1HD2      LEU   6  10.540 -12.897  -5.298
   42   HD23  LEU   6          2HD2      LEU   6   9.667 -12.402  -3.827
   43    H    SER   7           H        SER   7   6.534 -13.853  -1.893
   44    HA   SER   7           HA       SER   7   3.696 -14.533  -1.556
   45    HB2  SER   7           1HB      SER   7   3.933 -14.037   0.615
   46    HB3  SER   7           2HB      SER   7   5.434 -14.844   0.107
   47    HG   SER   7           HG       SER   7   6.003 -13.099   1.334
   48    H    LEU   8           H        LEU   8   2.134 -13.009  -0.689
   49    HA   LEU   8           HA       LEU   8   1.888 -10.591  -2.240
   50    HB2  LEU   8           1HB      LEU   8   0.614 -11.604   0.213
   51    HB3  LEU   8           2HB      LEU   8  -0.042 -10.147  -0.568
   52    HG   LEU   8           HG       LEU   8   0.052 -12.957  -1.728
   53   HD11  LEU   8          1HD1      LEU   8  -2.448 -12.766  -1.663
   54   HD12  LEU   8          2HD1      LEU   8  -1.745 -12.600  -0.036
   55   HD13  LEU   8          3HD1      LEU   8  -2.291 -11.157  -0.923
   56   HD21  LEU   8          3HD2      LEU   8   0.465 -11.309  -3.456
   57   HD22  LEU   8          1HD2      LEU   8  -1.158 -12.007  -3.660
   58   HD23  LEU   8          2HD2      LEU   8  -0.969 -10.382  -2.957
   59    H    THR   9           H        THR   9   3.189 -11.285   0.947
   60    HA   THR   9           HA       THR   9   3.534  -8.519   1.729
   61    HB   THR   9           HB       THR   9   5.099 -11.007   2.536
   62    HG1  THR   9           1HG      THR   9   3.715 -10.842   4.397
   63   HG21  THR   9          3HG2      THR   9   4.940  -8.248   3.810
   64   HG22  THR   9          1HG2      THR   9   5.795  -9.656   4.480
   65   HG23  THR   9          2HG2      THR   9   6.351  -8.920   2.958
   66    H    GLN  10           H        GLN  10   5.695 -10.868   0.138
   67    HA   GLN  10           HA       GLN  10   7.871  -9.012  -0.183
   68    HB2  GLN  10           1HB      GLN  10   7.055 -11.515  -1.665
   69    HB3  GLN  10           2HB      GLN  10   8.536 -10.598  -2.031
   70    HG2  GLN  10           1HG      GLN  10   9.420 -11.216   0.392
   71    HG3  GLN  10           2HG      GLN  10   7.712 -11.704   0.509
   72   HE21  GLN  10          2HE2      GLN  10  10.349 -13.155   0.885
   73   HE22  GLN  10          1HE2      GLN  10  10.210 -14.565  -0.111
   74    H    LEU  11           H        LEU  11   5.062  -9.793  -2.185
   75    HA   LEU  11           HA       LEU  11   5.955  -8.354  -4.510
   76    HB2  LEU  11           1HB      LEU  11   3.372  -9.182  -3.394
   77    HB3  LEU  11           2HB      LEU  11   3.350  -8.337  -4.960
   78    HG   LEU  11           HG       LEU  11   4.787 -10.957  -4.385
   79   HD11  LEU  11          1HD1      LEU  11   3.018 -11.981  -5.840
   80   HD12  LEU  11          2HD1      LEU  11   2.308 -11.222  -4.395
   81   HD13  LEU  11          3HD1      LEU  11   2.226 -10.393  -5.966
   82   HD21  LEU  11          3HD2      LEU  11   5.893  -9.636  -6.091
   83   HD22  LEU  11          1HD2      LEU  11   5.109 -11.050  -6.833
   84   HD23  LEU  11          2HD2      LEU  11   4.361  -9.440  -6.975
   85    H    ILE  12           H        ILE  12   3.856  -7.403  -1.794
   86    HA   ILE  12           HA       ILE  12   3.395  -4.721  -2.789
   87    HB   ILE  12           HB       ILE  12   3.221  -5.939   0.001
   88   HG12  ILE  12          1HG1      ILE  12   1.043  -5.045  -1.863
   89   HG13  ILE  12          2HG1      ILE  12   1.652  -6.713  -1.756
   90   HG21  ILE  12          1HG2      ILE  12   2.031  -3.872   0.647
   91   HG22  ILE  12          2HG2      ILE  12   3.703  -3.521   0.153
   92   HG23  ILE  12          3HG2      ILE  12   2.357  -3.181  -0.959
   93   HD11  ILE  12          3HD1      ILE  12   0.368  -5.142   0.505
   94   HD12  ILE  12          1HD1      ILE  12  -0.409  -6.434  -0.437
   95   HD13  ILE  12          2HD1      ILE  12   0.980  -6.809   0.612
   96    H    LEU  13           H        LEU  13   5.772  -6.045  -0.511
   97    HA   LEU  13           HA       LEU  13   6.872  -3.467   0.157
   98    HB2  LEU  13           1HB      LEU  13   7.849  -6.239   0.216
   99    HB3  LEU  13           2HB      LEU  13   8.883  -4.967   0.908
  100    HG   LEU  13           HG       LEU  13   6.102  -5.753   1.863
  101   HD11  LEU  13          1HD1      LEU  13   7.311  -6.521   3.923
  102   HD12  LEU  13          2HD1      LEU  13   7.868  -7.401   2.481
  103   HD13  LEU  13          3HD1      LEU  13   8.858  -6.086   3.159
  104   HD21  LEU  13          3HD2      LEU  13   6.491  -3.374   2.120
  105   HD22  LEU  13          1HD2      LEU  13   6.511  -4.168   3.714
  106   HD23  LEU  13          2HD2      LEU  13   8.040  -3.685   2.939
  107    H    ILE  14           H        ILE  14   7.777  -5.917  -2.252
  108    HA   ILE  14           HA       ILE  14  10.083  -4.410  -3.211
  109    HB   ILE  14           HB       ILE  14   8.435  -6.680  -4.410
  110   HG12  ILE  14          1HG1      ILE  14  11.259  -6.675  -3.390
  111   HG13  ILE  14          2HG1      ILE  14   9.843  -7.098  -2.401
  112   HG21  ILE  14          1HG2      ILE  14  10.213  -6.851  -6.118
  113   HG22  ILE  14          2HG2      ILE  14   9.385  -5.279  -6.212
  114   HG23  ILE  14          3HG2      ILE  14  10.991  -5.395  -5.456
  115   HD11  ILE  14          3HD1      ILE  14  10.733  -8.520  -4.934
  116   HD12  ILE  14          1HD1      ILE  14  10.954  -9.116  -3.274
  117   HD13  ILE  14          2HD1      ILE  14   9.316  -8.944  -3.947
  118    H    ARG  15           H        ARG  15   6.688  -4.591  -4.167
  119    HA   ARG  15           HA       ARG  15   6.956  -2.880  -6.468
  120    HB2  ARG  15           1HB      ARG  15   5.047  -4.241  -6.193
  121    HB3  ARG  15           2HB      ARG  15   4.608  -3.387  -4.695
  122    HG2  ARG  15           1HG      ARG  15   3.216  -2.627  -6.548
  123    HG3  ARG  15           2HG      ARG  15   4.276  -1.314  -5.977
  124    HD2  ARG  15           1HD      ARG  15   5.802  -1.841  -7.848
  125    HD3  ARG  15           2HD      ARG  15   4.577  -2.983  -8.449
  126    HE   ARG  15           HE       ARG  15   3.326  -0.383  -8.298
  127   HH11  ARG  15          1HH1      ARG  15   5.910  -1.910 -10.075
  128   HH12  ARG  15          2HH1      ARG  15   5.601  -0.855 -11.441
  129   HH21  ARG  15          1HH2      ARG  15   2.966   0.837  -9.851
  130   HH22  ARG  15          2HH2      ARG  15   3.923   0.711 -11.313
  131    H    LEU  16           H        LEU  16   6.453  -2.212  -3.026
  132    HA   LEU  16           HA       LEU  16   6.238   0.678  -3.509
  133    HB2  LEU  16           1HB      LEU  16   6.551  -1.048  -1.147
  134    HB3  LEU  16           2HB      LEU  16   6.377   0.707  -0.913
  135    HG   LEU  16           HG       LEU  16   4.318  -1.171  -2.138
  136   HD11  LEU  16          1HD1      LEU  16   2.966  -0.583  -0.108
  137   HD12  LEU  16          2HD1      LEU  16   4.501  -1.361   0.341
  138   HD13  LEU  16          3HD1      LEU  16   4.320   0.402   0.490
  139   HD21  LEU  16          3HD2      LEU  16   4.272   1.005  -3.208
  140   HD22  LEU  16          1HD2      LEU  16   2.833   0.803  -2.179
  141   HD23  LEU  16          2HD2      LEU  16   4.191   1.814  -1.625
  142    H    SER  17           H        SER  17   8.774  -1.610  -3.006
  143    HA   SER  17           HA       SER  17  10.908   0.237  -2.280
  144    HB2  SER  17           1HB      SER  17  11.107  -2.074  -1.974
  145    HB3  SER  17           2HB      SER  17  11.009  -2.339  -3.729
  146    HG   SER  17           HG       SER  17  13.165  -2.243  -2.963
  147    H    ASN  18           H        ASN  18   9.497  -0.911  -5.363
  148    HA   ASN  18           HA       ASN  18  11.367   0.578  -7.025
  149    HB2  ASN  18           1HB      ASN  18   8.664  -0.706  -7.885
  150    HB3  ASN  18           2HB      ASN  18   9.918   0.279  -8.679
  151   HD21  ASN  18          2HD2      ASN  18   8.960  -2.517  -9.070
  152   HD22  ASN  18          1HD2      ASN  18  10.390  -3.493  -9.003
  153    H    ARG  19           H        ARG  19   8.071   1.171  -5.839
  154    HA   ARG  19           HA       ARG  19   8.532   4.063  -6.454
  155    HB2  ARG  19           1HB      ARG  19   6.032   2.538  -7.023
  156    HB3  ARG  19           2HB      ARG  19   6.173   4.311  -6.983
  157    HG2  ARG  19           1HG      ARG  19   7.772   2.513  -8.829
  158    HG3  ARG  19           2HG      ARG  19   6.245   3.307  -9.283
  159    HD2  ARG  19           1HD      ARG  19   7.286   5.473  -8.857
  160    HD3  ARG  19           2HD      ARG  19   8.817   4.640  -8.503
  161    HE   ARG  19           HE       ARG  19   7.733   5.043 -11.258
  162   HH11  ARG  19          1HH1      ARG  19  10.101   3.455  -9.251
  163   HH12  ARG  19          2HH1      ARG  19  11.077   3.109 -10.665
  164   HH21  ARG  19          1HH2      ARG  19   8.842   4.661 -12.886
  165   HH22  ARG  19          2HH2      ARG  19  10.360   3.798 -12.739
  166    H    GLY  20           H        GLY  20   8.116   5.433  -4.866
  167    HA2  GLY  20           1HA      GLY  20   8.299   4.356  -2.282
  168    HA3  GLY  20           2HA      GLY  20   7.871   6.043  -2.647
  169    H    CYS  21           H        CYS  21   5.448   5.407  -4.100
  170    HA   CYS  21           HA       CYS  21   3.652   4.465  -1.848
  171    HB2  CYS  21           1HB      CYS  21   4.067   6.895  -1.727
  172    HB3  CYS  21           2HB      CYS  21   3.617   7.068  -3.440
  173    HG   CYS  21           HG       CYS  21   1.199   6.257  -3.153
  174    H    GLN  22           H        GLN  22   2.143   3.113  -2.588
  175    HA   GLN  22           HA       GLN  22   1.080   3.550  -5.351
  176    HB2  GLN  22           1HB      GLN  22   1.798   0.937  -4.009
  177    HB3  GLN  22           2HB      GLN  22   0.752   1.061  -5.444
  178    HG2  GLN  22           1HG      GLN  22   3.778   1.926  -5.514
  179    HG3  GLN  22           2HG      GLN  22   2.909   0.406  -5.830
  180   HE21  GLN  22          2HE2      GLN  22   2.771   3.900  -6.661
  181   HE22  GLN  22          1HE2      GLN  22   2.358   3.659  -8.327
  182    H    THR  23           H        THR  23  -1.058   2.776  -5.716
  183    HA   THR  23           HA       THR  23  -2.747   3.035  -3.291
  184    HB   THR  23           HB       THR  23  -4.618   3.202  -4.806
  185    HG1  THR  23           1HG      THR  23  -3.967   3.050  -7.184
  186   HG21  THR  23          3HG2      THR  23  -2.232   4.688  -5.977
  187   HG22  THR  23          1HG2      THR  23  -3.944   5.109  -6.227
  188   HG23  THR  23          2HG2      THR  23  -3.222   5.233  -4.604
  189    H    LEU  24           H        LEU  24  -4.594   1.603  -2.992
  190    HA   LEU  24           HA       LEU  24  -3.817  -1.151  -2.843
  191    HB2  LEU  24           1HB      LEU  24  -5.353  -0.128  -1.439
  192    HB3  LEU  24           2HB      LEU  24  -6.592   0.149  -2.685
  193    HG   LEU  24           HG       LEU  24  -6.690  -2.353  -3.013
  194   HD11  LEU  24          1HD1      LEU  24  -5.800  -3.771  -1.146
  195   HD12  LEU  24          2HD1      LEU  24  -4.491  -2.895  -1.976
  196   HD13  LEU  24          3HD1      LEU  24  -5.091  -2.319  -0.402
  197   HD21  LEU  24          3HD2      LEU  24  -8.393  -1.174  -1.752
  198   HD22  LEU  24          1HD2      LEU  24  -8.078  -2.762  -1.011
  199   HD23  LEU  24          2HD2      LEU  24  -7.414  -1.285  -0.270
  200    H    GLU  25           H        GLU  25  -5.574   0.682  -5.282
  201    HA   GLU  25           HA       GLU  25  -6.427  -1.665  -6.774
  202    HB2  GLU  25           1HB      GLU  25  -6.155   1.255  -7.495
  203    HB3  GLU  25           2HB      GLU  25  -6.801   0.010  -8.593
  204    HG2  GLU  25           1HG      GLU  25  -8.693  -0.407  -6.958
  205    HG3  GLU  25           2HG      GLU  25  -7.882   0.783  -5.915
  206    H    GLU  26           H        GLU  26  -3.641   0.513  -6.926
  207    HA   GLU  26           HA       GLU  26  -2.499  -0.717  -9.292
  208    HB2  GLU  26           1HB      GLU  26  -1.360   0.937  -7.041
  209    HB3  GLU  26           2HB      GLU  26  -0.378   0.325  -8.393
  210    HG2  GLU  26           1HG      GLU  26  -1.630   1.720 -10.001
  211    HG3  GLU  26           2HG      GLU  26  -2.832   1.989  -8.717
  212    H    LEU  27           H        LEU  27  -2.145  -1.286  -5.807
  213    HA   LEU  27           HA       LEU  27  -0.236  -3.446  -6.139
  214    HB2  LEU  27           1HB      LEU  27  -2.156  -2.634  -4.065
  215    HB3  LEU  27           2HB      LEU  27  -1.081  -4.010  -3.731
  216    HG   LEU  27           HG       LEU  27  -0.204  -1.152  -4.297
  217   HD11  LEU  27          1HD1      LEU  27   0.524  -1.165  -1.896
  218   HD12  LEU  27          2HD1      LEU  27  -1.228  -1.430  -2.041
  219   HD13  LEU  27          3HD1      LEU  27  -0.145  -2.804  -1.718
  220   HD21  LEU  27          3HD2      LEU  27   1.391  -2.773  -5.135
  221   HD22  LEU  27          1HD2      LEU  27   2.055  -1.955  -3.701
  222   HD23  LEU  27          2HD2      LEU  27   1.412  -3.610  -3.564
  223    H    GLU  28           H        GLU  28  -3.742  -3.220  -6.171
  224    HA   GLU  28           HA       GLU  28  -4.282  -6.042  -6.103
  225    HB2  GLU  28           1HB      GLU  28  -5.989  -4.322  -5.789
  226    HB3  GLU  28           2HB      GLU  28  -5.763  -3.790  -7.471
  227    HG2  GLU  28           1HG      GLU  28  -6.535  -6.162  -8.189
  228    HG3  GLU  28           2HG      GLU  28  -6.827  -6.385  -6.449
  229    H    GLU  29           H        GLU  29  -3.661  -3.816  -8.812
  230    HA   GLU  29           HA       GLU  29  -3.937  -5.892 -10.824
  231    HB2  GLU  29           1HB      GLU  29  -2.643  -3.165 -10.837
  232    HB3  GLU  29           2HB      GLU  29  -2.758  -4.221 -12.266
  233    HG2  GLU  29           1HG      GLU  29  -5.271  -4.077 -12.160
  234    HG3  GLU  29           2HG      GLU  29  -5.040  -3.173 -10.645
  235    H    PHE  30           H        PHE  30  -1.248  -4.611  -8.941
  236    HA   PHE  30           HA       PHE  30   0.833  -5.923 -10.454
  237    HB2  PHE  30           1HB      PHE  30   1.270  -4.038  -8.883
  238    HB3  PHE  30           2HB      PHE  30   0.811  -5.085  -7.521
  239    HD1  PHE  30           1HD      PHE  30   3.237  -4.744 -10.313
  240    HD2  PHE  30           2HD      PHE  30   2.364  -6.443  -6.492
  241    HE1  PHE  30           1HE      PHE  30   5.575  -5.526 -10.129
  242    HE2  PHE  30           2HE      PHE  30   4.702  -7.226  -6.303
  243    HZ   PHE  30           HZ       PHE  30   6.308  -6.767  -8.124
  244    H    THR  31           H        THR  31  -0.996  -6.872  -7.547
  245    HA   THR  31           HA       THR  31   0.502  -9.435  -7.472
  246    HB   THR  31           HB       THR  31  -0.613  -9.815  -5.339
  247    HG1  THR  31           1HG      THR  31  -1.945  -7.319  -5.613
  248   HG21  THR  31          3HG2      THR  31   0.317  -6.926  -5.578
  249   HG22  THR  31          1HG2      THR  31   0.201  -7.859  -4.068
  250   HG23  THR  31          2HG2      THR  31   1.369  -8.337  -5.322
  251    H    GLN  32           H        GLN  32  -2.489  -8.180  -8.624
  252    HA   GLN  32           HA       GLN  32  -4.514  -9.164  -9.191
  253    HB2  GLN  32           1HB      GLN  32  -2.700 -11.546  -9.629
  254    HB3  GLN  32           2HB      GLN  32  -4.388 -11.421 -10.178
  255    HG2  GLN  32           1HG      GLN  32  -2.082  -9.626 -11.348
  256    HG3  GLN  32           2HG      GLN  32  -2.877 -11.147 -11.819
  257   HE21  GLN  32          2HE2      GLN  32  -2.886  -7.806 -12.139
  258   HE22  GLN  32          1HE2      GLN  32  -4.488  -7.595 -12.766
  259    H    ALA  33           H        ALA  33  -3.683  -9.218  -6.406
  260    HA   ALA  33           HA       ALA  33  -5.183 -11.631  -5.505
  261    HB1  ALA  33           1HB      ALA  33  -4.392 -11.029  -3.250
  262    HB2  ALA  33           2HB      ALA  33  -3.037 -11.231  -4.386
  263    HB3  ALA  33           3HB      ALA  33  -3.574  -9.600  -3.920
  264    H    LYS  34           H        LYS  34  -6.700 -11.293  -3.666
  265    HA   LYS  34           HA       LYS  34  -8.706  -9.326  -4.389
  266    HB2  LYS  34           1HB      LYS  34  -8.377 -11.103  -1.968
  267    HB3  LYS  34           2HB      LYS  34  -9.799 -10.085  -2.291
  268    HG2  LYS  34           1HG      LYS  34 -10.213 -11.345  -4.377
  269    HG3  LYS  34           2HG      LYS  34  -8.813 -12.383  -4.015
  270    HD2  LYS  34           1HD      LYS  34  -9.896 -13.125  -1.933
  271    HD3  LYS  34           2HD      LYS  34 -11.295 -12.084  -2.289
  272    HE2  LYS  34           1HE      LYS  34 -11.702 -13.352  -4.362
  273    HE3  LYS  34           2HE      LYS  34 -10.317 -14.402  -3.985
  274    HZ1  LYS  34           3HZ      LYS  34 -12.756 -14.129  -2.350
  275    HZ2  LYS  34           1HZ      LYS  34 -12.397 -15.405  -3.331
  276    HZ3  LYS  34           2HZ      LYS  34 -11.473 -15.103  -1.998
  277    H    ARG  35           H        ARG  35  -9.487  -7.579  -3.244
  278    HA   ARG  35           HA       ARG  35  -7.444  -5.833  -2.241
  279    HB2  ARG  35           1HB      ARG  35 -10.417  -5.654  -2.151
  280    HB3  ARG  35           2HB      ARG  35  -9.320  -4.409  -1.511
  281    HG2  ARG  35           1HG      ARG  35  -8.358  -4.081  -3.728
  282    HG3  ARG  35           2HG      ARG  35  -9.389  -5.376  -4.386
  283    HD2  ARG  35           1HD      ARG  35 -11.358  -4.041  -3.824
  284    HD3  ARG  35           2HD      ARG  35 -10.281  -2.733  -3.281
  285    HE   ARG  35           HE       ARG  35  -9.657  -3.230  -6.050
  286   HH11  ARG  35          1HH1      ARG  35 -12.402  -2.138  -4.199
  287   HH12  ARG  35          2HH1      ARG  35 -12.936  -1.164  -5.556
  288   HH21  ARG  35          1HH2      ARG  35 -10.260  -2.128  -7.614
  289   HH22  ARG  35          2HH2      ARG  35 -11.717  -1.159  -7.503
  290    H    GLU  36           H        GLU  36  -9.938  -7.746  -0.573
  291    HA   GLU  36           HA       GLU  36  -9.335  -6.767   2.058
  292    HB2  GLU  36           1HB      GLU  36 -10.526  -9.360   1.072
  293    HB3  GLU  36           2HB      GLU  36 -10.392  -8.918   2.791
  294    HG2  GLU  36           1HG      GLU  36 -11.922  -6.958   2.398
  295    HG3  GLU  36           2HG      GLU  36 -11.842  -7.385   0.674
  296    H    VAL  37           H        VAL  37  -8.082  -9.535   0.215
  297    HA   VAL  37           HA       VAL  37  -6.452 -10.582   2.377
  298    HB   VAL  37           HB       VAL  37  -6.208 -10.859  -0.647
  299   HG11  VAL  37          1HG1      VAL  37  -4.728 -12.772  -0.139
  300   HG12  VAL  37          2HG1      VAL  37  -4.046 -11.252   0.485
  301   HG13  VAL  37          3HG1      VAL  37  -4.837 -12.396   1.596
  302   HG21  VAL  37          3HG2      VAL  37  -8.273 -11.778   0.225
  303   HG22  VAL  37          1HG2      VAL  37  -7.171 -13.076  -0.290
  304   HG23  VAL  37          2HG2      VAL  37  -7.367 -12.710   1.441
  305    H    LEU  38           H        LEU  38  -5.787  -8.276  -0.230
  306    HA   LEU  38           HA       LEU  38  -3.010  -7.932   0.484
  307    HB2  LEU  38           1HB      LEU  38  -5.037  -6.288  -0.875
  308    HB3  LEU  38           2HB      LEU  38  -3.358  -5.704  -0.829
  309    HG   LEU  38           HG       LEU  38  -4.304  -8.290  -2.123
  310   HD11  LEU  38          1HD1      LEU  38  -3.749  -7.136  -4.280
  311   HD12  LEU  38          2HD1      LEU  38  -5.023  -6.268  -3.392
  312   HD13  LEU  38          3HD1      LEU  38  -3.351  -5.660  -3.370
  313   HD21  LEU  38          3HD2      LEU  38  -2.049  -8.462  -1.249
  314   HD22  LEU  38          1HD2      LEU  38  -2.009  -8.413  -3.029
  315   HD23  LEU  38          2HD2      LEU  38  -1.578  -6.963  -2.088
  316    H    LEU  39           H        LEU  39  -6.006  -6.443   1.586
  317    HA   LEU  39           HA       LEU  39  -4.719  -4.306   3.054
  318    HB2  LEU  39           1HB      LEU  39  -7.311  -5.678   3.118
  319    HB3  LEU  39           2HB      LEU  39  -7.056  -4.364   4.289
  320    HG   LEU  39           HG       LEU  39  -6.936  -4.087   1.260
  321   HD11  LEU  39          1HD1      LEU  39  -9.068  -2.791   1.527
  322   HD12  LEU  39          2HD1      LEU  39  -9.257  -4.469   2.087
  323   HD13  LEU  39          3HD1      LEU  39  -9.052  -3.154   3.268
  324   HD21  LEU  39          3HD2      LEU  39  -5.461  -2.535   2.399
  325   HD22  LEU  39          1HD2      LEU  39  -6.851  -1.660   1.715
  326   HD23  LEU  39          2HD2      LEU  39  -6.788  -2.006   3.460
  327    H    VAL  40           H        VAL  40  -5.578  -7.633   3.825
  328    HA   VAL  40           HA       VAL  40  -4.970  -7.552   6.640
  329    HB   VAL  40           HB       VAL  40  -4.670  -9.768   4.573
  330   HG11  VAL  40          1HG1      VAL  40  -4.475 -11.290   6.512
  331   HG12  VAL  40          2HG1      VAL  40  -3.130 -10.127   6.473
  332   HG13  VAL  40          3HG1      VAL  40  -4.478  -9.892   7.611
  333   HG21  VAL  40          3HG2      VAL  40  -6.959  -9.055   4.922
  334   HG22  VAL  40          1HG2      VAL  40  -6.688 -10.670   5.614
  335   HG23  VAL  40          2HG2      VAL  40  -6.771  -9.248   6.681
  336    H    THR  41           H        THR  41  -2.857  -8.178   3.842
  337    HA   THR  41           HA       THR  41  -0.462  -8.392   5.435
  338    HB   THR  41           HB       THR  41  -0.821  -7.592   2.516
  339    HG1  THR  41           1HG      THR  41  -0.222  -9.818   2.204
  340   HG21  THR  41          3HG2      THR  41   1.647  -8.514   4.042
  341   HG22  THR  41          1HG2      THR  41   1.558  -8.216   2.290
  342   HG23  THR  41          2HG2      THR  41   1.357  -6.867   3.432
  343    H    LEU  42           H        LEU  42  -2.018  -5.662   3.776
  344    HA   LEU  42           HA       LEU  42   0.091  -3.786   4.343
  345    HB2  LEU  42           1HB      LEU  42  -2.791  -3.592   3.796
  346    HB3  LEU  42           2HB      LEU  42  -1.856  -2.084   3.926
  347    HG   LEU  42           HG       LEU  42  -1.340  -4.293   1.898
  348   HD11  LEU  42          1HD1      LEU  42  -2.284  -2.680   0.223
  349   HD12  LEU  42          2HD1      LEU  42  -3.494  -3.120   1.451
  350   HD13  LEU  42          3HD1      LEU  42  -2.659  -1.550   1.547
  351   HD21  LEU  42          3HD2      LEU  42   0.651  -3.037   2.480
  352   HD22  LEU  42          1HD2      LEU  42   0.137  -2.628   0.827
  353   HD23  LEU  42          2HD2      LEU  42  -0.190  -1.501   2.166
  354    H    THR  43           H        THR  43  -2.794  -4.774   6.123
  355    HA   THR  43           HA       THR  43  -2.548  -2.695   8.137
  356    HB   THR  43           HB       THR  43  -3.987  -5.379   8.208
  357    HG1  THR  43           1HG      THR  43  -5.818  -3.999   7.818
  358   HG21  THR  43          3HG2      THR  43  -4.212  -2.954  10.034
  359   HG22  THR  43          1HG2      THR  43  -5.233  -4.409  10.106
  360   HG23  THR  43          2HG2      THR  43  -3.495  -4.522  10.472
  361    H    ARG  44           H        ARG  44  -1.508  -6.087   7.950
  362    HA   ARG  44           HA       ARG  44  -0.474  -6.168  10.646
  363    HB2  ARG  44           1HB      ARG  44   0.028  -7.866   8.252
  364    HB3  ARG  44           2HB      ARG  44   0.825  -8.110   9.823
  365    HG2  ARG  44           1HG      ARG  44  -1.354  -8.441  10.892
  366    HG3  ARG  44           2HG      ARG  44  -2.169  -8.159   9.335
  367    HD2  ARG  44           1HD      ARG  44  -1.173 -10.141   8.426
  368    HD3  ARG  44           2HD      ARG  44  -0.275 -10.407   9.939
  369    HE   ARG  44           HE       ARG  44  -3.103 -10.496  10.565
  370   HH11  ARG  44          1HH1      ARG  44  -0.777 -12.342   8.736
  371   HH12  ARG  44          2HH1      ARG  44  -1.690 -13.806   9.042
  372   HH21  ARG  44          1HH2      ARG  44  -4.164 -12.162  10.917
  373   HH22  ARG  44          2HH2      ARG  44  -3.621 -13.706  10.286
  374    H    LEU  45           H        LEU  45   0.950  -5.306   7.523
  375    HA   LEU  45           HA       LEU  45   3.588  -4.803   8.666
  376    HB2  LEU  45           1HB      LEU  45   2.159  -4.030   6.215
  377    HB3  LEU  45           2HB      LEU  45   3.847  -3.504   6.410
  378    HG   LEU  45           HG       LEU  45   2.868  -6.384   6.293
  379   HD11  LEU  45          1HD1      LEU  45   4.095  -6.448   4.106
  380   HD12  LEU  45          2HD1      LEU  45   2.794  -5.235   4.082
  381   HD13  LEU  45          3HD1      LEU  45   4.486  -4.723   4.291
  382   HD21  LEU  45          3HD2      LEU  45   4.793  -6.141   7.746
  383   HD22  LEU  45          1HD2      LEU  45   5.266  -6.974   6.245
  384   HD23  LEU  45          2HD2      LEU  45   5.675  -5.256   6.478
  385    H    HIS  46           H        HIS  46   0.654  -2.934   8.175
  386    HA   HIS  46           HA       HIS  46   1.795  -0.353   8.731
  387    HB2  HIS  46           1HB      HIS  46  -0.486  -0.707   7.733
  388    HB3  HIS  46           2HB      HIS  46  -1.041  -1.320   9.311
  389    HD1  HIS  46           1HD      HIS  46   0.592   1.846   7.921
  390    HD2  HIS  46           2HD      HIS  46  -2.231   0.707  10.834
  391    HE1  HIS  46           1HE      HIS  46  -0.190   3.920   8.947
  392    H    GLN  47           H        GLN  47   0.399  -2.850  10.838
  393    HA   GLN  47           HA       GLN  47   0.704  -1.322  13.268
  394    HB2  GLN  47           1HB      GLN  47   0.551  -4.287  12.703
  395    HB3  GLN  47           2HB      GLN  47   0.623  -3.595  14.341
  396    HG2  GLN  47           1HG      GLN  47  -1.724  -2.383  13.749
  397    HG3  GLN  47           2HG      GLN  47  -1.305  -3.198  12.223
  398   HE21  GLN  47          2HE2      GLN  47  -3.753  -3.581  13.516
  399   HE22  GLN  47          1HE2      GLN  47  -3.830  -5.209  14.102
  400    H    ARG  48           H        ARG  48   2.911  -3.163  11.314
  401    HA   ARG  48           HA       ARG  48   4.937  -3.293  13.462
  402    HB2  ARG  48           1HB      ARG  48   5.014  -4.133  10.600
  403    HB3  ARG  48           2HB      ARG  48   6.376  -4.242  11.740
  404    HG2  ARG  48           1HG      ARG  48   5.142  -5.787  13.139
  405    HG3  ARG  48           2HG      ARG  48   3.691  -5.602  12.122
  406    HD2  ARG  48           1HD      ARG  48   4.896  -6.608  10.262
  407    HD3  ARG  48           2HD      ARG  48   6.308  -6.836  11.321
  408    HE   ARG  48           HE       ARG  48   4.163  -8.296  12.540
  409   HH11  ARG  48          1HH1      ARG  48   5.843  -8.377   9.485
  410   HH12  ARG  48          2HH1      ARG  48   5.566 -10.105   9.373
  411   HH21  ARG  48          1HH2      ARG  48   3.832 -10.272  12.423
  412   HH22  ARG  48          2HH2      ARG  48   4.420 -11.187  11.047
  413    H    GLY  49           H        GLY  49   3.824  -0.929  11.413
  414    HA2  GLY  49           1HA      GLY  49   4.653   1.223  11.095
  415    HA3  GLY  49           2HA      GLY  49   6.101   0.774  12.024
  416    H    VAL  50           H        VAL  50   4.954  -1.056   9.246
  417    HA   VAL  50           HA       VAL  50   7.502  -0.378   7.808
  418    HB   VAL  50           HB       VAL  50   5.485  -2.616   7.349
  419   HG11  VAL  50          1HG1      VAL  50   7.209  -3.508   5.817
  420   HG12  VAL  50          2HG1      VAL  50   6.653  -1.902   5.290
  421   HG13  VAL  50          3HG1      VAL  50   8.219  -2.075   6.116
  422   HG21  VAL  50          3HG2      VAL  50   6.683  -2.925   9.433
  423   HG22  VAL  50          1HG2      VAL  50   7.225  -4.100   8.211
  424   HG23  VAL  50          2HG2      VAL  50   8.236  -2.686   8.598
  425    H    ILE  51           H        ILE  51   4.039  -0.833   7.067
  426    HA   ILE  51           HA       ILE  51   4.418   1.167   4.850
  427    HB   ILE  51           HB       ILE  51   2.425  -1.136   5.065
  428   HG12  ILE  51          1HG1      ILE  51   4.732  -0.726   3.181
  429   HG13  ILE  51          2HG1      ILE  51   4.699  -1.838   4.568
  430   HG21  ILE  51          1HG2      ILE  51   1.741  -0.450   2.791
  431   HG22  ILE  51          2HG2      ILE  51   1.470   0.860   3.963
  432   HG23  ILE  51          3HG2      ILE  51   2.870   0.925   2.867
  433   HD11  ILE  51          3HD1      ILE  51   2.889  -1.981   2.132
  434   HD12  ILE  51          1HD1      ILE  51   4.282  -3.037   2.456
  435   HD13  ILE  51          2HD1      ILE  51   2.855  -3.094   3.519
  436    H    TYR  52           H        TYR  52   3.458   2.991   4.953
  437    HA   TYR  52           HA       TYR  52   1.380   3.320   7.089
  438    HB2  TYR  52           1HB      TYR  52   3.222   5.340   5.793
  439    HB3  TYR  52           2HB      TYR  52   1.998   5.690   7.037
  440    HD1  TYR  52           1HD      TYR  52   5.202   3.921   6.396
  441    HD2  TYR  52           2HD      TYR  52   2.460   5.316   9.348
  442    HE1  TYR  52           1HE      TYR  52   6.866   3.427   8.164
  443    HE2  TYR  52           2HE      TYR  52   4.108   4.831  11.123
  444    HH   TYR  52           HH       TYR  52   7.312   3.431  10.392
  445    H    ARG  53           H        ARG  53  -0.364   4.760   6.743
  446    HA   ARG  53           HA       ARG  53  -1.205   4.772   3.861
  447    HB2  ARG  53           1HB      ARG  53  -3.366   4.150   4.406
  448    HB3  ARG  53           2HB      ARG  53  -2.232   2.949   5.064
  449    HG2  ARG  53           1HG      ARG  53  -2.476   4.137   7.297
  450    HG3  ARG  53           2HG      ARG  53  -3.829   5.035   6.568
  451    HD2  ARG  53           1HD      ARG  53  -5.003   2.968   6.178
  452    HD3  ARG  53           2HD      ARG  53  -3.644   2.055   6.875
  453    HE   ARG  53           HE       ARG  53  -4.810   3.908   8.852
  454   HH11  ARG  53          1HH1      ARG  53  -5.275   0.797   7.349
  455   HH12  ARG  53          2HH1      ARG  53  -6.133   0.231   8.769
  456   HH21  ARG  53          1HH2      ARG  53  -5.797   3.278  10.482
  457   HH22  ARG  53          2HH2      ARG  53  -6.431   1.647  10.557
  458    H    LYS  54           H        LYS  54  -2.529   6.393   3.145
  459    HA   LYS  54           HA       LYS  54  -3.466   8.475   4.981
  460    HB2  LYS  54           1HB      LYS  54  -1.088   9.062   4.662
  461    HB3  LYS  54           2HB      LYS  54  -1.369   9.131   2.907
  462    HG2  LYS  54           1HG      LYS  54  -1.405  11.383   3.696
  463    HG3  LYS  54           2HG      LYS  54  -3.090  10.925   3.352
  464    HD2  LYS  54           1HD      LYS  54  -3.417  10.422   5.759
  465    HD3  LYS  54           2HD      LYS  54  -1.752  10.960   6.079
  466    HE2  LYS  54           1HE      LYS  54  -2.271  13.199   5.339
  467    HE3  LYS  54           2HE      LYS  54  -3.893  12.691   4.810
  468    HZ1  LYS  54           3HZ      LYS  54  -2.921  12.697   7.595
  469    HZ2  LYS  54           1HZ      LYS  54  -3.957  13.800   6.939
  470    HZ3  LYS  54           2HZ      LYS  54  -4.425  12.226   7.106
  471    H    TRP  55           H        TRP  55  -5.145   9.578   4.228
  472    HA   TRP  55           HA       TRP  55  -6.215   8.783   1.595
  473    HB2  TRP  55           1HB      TRP  55  -7.282  10.530   3.852
  474    HB3  TRP  55           2HB      TRP  55  -8.142  10.274   2.315
  475    HD1  TRP  55           HD       TRP  55  -7.175   8.621   5.473
  476    HE1  TRP  55           1HE      TRP  55  -8.617   6.357   5.790
  477    HE3  TRP  55           3HE      TRP  55  -9.343   8.483   0.877
  478    HZ2  TRP  55           2HZ      TRP  55 -10.355   4.896   4.215
  479    HZ3  TRP  55           3HZ      TRP  55 -10.858   6.688   0.303
  480    HH2  TRP  55           HH       TRP  55 -11.399   4.899   1.899
  481    H    ARG  56           H        ARG  56  -6.436   9.975  -0.183
  482    HA   ARG  56           HA       ARG  56  -5.593  12.838  -0.073
  483    HB2  ARG  56           1HB      ARG  56  -3.639  11.690  -0.735
  484    HB3  ARG  56           2HB      ARG  56  -4.533  10.827  -2.009
  485    HG2  ARG  56           1HG      ARG  56  -4.867  12.850  -3.251
  486    HG3  ARG  56           2HG      ARG  56  -4.238  13.841  -1.913
  487    HD2  ARG  56           1HD      ARG  56  -2.684  13.625  -3.771
  488    HD3  ARG  56           2HD      ARG  56  -2.043  12.971  -2.246
  489    HE   ARG  56           HE       ARG  56  -2.049  10.736  -3.334
  490   HH11  ARG  56          1HH1      ARG  56  -3.583  13.106  -5.381
  491   HH12  ARG  56          2HH1      ARG  56  -3.483  12.006  -6.740
  492   HH21  ARG  56          1HH2      ARG  56  -1.934   9.462  -4.881
  493   HH22  ARG  56          2HH2      ARG  56  -2.544   9.926  -6.457
  494    H    HIS  57           H        HIS  57  -7.031  14.113  -0.902
  495    HA   HIS  57           HA       HIS  57  -9.293  13.125  -2.423
  496    HB2  HIS  57           1HB      HIS  57  -9.293  15.202  -0.942
  497    HB3  HIS  57           2HB      HIS  57  -8.340  16.010  -2.211
  498    HD1  HIS  57           1HD      HIS  57  -9.531  16.427  -4.508
  499    HD2  HIS  57           2HD      HIS  57 -12.108  14.993  -1.496
  500    HE1  HIS  57           1HE      HIS  57 -11.799  16.928  -5.268
  501    H    PHE  58           H        PHE  58  -9.696  12.995  -4.509
  502    HA   PHE  58           HA       PHE  58  -7.899  14.204  -6.498
  503    HB2  PHE  58           1HB      PHE  58  -6.606  12.189  -5.811
  504    HB3  PHE  58           2HB      PHE  58  -8.012  11.171  -6.192
  505    HD1  PHE  58           1HD      PHE  58  -5.673  13.632  -7.721
  506    HD2  PHE  58           2HD      PHE  58  -8.255  10.276  -8.286
  507    HE1  PHE  58           1HE      PHE  58  -4.883  13.419 -10.054
  508    HE2  PHE  58           2HE      PHE  58  -7.466  10.059 -10.619
  509    HZ   PHE  58           HZ       PHE  58  -5.781  11.633 -11.503
  510    H    SER  59           H        SER  59  -9.190  14.960  -7.962
  511    HA   SER  59           HA       SER  59 -10.860  14.978  -9.666
  512    HB2  SER  59           1HB      SER  59 -10.651  12.043  -9.359
  513    HB3  SER  59           2HB      SER  59 -11.478  12.945 -10.650
  514    HG   SER  59           HG       SER  59  -9.352  12.336 -11.227
  515    H    GLY  60           H        GLY  60 -11.584  15.071  -6.725
  516    HA2  GLY  60           1HA      GLY  60 -13.737  15.745  -5.993
  517    HA3  GLY  60           2HA      GLY  60 -14.475  14.772  -7.287
  518    H    ARG  61           H        ARG  61 -12.140  12.857  -5.998
  519    HA   ARG  61           HA       ARG  61 -13.857  11.792  -3.800
  520    HB2  ARG  61           1HB      ARG  61 -12.871  10.196  -6.117
  521    HB3  ARG  61           2HB      ARG  61 -13.479   9.521  -4.588
  522    HG2  ARG  61           1HG      ARG  61 -15.656  10.618  -4.991
  523    HG3  ARG  61           2HG      ARG  61 -15.042  11.234  -6.545
  524    HD2  ARG  61           1HD      ARG  61 -14.771   8.956  -7.327
  525    HD3  ARG  61           2HD      ARG  61 -15.414   8.355  -5.782
  526    HE   ARG  61           HE       ARG  61 -17.462  10.000  -6.991
  527   HH11  ARG  61          1HH1      ARG  61 -15.812   7.002  -7.661
  528   HH12  ARG  61          2HH1      ARG  61 -17.235   6.395  -8.484
  529   HH21  ARG  61          1HH2      ARG  61 -19.098   9.322  -7.937
  530   HH22  ARG  61          2HH2      ARG  61 -19.110   7.717  -8.642
  531    H    LYS  62           H        LYS  62 -12.839  10.863  -2.135
  532    HA   LYS  62           HA       LYS  62  -9.897  11.252  -2.053
  533    HB2  LYS  62           1HB      LYS  62 -11.953  10.524   0.037
  534    HB3  LYS  62           2HB      LYS  62 -10.202  10.628   0.343
  535    HG2  LYS  62           1HG      LYS  62 -10.230  13.009  -0.270
  536    HG3  LYS  62           2HG      LYS  62 -11.978  12.909  -0.588
  537    HD2  LYS  62           1HD      LYS  62 -12.376  12.298   1.762
  538    HD3  LYS  62           2HD      LYS  62 -10.628  12.393   2.084
  539    HE2  LYS  62           1HE      LYS  62 -10.638  14.770   1.475
  540    HE3  LYS  62           2HE      LYS  62 -12.380  14.681   1.134
  541    HZ1  LYS  62           3HZ      LYS  62 -11.121  14.217   3.761
  542    HZ2  LYS  62           1HZ      LYS  62 -11.945  15.575   3.320
  543    HZ3  LYS  62           2HZ      LYS  62 -12.739  14.134   3.447
  544    H    TYR  63           H        TYR  63  -8.462   9.744  -2.309
  545    HA   TYR  63           HA       TYR  63  -9.324   6.893  -1.924
  546    HB2  TYR  63           1HB      TYR  63  -7.286   7.990  -3.870
  547    HB3  TYR  63           2HB      TYR  63  -7.704   6.277  -3.629
  548    HD1  TYR  63           2HD      TYR  63  -9.906   5.423  -4.376
  549    HD2  TYR  63           1HD      TYR  63  -8.703   9.433  -5.184
  550    HE1  TYR  63           2HE      TYR  63 -11.697   5.609  -6.068
  551    HE2  TYR  63           1HE      TYR  63 -10.493   9.636  -6.884
  552    HH   TYR  63           HH       TYR  63 -12.714   6.942  -7.609
  553    H    ARG  64           H        ARG  64  -8.026   5.519  -0.858
  554    HA   ARG  64           HA       ARG  64  -5.908   6.798   0.782
  555    HB2  ARG  64           1HB      ARG  64  -7.707   5.406   1.768
  556    HB3  ARG  64           2HB      ARG  64  -6.915   4.005   1.008
  557    HG2  ARG  64           1HG      ARG  64  -4.923   4.335   2.303
  558    HG3  ARG  64           2HG      ARG  64  -5.519   5.895   2.921
  559    HD2  ARG  64           1HD      ARG  64  -5.711   4.325   4.644
  560    HD3  ARG  64           2HD      ARG  64  -7.351   4.645   4.033
  561    HE   ARG  64           HE       ARG  64  -6.029   2.093   3.130
  562   HH11  ARG  64          1HH1      ARG  64  -8.485   3.671   5.035
  563   HH12  ARG  64          2HH1      ARG  64  -9.346   2.152   5.195
  564   HH21  ARG  64          1HH2      ARG  64  -6.998   0.344   3.310
  565   HH22  ARG  64          2HH2      ARG  64  -8.498   0.253   4.212
  566    H    GLU  65           H        GLU  65  -3.831   6.587   0.511
  567    HA   GLU  65           HA       GLU  65  -2.867   4.405  -1.312
  568    HB2  GLU  65           1HB      GLU  65  -1.053   5.957  -1.957
  569    HB3  GLU  65           2HB      GLU  65  -2.674   6.447  -2.508
  570    HG2  GLU  65           1HG      GLU  65  -2.748   8.139  -0.596
  571    HG3  GLU  65           2HG      GLU  65  -1.140   7.513  -0.174
  572    H    TYR  66           H        TYR  66  -0.648   3.755  -0.998
  573    HA   TYR  66           HA       TYR  66   0.025   3.834   1.928
  574    HB2  TYR  66           1HB      TYR  66   0.061   1.510  -0.006
  575    HB3  TYR  66           2HB      TYR  66   0.796   1.487   1.616
  576    HD1  TYR  66           1HD      TYR  66  -2.412   1.678  -0.236
  577    HD2  TYR  66           2HD      TYR  66  -0.561   1.216   3.577
  578    HE1  TYR  66           1HE      TYR  66  -4.594   1.015   0.735
  579    HE2  TYR  66           2HE      TYR  66  -2.728   0.553   4.562
  580    HH   TYR  66           HH       TYR  66  -4.908  -0.065   4.096
  581    H    CYS  67           H        CYS  67   1.998   4.328   2.478
  582    HA   CYS  67           HA       CYS  67   4.130   4.437   0.324
  583    HB2  CYS  67           1HB      CYS  67   3.671   5.969   2.920
  584    HB3  CYS  67           2HB      CYS  67   4.964   6.270   1.735
  585    HG   CYS  67           HG       CYS  67   3.267   8.159   1.700
  586    H    LEU  68           H        LEU  68   6.112   3.559   0.751
  587    HA   LEU  68           HA       LEU  68   6.230   1.680   3.057
  588    HB2  LEU  68           1HB      LEU  68   6.574   0.791   0.984
  589    HB3  LEU  68           2HB      LEU  68   7.866   1.901   0.474
  590    HG   LEU  68           HG       LEU  68   9.237   0.996   2.417
  591   HD11  LEU  68          1HD1      LEU  68   8.577  -1.272   3.258
  592   HD12  LEU  68          2HD1      LEU  68   7.349  -0.050   3.663
  593   HD13  LEU  68          3HD1      LEU  68   7.076  -1.171   2.309
  594   HD21  LEU  68          3HD2      LEU  68   9.690   0.377   0.117
  595   HD22  LEU  68          1HD2      LEU  68   9.940  -1.025   1.183
  596   HD23  LEU  68          2HD2      LEU  68   8.466  -0.913   0.192
  597    H    LYS  69           H        LYS  69   7.299   2.075   4.811
  598    HA   LYS  69           HA       LYS  69   8.812   3.045   6.291
  599    HB2  LYS  69           1HB      LYS  69  10.483   3.113   3.774
  600    HB3  LYS  69           2HB      LYS  69  11.091   3.394   5.422
  601    HG2  LYS  69           1HG      LYS  69  10.486   1.106   6.055
  602    HG3  LYS  69           2HG      LYS  69   9.825   0.818   4.429
  603    HD2  LYS  69           1HD      LYS  69  12.067   1.233   3.464
  604    HD3  LYS  69           2HD      LYS  69  12.715   1.457   5.105
  605    HE2  LYS  69           1HE      LYS  69  12.105  -0.831   5.689
  606    HE3  LYS  69           2HE      LYS  69  11.377  -1.065   4.083
  607    HZ1  LYS  69           3HZ      LYS  69  14.230  -0.529   4.611
  608    HZ2  LYS  69           1HZ      LYS  69  13.590  -1.992   4.201
  609    HZ3  LYS  69           2HZ      LYS  69  13.556  -0.745   3.122
  610    H    HIS  70           H        HIS  70   6.911   4.795   5.479
  611    HA   HIS  70           HA       HIS  70   8.482   7.342   5.267
  612    HB2  HIS  70           1HB      HIS  70   7.228   6.978   3.169
  613    HB3  HIS  70           2HB      HIS  70   5.726   6.748   4.097
  614    HD1  HIS  70           1HD      HIS  70   8.383   9.458   3.639
  615    HD2  HIS  70           2HD      HIS  70   4.224   9.112   4.226
  616    HE1  HIS  70           1HE      HIS  70   7.511  11.740   3.639
  617    H    ARG  71           H        ARG  71   8.403   8.545   6.975
  618    HA   ARG  71           HA       ARG  71   7.003   7.906   9.319
  619    HB2  ARG  71           1HB      ARG  71   8.906   9.420   9.157
  620    HB3  ARG  71           2HB      ARG  71   7.810  10.660   8.508
  621    HG2  ARG  71           1HG      ARG  71   6.511  10.626  10.577
  622    HG3  ARG  71           2HG      ARG  71   7.559   9.344  11.229
  623    HD2  ARG  71           1HD      ARG  71   9.428  10.840  11.246
  624    HD3  ARG  71           2HD      ARG  71   8.440  12.120  10.504
  625    HE   ARG  71           HE       ARG  71   7.486  12.525  12.749
  626   HH11  ARG  71          1HH1      ARG  71   9.349   9.578  12.763
  627   HH12  ARG  71          2HH1      ARG  71   9.296   9.546  14.514
  628   HH21  ARG  71          1HH2      ARG  71   7.410  12.499  14.754
  629   HH22  ARG  71          2HH2      ARG  71   8.191  11.211  15.652
  630    H    ASP  72           H        ASP  72   5.044   8.075  10.073
  631    HA   ASP  72           HA       ASP  72   2.854   8.812   8.379
  632    HB2  ASP  72           1HB      ASP  72   2.783   7.254  10.491
  633    HB3  ASP  72           2HB      ASP  72   2.921   8.821  11.324
  634    H    GLU  73           H        GLU  73   4.580  10.600  10.910
  635    HA   GLU  73           HA       GLU  73   2.935  12.931  10.905
  636    HB2  GLU  73           1HB      GLU  73   4.716  12.451  12.535
  637    HB3  GLU  73           2HB      GLU  73   5.929  12.711  11.257
  638    HG2  GLU  73           1HG      GLU  73   5.214  15.128  11.095
  639    HG3  GLU  73           2HG      GLU  73   3.949  14.707  12.272
  640    H    LEU  74           H        LEU  74   5.710  12.062   8.854
  641    HA   LEU  74           HA       LEU  74   5.698  14.532   7.369
  642    HB2  LEU  74           1HB      LEU  74   6.592  11.782   6.829
  643    HB3  LEU  74           2HB      LEU  74   6.986  13.053   5.649
  644    HG   LEU  74           HG       LEU  74   7.924  12.893   8.540
  645   HD11  LEU  74          1HD1      LEU  74  10.196  12.668   7.500
  646   HD12  LEU  74          2HD1      LEU  74   9.118  11.349   6.988
  647   HD13  LEU  74          3HD1      LEU  74   9.444  12.709   5.888
  648   HD21  LEU  74          3HD2      LEU  74   7.493  15.192   7.903
  649   HD22  LEU  74          1HD2      LEU  74   9.247  14.915   8.030
  650   HD23  LEU  74          2HD2      LEU  74   8.471  14.998   6.429
  651    H    ALA  75           H        ALA  75   3.986  11.473   6.976
  652    HA   ALA  75           HA       ALA  75   2.873  12.010   4.410
  653    HB1  ALA  75           1HB      ALA  75   1.137  10.382   5.049
  654    HB2  ALA  75           2HB      ALA  75   2.765   9.800   5.474
  655    HB3  ALA  75           3HB      ALA  75   1.694  10.453   6.737
  656    H    ASP  76           H        ASP  76   1.743  12.855   7.675
  657    HA   ASP  76           HA       ASP  76  -0.693  14.128   6.793
  658    HB2  ASP  76           1HB      ASP  76   0.947  14.504   9.371
  659    HB3  ASP  76           2HB      ASP  76  -0.577  15.282   8.879
  660    H    LEU  77           H        LEU  77   2.626  15.248   7.151
  661    HA   LEU  77           HA       LEU  77   1.926  18.060   6.839
  662    HB2  LEU  77           1HB      LEU  77   4.393  16.473   6.619
  663    HB3  LEU  77           2HB      LEU  77   4.495  18.243   6.470
  664    HG   LEU  77           HG       LEU  77   3.530  16.712   8.917
  665   HD11  LEU  77          1HD1      LEU  77   5.644  17.552   9.976
  666   HD12  LEU  77          2HD1      LEU  77   5.991  16.519   8.569
  667   HD13  LEU  77          3HD1      LEU  77   6.110  18.289   8.425
  668   HD21  LEU  77          3HD2      LEU  77   2.413  18.850   8.670
  669   HD22  LEU  77          1HD2      LEU  77   3.556  18.916  10.033
  670   HD23  LEU  77          2HD2      LEU  77   3.977  19.678   8.478
  671    H    GLU  78           H        GLU  78   2.987  15.470   4.685
  672    HA   GLU  78           HA       GLU  78   3.355  17.279   2.415
  673    HB2  GLU  78           1HB      GLU  78   3.211  14.280   2.704
  674    HB3  GLU  78           2HB      GLU  78   3.425  15.106   1.141
  675    HG2  GLU  78           1HG      GLU  78   5.603  16.083   1.992
  676    HG3  GLU  78           2HG      GLU  78   5.210  15.287   3.533
  677    H    HIS  79           H        HIS  79   0.803  15.099   3.549
  678    HA   HIS  79           HA       HIS  79  -0.827  15.733   1.153
  679    HB2  HIS  79           1HB      HIS  79  -1.288  13.863   3.519
  680    HB3  HIS  79           2HB      HIS  79  -2.440  14.100   2.181
  681    HD2  HIS  79           2HD      HIS  79  -1.950  12.453  -0.076
  682    HE1  HIS  79           1HE      HIS  79   1.844  11.103   1.278
  683    HE2  HIS  79           2HE      HIS  79  -0.057  10.878  -0.522
  Start of MODEL    2
    1    H    LYS   3           H        LYS   3   9.665 -14.315  -2.469
    2    HA   LYS   3           HA       LYS   3   7.701 -15.416  -0.746
    3    HB2  LYS   3           1HB      LYS   3  10.265 -14.576   0.616
    4    HB3  LYS   3           2HB      LYS   3   8.703 -14.810   1.435
    5    HG2  LYS   3           1HG      LYS   3   8.715 -17.186   0.752
    6    HG3  LYS   3           2HG      LYS   3  10.297 -16.944  -0.027
    7    HD2  LYS   3           1HD      LYS   3  11.275 -16.319   2.143
    8    HD3  LYS   3           2HD      LYS   3   9.693 -16.554   2.925
    9    HE2  LYS   3           1HE      LYS   3   9.714 -18.920   2.264
   10    HE3  LYS   3           2HE      LYS   3  11.292 -18.688   1.478
   11    HZ1  LYS   3           3HZ      LYS   3  10.746 -18.346   4.356
   12    HZ2  LYS   3           1HZ      LYS   3  11.524 -19.631   3.674
   13    HZ3  LYS   3           2HZ      LYS   3  12.209 -18.131   3.626
   14    H    ALA   4           H        ALA   4   9.762 -12.818  -1.758
   15    HA   ALA   4           HA       ALA   4   8.486 -10.719  -0.276
   16    HB1  ALA   4           1HB      ALA   4   9.555  -9.215  -1.911
   17    HB2  ALA   4           2HB      ALA   4  10.693 -10.445  -1.311
   18    HB3  ALA   4           3HB      ALA   4   9.967 -10.616  -2.928
   19    H    LYS   5           H        LYS   5   7.838 -12.175  -3.439
   20    HA   LYS   5           HA       LYS   5   5.593 -10.301  -3.912
   21    HB2  LYS   5           1HB      LYS   5   6.682 -12.654  -5.464
   22    HB3  LYS   5           2HB      LYS   5   5.289 -11.668  -5.966
   23    HG2  LYS   5           1HG      LYS   5   6.756  -9.672  -6.045
   24    HG3  LYS   5           2HG      LYS   5   8.144 -10.697  -5.609
   25    HD2  LYS   5           1HD      LYS   5   7.809 -12.028  -7.650
   26    HD3  LYS   5           2HD      LYS   5   6.413 -11.013  -8.085
   27    HE2  LYS   5           1HE      LYS   5   7.875  -9.043  -8.197
   28    HE3  LYS   5           2HE      LYS   5   9.272 -10.052  -7.756
   29    HZ1  LYS   5           3HZ      LYS   5   7.636 -10.358 -10.193
   30    HZ2  LYS   5           1HZ      LYS   5   9.146  -9.695 -10.127
   31    HZ3  LYS   5           2HZ      LYS   5   8.932 -11.294  -9.783
   32    H    LEU   6           H        LEU   6   6.148 -13.546  -2.749
   33    HA   LEU   6           HA       LEU   6   3.430 -14.475  -3.006
   34    HB2  LEU   6           1HB      LEU   6   5.680 -15.089  -1.213
   35    HB3  LEU   6           2HB      LEU   6   4.214 -16.091  -1.114
   36    HG   LEU   6           HG       LEU   6   6.033 -15.795  -3.536
   37   HD11  LEU   6          1HD1      LEU   6   6.573 -18.207  -3.104
   38   HD12  LEU   6          2HD1      LEU   6   7.024 -17.186  -1.719
   39   HD13  LEU   6          3HD1      LEU   6   5.538 -18.163  -1.658
   40   HD21  LEU   6          3HD2      LEU   6   3.718 -16.086  -4.190
   41   HD22  LEU   6          1HD2      LEU   6   4.638 -17.567  -4.544
   42   HD23  LEU   6          2HD2      LEU   6   3.565 -17.504  -3.125
   43    H    SER   7           H        SER   7   5.159 -12.742  -0.437
   44    HA   SER   7           HA       SER   7   2.843 -12.519   1.356
   45    HB2  SER   7           1HB      SER   7   4.858 -12.397   2.345
   46    HB3  SER   7           2HB      SER   7   5.460 -11.171   1.206
   47    HG   SER   7           HG       SER   7   3.338 -10.832   3.060
   48    H    LEU   8           H        LEU   8   1.096 -11.317   0.976
   49    HA   LEU   8           HA       LEU   8   0.912  -9.361  -1.135
   50    HB2  LEU   8           1HB      LEU   8  -0.644  -9.992   1.278
   51    HB3  LEU   8           2HB      LEU   8  -1.273  -8.750   0.171
   52    HG   LEU   8           HG       LEU   8  -0.797 -11.683  -0.489
   53   HD11  LEU   8          1HD1      LEU   8  -3.296 -11.772  -0.698
   54   HD12  LEU   8          2HD1      LEU   8  -2.801 -11.299   0.944
   55   HD13  LEU   8          3HD1      LEU   8  -3.383 -10.065  -0.201
   56   HD21  LEU   8          3HD2      LEU   8  -0.356 -10.258  -2.400
   57   HD22  LEU   8          1HD2      LEU   8  -1.870 -11.159  -2.652
   58   HD23  LEU   8          2HD2      LEU   8  -1.922  -9.440  -2.189
   59    H    THR   9           H        THR   9   1.625  -9.138   2.313
   60    HA   THR   9           HA       THR   9   1.545  -6.260   2.458
   61    HB   THR   9           HB       THR   9   2.967  -6.542   4.480
   62    HG1  THR   9           1HG      THR   9   3.699  -8.593   5.028
   63   HG21  THR   9          3HG2      THR   9   0.710  -8.573   4.264
   64   HG22  THR   9          1HG2      THR   9   1.384  -7.923   5.778
   65   HG23  THR   9          2HG2      THR   9   0.521  -6.847   4.652
   66    H    GLN  10           H        GLN  10   4.288  -8.511   2.021
   67    HA   GLN  10           HA       GLN  10   6.216  -6.418   1.591
   68    HB2  GLN  10           1HB      GLN  10   6.160  -9.308   0.691
   69    HB3  GLN  10           2HB      GLN  10   7.570  -8.227   0.568
   70    HG2  GLN  10           1HG      GLN  10   6.404  -9.252   3.302
   71    HG3  GLN  10           2HG      GLN  10   7.785  -9.642   2.249
   72   HE21  GLN  10          2HE2      GLN  10   6.892  -8.019   4.972
   73   HE22  GLN  10          1HE2      GLN  10   8.120  -6.798   5.011
   74    H    LEU  11           H        LEU  11   4.025  -8.144  -0.560
   75    HA   LEU  11           HA       LEU  11   5.203  -7.235  -3.021
   76    HB2  LEU  11           1HB      LEU  11   3.754  -9.034  -2.842
   77    HB3  LEU  11           2HB      LEU  11   2.327  -8.084  -2.364
   78    HG   LEU  11           HG       LEU  11   2.494  -6.872  -4.563
   79   HD11  LEU  11          1HD1      LEU  11   3.839  -7.973  -6.373
   80   HD12  LEU  11          2HD1      LEU  11   4.882  -7.407  -5.045
   81   HD13  LEU  11          3HD1      LEU  11   4.466  -9.134  -5.178
   82   HD21  LEU  11          3HD2      LEU  11   0.876  -8.646  -4.228
   83   HD22  LEU  11          1HD2      LEU  11   1.501  -8.701  -5.894
   84   HD23  LEU  11          2HD2      LEU  11   2.081  -9.873  -4.684
   85    H    ILE  12           H        ILE  12   2.567  -5.904  -1.024
   86    HA   ILE  12           HA       ILE  12   2.074  -3.559  -2.574
   87    HB   ILE  12           HB       ILE  12   1.988  -4.027   0.439
   88   HG12  ILE  12          1HG1      ILE  12  -0.291  -3.713  -1.484
   89   HG13  ILE  12          2HG1      ILE  12   0.456  -5.283  -1.114
   90   HG21  ILE  12          1HG2      ILE  12   0.684  -1.931   0.556
   91   HG22  ILE  12          2HG2      ILE  12   2.328  -1.628  -0.047
   92   HG23  ILE  12          3HG2      ILE  12   0.958  -1.662  -1.182
   93   HD11  ILE  12          3HD1      ILE  12  -0.855  -3.420   0.897
   94   HD12  ILE  12          1HD1      ILE  12  -1.563  -4.917   0.248
   95   HD13  ILE  12          2HD1      ILE  12  -0.106  -4.991   1.268
   96    H    LEU  13           H        LEU  13   4.621  -4.221  -0.216
   97    HA   LEU  13           HA       LEU  13   5.507  -1.450  -0.170
   98    HB2  LEU  13           1HB      LEU  13   6.737  -4.017   0.592
   99    HB3  LEU  13           2HB      LEU  13   7.523  -2.489   1.047
  100    HG   LEU  13           HG       LEU  13   4.794  -3.460   1.984
  101   HD11  LEU  13          1HD1      LEU  13   5.904  -3.609   4.229
  102   HD12  LEU  13          2HD1      LEU  13   6.695  -4.676   3.045
  103   HD13  LEU  13          3HD1      LEU  13   7.443  -3.121   3.483
  104   HD21  LEU  13          3HD2      LEU  13   4.851  -1.048   1.747
  105   HD22  LEU  13          1HD2      LEU  13   4.831  -1.487   3.470
  106   HD23  LEU  13          2HD2      LEU  13   6.349  -0.960   2.703
  107    H    ILE  14           H        ILE  14   6.220  -4.241  -2.137
  108    HA   ILE  14           HA       ILE  14   8.615  -3.188  -3.382
  109    HB   ILE  14           HB       ILE  14   6.486  -5.154  -4.336
  110   HG12  ILE  14          1HG1      ILE  14   9.340  -5.630  -3.529
  111   HG13  ILE  14          2HG1      ILE  14   7.952  -5.765  -2.426
  112   HG21  ILE  14          1HG2      ILE  14   8.052  -5.710  -6.166
  113   HG22  ILE  14          2HG2      ILE  14   7.518  -4.016  -6.273
  114   HG23  ILE  14          3HG2      ILE  14   9.135  -4.401  -5.638
  115   HD11  ILE  14          3HD1      ILE  14   8.381  -7.396  -4.953
  116   HD12  ILE  14          1HD1      ILE  14   8.621  -7.973  -3.290
  117   HD13  ILE  14          2HD1      ILE  14   6.991  -7.530  -3.850
  118    H    ARG  15           H        ARG  15   5.172  -2.852  -4.150
  119    HA   ARG  15           HA       ARG  15   5.655  -1.154  -6.453
  120    HB2  ARG  15           1HB      ARG  15   3.617  -2.340  -6.240
  121    HB3  ARG  15           2HB      ARG  15   3.229  -1.465  -4.741
  122    HG2  ARG  15           1HG      ARG  15   1.969  -0.560  -6.636
  123    HG3  ARG  15           2HG      ARG  15   3.114   0.641  -5.989
  124    HD2  ARG  15           1HD      ARG  15   4.664   0.033  -7.809
  125    HD3  ARG  15           2HD      ARG  15   3.379  -0.992  -8.490
  126    HE   ARG  15           HE       ARG  15   2.305   1.672  -8.343
  127   HH11  ARG  15          1HH1      ARG  15   4.949   0.084  -9.970
  128   HH12  ARG  15          2HH1      ARG  15   4.812   1.211 -11.305
  129   HH21  ARG  15          1HH2      ARG  15   2.142   2.976  -9.861
  130   HH22  ARG  15          2HH2      ARG  15   3.213   2.861 -11.244
  131    H    LEU  16           H        LEU  16   5.160  -0.552  -3.000
  132    HA   LEU  16           HA       LEU  16   5.097   2.347  -3.342
  133    HB2  LEU  16           1HB      LEU  16   5.502   0.512  -1.077
  134    HB3  LEU  16           2HB      LEU  16   5.392   2.258  -0.763
  135    HG   LEU  16           HG       LEU  16   3.213   0.463  -1.899
  136   HD11  LEU  16          1HD1      LEU  16   1.999   1.077   0.208
  137   HD12  LEU  16          2HD1      LEU  16   3.538   0.259   0.565
  138   HD13  LEU  16          3HD1      LEU  16   3.410   2.026   0.727
  139   HD21  LEU  16          3HD2      LEU  16   3.158   2.641  -2.960
  140   HD22  LEU  16          1HD2      LEU  16   1.778   2.473  -1.849
  141   HD23  LEU  16          2HD2      LEU  16   3.192   3.447  -1.373
  142    H    SER  17           H        SER  17   7.575  -0.042  -3.104
  143    HA   SER  17           HA       SER  17   9.810   1.696  -2.404
  144    HB2  SER  17           1HB      SER  17   9.978  -0.607  -2.189
  145    HB3  SER  17           2HB      SER  17   9.714  -0.831  -3.934
  146    HG   SER  17           HG       SER  17  11.933  -0.830  -3.364
  147    H    ASN  18           H        ASN  18   8.288   0.666  -5.481
  148    HA   ASN  18           HA       ASN  18  10.147   2.150  -7.147
  149    HB2  ASN  18           1HB      ASN  18   7.399   0.943  -7.975
  150    HB3  ASN  18           2HB      ASN  18   8.653   1.920  -8.777
  151   HD21  ASN  18          2HD2      ASN  18   7.634  -0.848  -9.206
  152   HD22  ASN  18          1HD2      ASN  18   9.047  -1.850  -9.192
  153    H    ARG  19           H        ARG  19   6.870   2.796  -5.924
  154    HA   ARG  19           HA       ARG  19   7.411   5.693  -6.435
  155    HB2  ARG  19           1HB      ARG  19   4.893   4.252  -7.133
  156    HB3  ARG  19           2HB      ARG  19   5.065   6.018  -7.002
  157    HG2  ARG  19           1HG      ARG  19   6.691   4.289  -8.887
  158    HG3  ARG  19           2HG      ARG  19   5.179   5.110  -9.346
  159    HD2  ARG  19           1HD      ARG  19   6.221   7.251  -8.791
  160    HD3  ARG  19           2HD      ARG  19   7.739   6.392  -8.449
  161    HE   ARG  19           HE       ARG  19   6.713   6.935 -11.200
  162   HH11  ARG  19          1HH1      ARG  19   9.031   5.231  -9.227
  163   HH12  ARG  19          2HH1      ARG  19  10.030   4.946 -10.638
  164   HH21  ARG  19          1HH2      ARG  19   7.851   6.623 -12.823
  165   HH22  ARG  19          2HH2      ARG  19   9.360   5.740 -12.689
  166    H    GLY  20           H        GLY  20   7.065   6.977  -4.777
  167    HA2  GLY  20           1HA      GLY  20   7.046   5.770  -2.240
  168    HA3  GLY  20           2HA      GLY  20   6.770   7.501  -2.544
  169    H    CYS  21           H        CYS  21   4.386   7.348  -4.020
  170    HA   CYS  21           HA       CYS  21   2.437   6.423  -1.882
  171    HB2  CYS  21           1HB      CYS  21   3.083   8.823  -1.774
  172    HB3  CYS  21           2HB      CYS  21   2.607   9.016  -3.478
  173    HG   CYS  21           HG       CYS  21   0.943  10.177  -1.952
  174    H    GLN  22           H        GLN  22   0.925   5.121  -2.693
  175    HA   GLN  22           HA       GLN  22  -0.009   5.598  -5.496
  176    HB2  GLN  22           1HB      GLN  22   0.563   2.971  -4.116
  177    HB3  GLN  22           2HB      GLN  22  -0.413   3.119  -5.597
  178    HG2  GLN  22           1HG      GLN  22   2.644   3.869  -5.524
  179    HG3  GLN  22           2HG      GLN  22   1.721   2.398  -5.907
  180   HE21  GLN  22          2HE2      GLN  22   1.757   5.909  -6.673
  181   HE22  GLN  22          1HE2      GLN  22   1.420   5.714  -8.362
  182    H    THR  23           H        THR  23  -2.150   4.855  -5.960
  183    HA   THR  23           HA       THR  23  -3.948   5.354  -3.668
  184    HB   THR  23           HB       THR  23  -5.728   5.435  -5.300
  185    HG1  THR  23           1HG      THR  23  -4.986   5.039  -7.604
  186   HG21  THR  23          3HG2      THR  23  -3.228   6.737  -6.449
  187   HG22  THR  23          1HG2      THR  23  -4.906   7.184  -6.838
  188   HG23  THR  23          2HG2      THR  23  -4.277   7.431  -5.190
  189    H    LEU  24           H        LEU  24  -5.887   4.030  -3.374
  190    HA   LEU  24           HA       LEU  24  -5.245   1.318  -2.795
  191    HB2  LEU  24           1HB      LEU  24  -6.924   2.529  -1.764
  192    HB3  LEU  24           2HB      LEU  24  -7.972   2.666  -3.194
  193    HG   LEU  24           HG       LEU  24  -8.102   0.138  -3.212
  194   HD11  LEU  24          1HD1      LEU  24  -7.549  -1.024  -1.060
  195   HD12  LEU  24          2HD1      LEU  24  -6.101  -0.289  -1.787
  196   HD13  LEU  24          3HD1      LEU  24  -6.909   0.506  -0.415
  197   HD21  LEU  24          3HD2      LEU  24  -9.932   1.500  -2.393
  198   HD22  LEU  24          1HD2      LEU  24  -9.785   0.025  -1.409
  199   HD23  LEU  24          2HD2      LEU  24  -9.189   1.578  -0.778
  200    H    GLU  25           H        GLU  25  -6.835   2.756  -5.622
  201    HA   GLU  25           HA       GLU  25  -7.472   0.202  -6.834
  202    HB2  GLU  25           1HB      GLU  25  -7.229   3.003  -7.933
  203    HB3  GLU  25           2HB      GLU  25  -7.740   1.598  -8.899
  204    HG2  GLU  25           1HG      GLU  25  -9.751   1.323  -7.389
  205    HG3  GLU  25           2HG      GLU  25  -9.066   2.663  -6.439
  206    H    GLU  26           H        GLU  26  -4.755   2.458  -7.132
  207    HA   GLU  26           HA       GLU  26  -3.447   1.047  -9.277
  208    HB2  GLU  26           1HB      GLU  26  -2.477   2.911  -7.115
  209    HB3  GLU  26           2HB      GLU  26  -1.397   2.204  -8.341
  210    HG2  GLU  26           1HG      GLU  26  -2.595   3.407 -10.149
  211    HG3  GLU  26           2HG      GLU  26  -3.847   3.796  -8.948
  212    H    LEU  27           H        LEU  27  -3.277   0.755  -5.748
  213    HA   LEU  27           HA       LEU  27  -1.216  -1.297  -5.823
  214    HB2  LEU  27           1HB      LEU  27  -3.237  -0.419  -3.873
  215    HB3  LEU  27           2HB      LEU  27  -2.064  -1.665  -3.386
  216    HG   LEU  27           HG       LEU  27  -1.406   1.186  -4.225
  217   HD11  LEU  27          1HD1      LEU  27  -0.729   1.469  -1.825
  218   HD12  LEU  27          2HD1      LEU  27  -2.452   1.049  -1.965
  219   HD13  LEU  27          3HD1      LEU  27  -1.268  -0.194  -1.493
  220   HD21  LEU  27          3HD2      LEU  27   0.331  -0.375  -4.878
  221   HD22  LEU  27          1HD2      LEU  27   0.897   0.633  -3.524
  222   HD23  LEU  27          2HD2      LEU  27   0.386  -1.047  -3.230
  223    H    GLU  28           H        GLU  28  -4.738  -1.292  -5.873
  224    HA   GLU  28           HA       GLU  28  -5.069  -4.133  -5.527
  225    HB2  GLU  28           1HB      GLU  28  -6.873  -2.481  -5.287
  226    HB3  GLU  28           2HB      GLU  28  -6.775  -2.142  -7.033
  227    HG2  GLU  28           1HG      GLU  28  -7.461  -4.568  -7.473
  228    HG3  GLU  28           2HG      GLU  28  -7.509  -4.716  -5.700
  229    H    GLU  29           H        GLU  29  -4.609  -2.101  -8.402
  230    HA   GLU  29           HA       GLU  29  -4.902  -4.309 -10.264
  231    HB2  GLU  29           1HB      GLU  29  -3.676  -1.561 -10.481
  232    HB3  GLU  29           2HB      GLU  29  -3.764  -2.712 -11.835
  233    HG2  GLU  29           1HG      GLU  29  -6.277  -2.638 -11.728
  234    HG3  GLU  29           2HG      GLU  29  -6.073  -1.639 -10.271
  235    H    PHE  30           H        PHE  30  -2.183  -2.858  -8.554
  236    HA   PHE  30           HA       PHE  30  -0.120  -4.263  -9.998
  237    HB2  PHE  30           1HB      PHE  30   0.368  -2.296  -8.580
  238    HB3  PHE  30           2HB      PHE  30  -0.133  -3.207  -7.137
  239    HD1  PHE  30           1HD      PHE  30   2.372  -3.047  -9.855
  240    HD2  PHE  30           2HD      PHE  30   1.336  -4.627  -6.023
  241    HE1  PHE  30           1HE      PHE  30   4.688  -3.863  -9.567
  242    HE2  PHE  30           2HE      PHE  30   3.652  -5.442  -5.731
  243    HZ   PHE  30           HZ       PHE  30   5.328  -5.061  -7.505
  244    H    THR  31           H        THR  31  -1.827  -5.012  -6.954
  245    HA   THR  31           HA       THR  31  -0.336  -7.552  -6.730
  246    HB   THR  31           HB       THR  31  -1.523  -7.844  -4.625
  247    HG1  THR  31           1HG      THR  31  -3.006  -5.964  -4.085
  248   HG21  THR  31          3HG2      THR  31  -0.679  -4.942  -4.994
  249   HG22  THR  31          1HG2      THR  31  -0.828  -5.793  -3.436
  250   HG23  THR  31          2HG2      THR  31   0.406  -6.300  -4.615
  251    H    GLN  32           H        GLN  32  -3.338  -6.448  -8.029
  252    HA   GLN  32           HA       GLN  32  -5.311  -7.532  -8.601
  253    HB2  GLN  32           1HB      GLN  32  -3.350  -9.806  -8.970
  254    HB3  GLN  32           2HB      GLN  32  -5.046  -9.829  -9.508
  255    HG2  GLN  32           1HG      GLN  32  -2.901  -7.889 -10.748
  256    HG3  GLN  32           2HG      GLN  32  -3.563  -9.488 -11.168
  257   HE21  GLN  32          2HE2      GLN  32  -3.850  -6.183 -11.621
  258   HE22  GLN  32          1HE2      GLN  32  -5.470  -6.128 -12.237
  259    H    ALA  33           H        ALA  33  -4.536  -7.492  -5.801
  260    HA   ALA  33           HA       ALA  33  -5.710 -10.017  -4.803
  261    HB1  ALA  33           1HB      ALA  33  -5.244  -9.078  -2.571
  262    HB2  ALA  33           2HB      ALA  33  -3.791  -9.077  -3.598
  263    HB3  ALA  33           3HB      ALA  33  -4.689  -7.567  -3.326
  264    H    LYS  34           H        LYS  34  -7.568 -10.123  -3.513
  265    HA   LYS  34           HA       LYS  34  -9.805  -8.534  -4.248
  266    HB2  LYS  34           1HB      LYS  34  -9.926 -10.734  -3.162
  267    HB3  LYS  34           2HB      LYS  34  -9.297 -10.012  -1.661
  268    HG2  LYS  34           1HG      LYS  34 -11.282  -8.601  -1.473
  269    HG3  LYS  34           2HG      LYS  34 -11.905  -9.243  -3.013
  270    HD2  LYS  34           1HD      LYS  34 -11.986 -11.507  -2.025
  271    HD3  LYS  34           2HD      LYS  34 -11.399 -10.843  -0.481
  272    HE2  LYS  34           1HE      LYS  34 -13.384  -9.412  -0.330
  273    HE3  LYS  34           2HE      LYS  34 -13.971 -10.053  -1.882
  274    HZ1  LYS  34           3HZ      LYS  34 -13.556 -11.630   0.576
  275    HZ2  LYS  34           1HZ      LYS  34 -15.017 -11.146  -0.017
  276    HZ3  LYS  34           2HZ      LYS  34 -14.099 -12.225  -0.864
  277    H    ARG  35           H        ARG  35 -10.635  -6.671  -3.663
  278    HA   ARG  35           HA       ARG  35  -8.962  -4.680  -2.566
  279    HB2  ARG  35           1HB      ARG  35 -10.868  -4.232  -3.969
  280    HB3  ARG  35           2HB      ARG  35 -11.948  -4.675  -2.625
  281    HG2  ARG  35           1HG      ARG  35 -11.254  -2.804  -1.327
  282    HG3  ARG  35           2HG      ARG  35  -9.896  -2.459  -2.426
  283    HD2  ARG  35           1HD      ARG  35 -12.814  -2.194  -3.083
  284    HD3  ARG  35           2HD      ARG  35 -11.706  -0.870  -2.651
  285    HE   ARG  35           HE       ARG  35 -10.569  -1.949  -4.998
  286   HH11  ARG  35          1HH1      ARG  35 -13.783  -0.849  -4.216
  287   HH12  ARG  35          2HH1      ARG  35 -14.023  -0.353  -5.880
  288   HH21  ARG  35          1HH2      ARG  35 -10.831  -1.394  -6.908
  289   HH22  ARG  35          2HH2      ARG  35 -12.342  -0.664  -7.417
  290    H    GLU  36           H        GLU  36 -11.503  -6.580  -0.951
  291    HA   GLU  36           HA       GLU  36 -11.295  -5.360   1.610
  292    HB2  GLU  36           1HB      GLU  36 -13.055  -6.929   0.954
  293    HB3  GLU  36           2HB      GLU  36 -11.857  -8.244   0.901
  294    HG2  GLU  36           1HG      GLU  36 -11.493  -7.959   3.401
  295    HG3  GLU  36           2HG      GLU  36 -12.660  -6.623   3.281
  296    H    VAL  37           H        VAL  37  -9.547  -8.193   0.321
  297    HA   VAL  37           HA       VAL  37  -7.916  -8.560   2.693
  298    HB   VAL  37           HB       VAL  37  -7.477  -9.388  -0.205
  299   HG11  VAL  37          1HG1      VAL  37  -5.777 -10.931   0.713
  300   HG12  VAL  37          2HG1      VAL  37  -5.341  -9.236   1.031
  301   HG13  VAL  37          3HG1      VAL  37  -6.023 -10.239   2.333
  302   HG21  VAL  37          3HG2      VAL  37  -9.439 -10.402   0.789
  303   HG22  VAL  37          1HG2      VAL  37  -8.146 -11.605   0.572
  304   HG23  VAL  37          2HG2      VAL  37  -8.477 -10.936   2.189
  305    H    LEU  38           H        LEU  38  -7.416  -6.733  -0.301
  306    HA   LEU  38           HA       LEU  38  -4.755  -5.895   0.230
  307    HB2  LEU  38           1HB      LEU  38  -5.786  -5.608  -1.790
  308    HB3  LEU  38           2HB      LEU  38  -7.049  -4.487  -1.236
  309    HG   LEU  38           HG       LEU  38  -5.207  -2.873  -0.612
  310   HD11  LEU  38          1HD1      LEU  38  -2.983  -3.227  -1.717
  311   HD12  LEU  38          2HD1      LEU  38  -3.343  -4.527  -0.557
  312   HD13  LEU  38          3HD1      LEU  38  -3.544  -4.812  -2.303
  313   HD21  LEU  38          3HD2      LEU  38  -6.531  -2.572  -2.622
  314   HD22  LEU  38          1HD2      LEU  38  -4.845  -2.088  -2.926
  315   HD23  LEU  38          2HD2      LEU  38  -5.448  -3.651  -3.531
  316    H    LEU  39           H        LEU  39  -7.841  -4.467   1.276
  317    HA   LEU  39           HA       LEU  39  -6.631  -2.229   2.627
  318    HB2  LEU  39           1HB      LEU  39  -9.160  -3.706   2.858
  319    HB3  LEU  39           2HB      LEU  39  -8.941  -2.264   3.877
  320    HG   LEU  39           HG       LEU  39  -8.901  -2.308   0.834
  321   HD11  LEU  39          1HD1      LEU  39 -11.084  -1.084   1.021
  322   HD12  LEU  39          2HD1      LEU  39 -11.183  -2.699   1.760
  323   HD13  LEU  39          3HD1      LEU  39 -11.011  -1.258   2.790
  324   HD21  LEU  39          3HD2      LEU  39  -7.473  -0.583   1.759
  325   HD22  LEU  39          1HD2      LEU  39  -8.917   0.155   1.026
  326   HD23  LEU  39          2HD2      LEU  39  -8.799  -0.001   2.795
  327    H    VAL  40           H        VAL  40  -7.391  -5.523   3.629
  328    HA   VAL  40           HA       VAL  40  -6.855  -5.143   6.452
  329    HB   VAL  40           HB       VAL  40  -6.680  -7.596   4.656
  330   HG11  VAL  40          1HG1      VAL  40  -6.591  -8.894   6.758
  331   HG12  VAL  40          2HG1      VAL  40  -5.176  -7.827   6.605
  332   HG13  VAL  40          3HG1      VAL  40  -6.515  -7.380   7.691
  333   HG21  VAL  40          3HG2      VAL  40  -8.921  -6.708   4.891
  334   HG22  VAL  40          1HG2      VAL  40  -8.755  -8.248   5.767
  335   HG23  VAL  40          2HG2      VAL  40  -8.757  -6.710   6.664
  336    H    THR  41           H        THR  41  -4.766  -6.115   3.745
  337    HA   THR  41           HA       THR  41  -2.462  -6.449   5.509
  338    HB   THR  41           HB       THR  41  -1.177  -6.663   3.393
  339    HG1  THR  41           1HG      THR  41  -3.704  -6.133   2.159
  340   HG21  THR  41          3HG2      THR  41  -3.802  -8.208   3.397
  341   HG22  THR  41          1HG2      THR  41  -2.317  -8.681   2.537
  342   HG23  THR  41          2HG2      THR  41  -2.340  -8.639   4.316
  343    H    LEU  42           H        LEU  42  -3.808  -3.838   3.598
  344    HA   LEU  42           HA       LEU  42  -1.518  -2.082   3.892
  345    HB2  LEU  42           1HB      LEU  42  -4.393  -1.783   3.388
  346    HB3  LEU  42           2HB      LEU  42  -3.424  -0.294   3.473
  347    HG   LEU  42           HG       LEU  42  -2.985  -2.572   1.504
  348   HD11  LEU  42          1HD1      LEU  42  -3.855  -0.958  -0.208
  349   HD12  LEU  42          2HD1      LEU  42  -5.084  -1.314   1.028
  350   HD13  LEU  42          3HD1      LEU  42  -4.180   0.217   1.087
  351   HD21  LEU  42          3HD2      LEU  42  -0.939  -1.393   2.057
  352   HD22  LEU  42          1HD2      LEU  42  -1.435  -0.999   0.395
  353   HD23  LEU  42          2HD2      LEU  42  -1.711   0.172   1.707
  354    H    THR  43           H        THR  43  -4.474  -2.619   5.785
  355    HA   THR  43           HA       THR  43  -3.873  -0.614   7.774
  356    HB   THR  43           HB       THR  43  -5.528  -3.166   7.975
  357    HG1  THR  43           1HG      THR  43  -6.392  -1.695   6.486
  358   HG21  THR  43          3HG2      THR  43  -5.417  -0.719   9.783
  359   HG22  THR  43          1HG2      THR  43  -6.550  -2.081   9.944
  360   HG23  THR  43          2HG2      THR  43  -4.805  -2.339  10.189
  361    H    ARG  44           H        ARG  44  -3.021  -4.030   7.438
  362    HA   ARG  44           HA       ARG  44  -1.803  -4.342  10.012
  363    HB2  ARG  44           1HB      ARG  44  -1.363  -5.714   7.410
  364    HB3  ARG  44           2HB      ARG  44  -0.436  -6.090   8.881
  365    HG2  ARG  44           1HG      ARG  44  -2.460  -6.733  10.048
  366    HG3  ARG  44           2HG      ARG  44  -3.458  -6.232   8.660
  367    HD2  ARG  44           1HD      ARG  44  -2.478  -7.982   7.320
  368    HD3  ARG  44           2HD      ARG  44  -1.461  -8.474   8.694
  369    HE   ARG  44           HE       ARG  44  -4.213  -8.767   9.518
  370   HH11  ARG  44          1HH1      ARG  44  -2.064 -10.164   7.156
  371   HH12  ARG  44          2HH1      ARG  44  -2.934 -11.683   7.253
  372   HH21  ARG  44          1HH2      ARG  44  -5.226 -10.497   9.634
  373   HH22  ARG  44          2HH2      ARG  44  -4.738 -11.873   8.665
  374    H    LEU  45           H        LEU  45  -0.453  -3.251   6.902
  375    HA   LEU  45           HA       LEU  45   2.204  -2.828   7.975
  376    HB2  LEU  45           1HB      LEU  45   0.682  -1.837   5.664
  377    HB3  LEU  45           2HB      LEU  45   2.386  -1.351   5.820
  378    HG   LEU  45           HG       LEU  45   1.372  -4.208   5.550
  379   HD11  LEU  45          1HD1      LEU  45   2.433  -4.118   3.278
  380   HD12  LEU  45          2HD1      LEU  45   1.138  -2.908   3.435
  381   HD13  LEU  45          3HD1      LEU  45   2.843  -2.409   3.553
  382   HD21  LEU  45          3HD2      LEU  45   3.401  -4.064   6.869
  383   HD22  LEU  45          1HD2      LEU  45   3.759  -4.788   5.284
  384   HD23  LEU  45          2HD2      LEU  45   4.189  -3.091   5.602
  385    H    HIS  46           H        HIS  46  -0.639  -0.756   7.557
  386    HA   HIS  46           HA       HIS  46   0.657   1.694   8.305
  387    HB2  HIS  46           1HB      HIS  46  -1.552   1.660   7.188
  388    HB3  HIS  46           2HB      HIS  46  -2.265   0.870   8.614
  389    HD2  HIS  46           2HD      HIS  46  -3.271   2.684  10.529
  390    HE1  HIS  46           1HE      HIS  46  -1.317   6.087   8.902
  391    HE2  HIS  46           2HE      HIS  46  -3.016   5.168  10.685
  392    H    GLN  47           H        GLN  47  -1.111  -0.725  10.228
  393    HA   GLN  47           HA       GLN  47  -0.702   0.725  12.719
  394    HB2  GLN  47           1HB      GLN  47  -1.452  -2.141  12.108
  395    HB3  GLN  47           2HB      GLN  47  -1.396  -1.442  13.743
  396    HG2  GLN  47           1HG      GLN  47  -3.499  -0.614  11.558
  397    HG3  GLN  47           2HG      GLN  47  -3.468  -1.595  13.042
  398   HE21  GLN  47          2HE2      GLN  47  -4.346   1.324  11.822
  399   HE22  GLN  47          1HE2      GLN  47  -4.236   2.299  13.249
  400    H    ARG  48           H        ARG  48   1.043  -1.778  10.966
  401    HA   ARG  48           HA       ARG  48   2.922  -2.419  13.042
  402    HB2  ARG  48           1HB      ARG  48   2.632  -3.786  11.103
  403    HB3  ARG  48           2HB      ARG  48   3.293  -2.488  10.080
  404    HG2  ARG  48           1HG      ARG  48   5.448  -2.661  11.207
  405    HG3  ARG  48           2HG      ARG  48   4.796  -3.901  12.304
  406    HD2  ARG  48           1HD      ARG  48   4.530  -5.424  10.487
  407    HD3  ARG  48           2HD      ARG  48   5.050  -4.178   9.328
  408    HE   ARG  48           HE       ARG  48   7.210  -4.773  11.231
  409   HH11  ARG  48          1HH1      ARG  48   5.616  -6.053   8.405
  410   HH12  ARG  48          2HH1      ARG  48   7.089  -6.882   7.943
  411   HH21  ARG  48          1HH2      ARG  48   8.901  -5.723  10.719
  412   HH22  ARG  48          2HH2      ARG  48   8.963  -6.695   9.261
  413    H    GLY  49           H        GLY  49   2.766   0.213  10.702
  414    HA2  GLY  49           1HA      GLY  49   3.776   2.345  11.218
  415    HA3  GLY  49           2HA      GLY  49   5.013   1.503  12.178
  416    H    VAL  50           H        VAL  50   3.976   0.347   9.031
  417    HA   VAL  50           HA       VAL  50   6.706   0.948   7.934
  418    HB   VAL  50           HB       VAL  50   4.507  -0.902   6.917
  419   HG11  VAL  50          1HG1      VAL  50   6.251  -1.704   5.359
  420   HG12  VAL  50          2HG1      VAL  50   5.919   0.027   5.114
  421   HG13  VAL  50          3HG1      VAL  50   7.379  -0.484   5.994
  422   HG21  VAL  50          3HG2      VAL  50   5.477  -1.731   8.978
  423   HG22  VAL  50          1HG2      VAL  50   5.995  -2.720   7.593
  424   HG23  VAL  50          2HG2      VAL  50   7.114  -1.536   8.307
  425    H    ILE  51           H        ILE  51   3.260   1.321   7.153
  426    HA   ILE  51           HA       ILE  51   4.085   3.468   5.215
  427    HB   ILE  51           HB       ILE  51   2.125   2.875   3.849
  428   HG12  ILE  51          1HG1      ILE  51   1.735   0.568   5.738
  429   HG13  ILE  51          2HG1      ILE  51   0.776   2.067   5.733
  430   HG21  ILE  51          1HG2      ILE  51   2.884   0.688   2.982
  431   HG22  ILE  51          2HG2      ILE  51   4.266   1.755   3.327
  432   HG23  ILE  51          3HG2      ILE  51   3.855   0.441   4.453
  433   HD11  ILE  51          3HD1      ILE  51   0.979   0.077   3.445
  434   HD12  ILE  51          1HD1      ILE  51  -0.401   0.253   4.551
  435   HD13  ILE  51          2HD1      ILE  51   0.021   1.576   3.439
  436    H    TYR  52           H        TYR  52   2.306   4.971   4.686
  437    HA   TYR  52           HA       TYR  52   0.563   5.474   7.063
  438    HB2  TYR  52           1HB      TYR  52   2.531   6.859   7.348
  439    HB3  TYR  52           2HB      TYR  52   2.370   7.468   5.682
  440    HD1  TYR  52           1HD      TYR  52   0.630   7.383   8.989
  441    HD2  TYR  52           2HD      TYR  52   1.055   9.374   5.242
  442    HE1  TYR  52           1HE      TYR  52  -0.821   9.217   9.807
  443    HE2  TYR  52           2HE      TYR  52  -0.391  11.211   6.042
  444    HH   TYR  52           HH       TYR  52  -1.625  12.032   7.771
  445    H    ARG  53           H        ARG  53  -1.395   6.292   6.681
  446    HA   ARG  53           HA       ARG  53  -2.100   6.672   3.787
  447    HB2  ARG  53           1HB      ARG  53  -4.153   5.646   4.087
  448    HB3  ARG  53           2HB      ARG  53  -2.865   4.544   4.625
  449    HG2  ARG  53           1HG      ARG  53  -3.388   5.302   6.993
  450    HG3  ARG  53           2HG      ARG  53  -4.838   6.086   6.324
  451    HD2  ARG  53           1HD      ARG  53  -5.666   3.968   5.567
  452    HD3  ARG  53           2HD      ARG  53  -4.190   3.162   6.148
  453    HE   ARG  53           HE       ARG  53  -5.704   4.447   8.347
  454   HH11  ARG  53          1HH1      ARG  53  -5.457   1.566   6.398
  455   HH12  ARG  53          2HH1      ARG  53  -6.187   0.625   7.683
  456   HH21  ARG  53          1HH2      ARG  53  -6.549   3.384   9.826
  457   HH22  ARG  53          2HH2      ARG  53  -6.812   1.662   9.638
  458    H    LYS  54           H        LYS  54  -3.676   8.142   3.247
  459    HA   LYS  54           HA       LYS  54  -4.869   9.875   5.275
  460    HB2  LYS  54           1HB      LYS  54  -3.766  11.899   4.656
  461    HB3  LYS  54           2HB      LYS  54  -2.564  10.717   5.223
  462    HG2  LYS  54           1HG      LYS  54  -1.931  10.231   2.898
  463    HG3  LYS  54           2HG      LYS  54  -3.147  11.395   2.319
  464    HD2  LYS  54           1HD      LYS  54  -1.973  13.212   3.487
  465    HD3  LYS  54           2HD      LYS  54  -0.762  12.051   4.082
  466    HE2  LYS  54           1HE      LYS  54  -0.112  11.537   1.772
  467    HE3  LYS  54           2HE      LYS  54  -1.328  12.687   1.171
  468    HZ1  LYS  54           3HZ      LYS  54   0.999  13.374   2.848
  469    HZ2  LYS  54           1HZ      LYS  54   0.865  13.662   1.230
  470    HZ3  LYS  54           2HZ      LYS  54  -0.129  14.441   2.291
  471    H    TRP  55           H        TRP  55  -6.183  11.574   4.369
  472    HA   TRP  55           HA       TRP  55  -7.399  10.585   1.833
  473    HB2  TRP  55           1HB      TRP  55  -8.439  12.396   4.052
  474    HB3  TRP  55           2HB      TRP  55  -9.325  12.052   2.548
  475    HD1  TRP  55           HD       TRP  55  -8.296  10.589   5.773
  476    HE1  TRP  55           1HE      TRP  55  -9.677   8.311   6.224
  477    HE3  TRP  55           3HE      TRP  55 -10.481  10.143   1.205
  478    HZ2  TRP  55           2HZ      TRP  55 -11.385   6.722   4.744
  479    HZ3  TRP  55           3HZ      TRP  55 -11.952   8.282   0.741
  480    HH2  TRP  55           HH       TRP  55 -12.440   6.571   2.436
  481    H    ARG  56           H        ARG  56  -7.714  11.775   0.052
  482    HA   ARG  56           HA       ARG  56  -6.815  14.625   0.108
  483    HB2  ARG  56           1HB      ARG  56  -4.944  13.418  -0.691
  484    HB3  ARG  56           2HB      ARG  56  -5.952  12.599  -1.906
  485    HG2  ARG  56           1HG      ARG  56  -6.352  14.699  -3.052
  486    HG3  ARG  56           2HG      ARG  56  -5.467  15.590  -1.791
  487    HD2  ARG  56           1HD      ARG  56  -4.094  15.401  -3.698
  488    HD3  ARG  56           2HD      ARG  56  -3.441  14.348  -2.422
  489    HE   ARG  56           HE       ARG  56  -3.928  12.430  -3.910
  490   HH11  ARG  56          1HH1      ARG  56  -5.353  15.342  -5.197
  491   HH12  ARG  56          2HH1      ARG  56  -5.631  14.535  -6.728
  492   HH21  ARG  56          1HH2      ARG  56  -4.249  11.491  -5.654
  493   HH22  ARG  56          2HH2      ARG  56  -5.002  12.338  -6.989
  494    H    HIS  57           H        HIS  57  -8.265  15.941  -0.630
  495    HA   HIS  57           HA       HIS  57 -10.680  14.990  -1.927
  496    HB2  HIS  57           1HB      HIS  57 -10.513  17.061  -0.450
  497    HB3  HIS  57           2HB      HIS  57  -9.666  17.860  -1.796
  498    HD1  HIS  57           1HD      HIS  57 -11.047  18.373  -3.941
  499    HD2  HIS  57           2HD      HIS  57 -13.374  16.831  -0.785
  500    HE1  HIS  57           1HE      HIS  57 -13.368  18.898  -4.498
  501    H    PHE  58           H        PHE  58 -11.270  14.861  -3.966
  502    HA   PHE  58           HA       PHE  58  -9.678  16.109  -6.102
  503    HB2  PHE  58           1HB      PHE  58  -8.342  14.070  -5.609
  504    HB3  PHE  58           2HB      PHE  58  -9.793  13.072  -5.854
  505    HD1  PHE  58           1HD      PHE  58  -7.609  15.545  -7.580
  506    HD2  PHE  58           2HD      PHE  58 -10.273  12.223  -7.925
  507    HE1  PHE  58           1HE      PHE  58  -7.081  15.375  -9.990
  508    HE2  PHE  58           2HE      PHE  58  -9.747  12.048 -10.334
  509    HZ   PHE  58           HZ       PHE  58  -8.151  13.626 -11.366
  510    H    SER  59           H        SER  59 -11.123  16.934  -7.376
  511    HA   SER  59           HA       SER  59 -12.964  17.017  -8.892
  512    HB2  SER  59           1HB      SER  59 -12.720  14.073  -8.740
  513    HB3  SER  59           2HB      SER  59 -13.674  15.028  -9.899
  514    HG   SER  59           HG       SER  59 -11.705  16.008 -10.552
  515    H    GLY  60           H        GLY  60 -13.385  16.994  -5.902
  516    HA2  GLY  60           1HA      GLY  60 -15.451  17.577  -4.897
  517    HA3  GLY  60           2HA      GLY  60 -16.314  16.654  -6.150
  518    H    ARG  61           H        ARG  61 -13.800  14.748  -5.197
  519    HA   ARG  61           HA       ARG  61 -15.315  13.481  -2.953
  520    HB2  ARG  61           1HB      ARG  61 -14.399  12.056  -5.412
  521    HB3  ARG  61           2HB      ARG  61 -14.954  11.290  -3.903
  522    HG2  ARG  61           1HG      ARG  61 -16.641  13.171  -5.579
  523    HG3  ARG  61           2HG      ARG  61 -16.678  11.397  -5.728
  524    HD2  ARG  61           1HD      ARG  61 -17.365  11.251  -3.388
  525    HD3  ARG  61           2HD      ARG  61 -17.412  13.029  -3.319
  526    HE   ARG  61           HE       ARG  61 -19.501  11.355  -4.638
  527   HH11  ARG  61          1HH1      ARG  61 -18.200  14.553  -4.154
  528   HH12  ARG  61          2HH1      ARG  61 -19.708  15.256  -4.708
  529   HH21  ARG  61          1HH2      ARG  61 -21.236  12.144  -5.267
  530   HH22  ARG  61          2HH2      ARG  61 -21.439  13.883  -5.342
  531    H    LYS  62           H        LYS  62 -14.146  12.671  -1.367
  532    HA   LYS  62           HA       LYS  62 -11.209  13.048  -1.521
  533    HB2  LYS  62           1HB      LYS  62 -13.085  12.288   0.722
  534    HB3  LYS  62           2HB      LYS  62 -11.317  12.416   0.885
  535    HG2  LYS  62           1HG      LYS  62 -11.426  14.799   0.296
  536    HG3  LYS  62           2HG      LYS  62 -13.193  14.676   0.113
  537    HD2  LYS  62           1HD      LYS  62 -13.399  14.050   2.484
  538    HD3  LYS  62           2HD      LYS  62 -11.634  14.160   2.668
  539    HE2  LYS  62           1HE      LYS  62 -11.714  16.542   2.075
  540    HE3  LYS  62           2HE      LYS  62 -13.478  16.436   1.878
  541    HZ1  LYS  62           3HZ      LYS  62 -12.003  15.969   4.390
  542    HZ2  LYS  62           1HZ      LYS  62 -12.875  17.321   4.028
  543    HZ3  LYS  62           2HZ      LYS  62 -13.639  15.869   4.208
  544    H    TYR  63           H        TYR  63  -9.801  11.548  -1.918
  545    HA   TYR  63           HA       TYR  63 -10.634   8.688  -1.528
  546    HB2  TYR  63           1HB      TYR  63  -8.722   9.847  -3.566
  547    HB3  TYR  63           2HB      TYR  63  -9.101   8.122  -3.336
  548    HD1  TYR  63           2HD      TYR  63 -11.348   7.260  -3.947
  549    HD2  TYR  63           1HD      TYR  63 -10.222  11.288  -4.778
  550    HE1  TYR  63           2HE      TYR  63 -13.243   7.453  -5.522
  551    HE2  TYR  63           1HE      TYR  63 -12.116  11.499  -6.361
  552    HH   TYR  63           HH       TYR  63 -14.362   8.798  -6.979
  553    H    ARG  64           H        ARG  64  -9.217   7.255  -0.665
  554    HA   ARG  64           HA       ARG  64  -7.123   8.536   1.015
  555    HB2  ARG  64           1HB      ARG  64  -8.869   7.076   1.983
  556    HB3  ARG  64           2HB      ARG  64  -8.080   5.717   1.152
  557    HG2  ARG  64           1HG      ARG  64  -6.078   5.989   2.424
  558    HG3  ARG  64           2HG      ARG  64  -6.637   7.544   3.086
  559    HD2  ARG  64           1HD      ARG  64  -6.790   5.906   4.771
  560    HD3  ARG  64           2HD      ARG  64  -8.437   6.327   4.245
  561    HE   ARG  64           HE       ARG  64  -7.284   3.749   3.195
  562   HH11  ARG  64          1HH1      ARG  64  -9.569   5.370   5.270
  563   HH12  ARG  64          2HH1      ARG  64 -10.494   3.886   5.417
  564   HH21  ARG  64          1HH2      ARG  64  -8.327   2.043   3.360
  565   HH22  ARG  64          2HH2      ARG  64  -9.786   1.989   4.331
  566    H    GLU  65           H        GLU  65  -5.045   8.376   0.722
  567    HA   GLU  65           HA       GLU  65  -4.076   6.408  -1.328
  568    HB2  GLU  65           1HB      GLU  65  -2.975   9.107  -0.530
  569    HB3  GLU  65           2HB      GLU  65  -2.195   7.966  -1.653
  570    HG2  GLU  65           1HG      GLU  65  -4.244   8.208  -3.186
  571    HG3  GLU  65           2HG      GLU  65  -4.817   9.365  -1.963
  572    H    TYR  66           H        TYR  66  -2.070   5.423  -1.036
  573    HA   TYR  66           HA       TYR  66  -1.200   5.319   1.837
  574    HB2  TYR  66           1HB      TYR  66  -1.362   3.109  -0.220
  575    HB3  TYR  66           2HB      TYR  66  -0.563   2.969   1.365
  576    HD1  TYR  66           1HD      TYR  66  -3.845   3.458  -0.311
  577    HD2  TYR  66           2HD      TYR  66  -1.836   2.572   3.347
  578    HE1  TYR  66           1HE      TYR  66  -6.009   2.829   0.719
  579    HE2  TYR  66           2HE      TYR  66  -3.987   1.942   4.387
  580    HH   TYR  66           HH       TYR  66  -6.220   1.457   3.973
  581    H    CYS  67           H        CYS  67   0.822   5.716   2.281
  582    HA   CYS  67           HA       CYS  67   2.815   5.854  -0.004
  583    HB2  CYS  67           1HB      CYS  67   1.748   8.026   0.502
  584    HB3  CYS  67           2HB      CYS  67   2.171   7.837   2.222
  585    HG   CYS  67           HG       CYS  67   3.577   9.661   1.154
  586    H    LEU  68           H        LEU  68   4.747   4.996   0.463
  587    HA   LEU  68           HA       LEU  68   5.205   3.509   2.864
  588    HB2  LEU  68           1HB      LEU  68   6.163   3.087   0.771
  589    HB3  LEU  68           2HB      LEU  68   7.215   4.521   0.777
  590    HG   LEU  68           HG       LEU  68   8.256   3.600   2.904
  591   HD11  LEU  68          1HD1      LEU  68   8.002   1.133   3.272
  592   HD12  LEU  68          2HD1      LEU  68   6.446   1.976   3.454
  593   HD13  LEU  68          3HD1      LEU  68   6.800   1.075   1.960
  594   HD21  LEU  68          3HD2      LEU  68   9.395   3.501   0.766
  595   HD22  LEU  68          1HD2      LEU  68   9.722   2.020   1.697
  596   HD23  LEU  68          2HD2      LEU  68   8.553   1.988   0.355
  597    H    LYS  69           H        LYS  69   5.855   4.007   4.798
  598    HA   LYS  69           HA       LYS  69   6.599   6.851   5.301
  599    HB2  LYS  69           1HB      LYS  69   4.724   5.832   6.540
  600    HB3  LYS  69           2HB      LYS  69   5.851   4.628   7.208
  601    HG2  LYS  69           1HG      LYS  69   7.106   6.405   8.337
  602    HG3  LYS  69           2HG      LYS  69   6.018   7.630   7.643
  603    HD2  LYS  69           1HD      LYS  69   4.112   6.565   8.822
  604    HD3  LYS  69           2HD      LYS  69   5.241   5.407   9.562
  605    HE2  LYS  69           1HE      LYS  69   6.420   7.210  10.684
  606    HE3  LYS  69           2HE      LYS  69   5.399   8.419   9.873
  607    HZ1  LYS  69           3HZ      LYS  69   4.452   6.388  11.793
  608    HZ2  LYS  69           1HZ      LYS  69   4.659   7.993  12.117
  609    HZ3  LYS  69           2HZ      LYS  69   3.506   7.510  11.040
  610    H    HIS  70           H        HIS  70   7.691   3.564   6.184
  611    HA   HIS  70           HA       HIS  70  10.422   4.744   6.578
  612    HB2  HIS  70           1HB      HIS  70   9.105   2.362   7.957
  613    HB3  HIS  70           2HB      HIS  70  10.830   2.776   8.097
  614    HD1  HIS  70           1HD      HIS  70  11.455   4.871   9.473
  615    HD2  HIS  70           2HD      HIS  70   7.320   4.057   9.502
  616    HE1  HIS  70           1HE      HIS  70  10.526   6.166  11.326
  617    H    ARG  71           H        ARG  71  12.214   3.603   5.885
  618    HA   ARG  71           HA       ARG  71  11.572   1.837   3.551
  619    HB2  ARG  71           1HB      ARG  71  13.958   3.558   4.060
  620    HB3  ARG  71           2HB      ARG  71  13.756   2.427   2.702
  621    HG2  ARG  71           1HG      ARG  71  11.823   3.708   1.908
  622    HG3  ARG  71           2HG      ARG  71  11.999   4.832   3.278
  623    HD2  ARG  71           1HD      ARG  71  14.146   5.532   2.437
  624    HD3  ARG  71           2HD      ARG  71  13.993   4.394   1.077
  625    HE   ARG  71           HE       ARG  71  11.786   6.227   0.864
  626   HH11  ARG  71          1HH1      ARG  71  15.267   6.415   0.781
  627   HH12  ARG  71          2HH1      ARG  71  15.172   7.785  -0.307
  628   HH21  ARG  71          1HH2      ARG  71  11.661   7.801  -0.374
  629   HH22  ARG  71          2HH2      ARG  71  13.117   8.578  -0.966
  630    H    ASP  72           H        ASP  72  12.069   1.258   6.571
  631    HA   ASP  72           HA       ASP  72  14.418  -0.401   6.669
  632    HB2  ASP  72           1HB      ASP  72  11.828  -0.496   8.331
  633    HB3  ASP  72           2HB      ASP  72  13.282  -1.516   8.451
  634    H    GLU  73           H        GLU  73  11.030  -1.103   5.844
  635    HA   GLU  73           HA       GLU  73  11.598  -3.912   5.265
  636    HB2  GLU  73           1HB      GLU  73   9.290  -2.074   4.625
  637    HB3  GLU  73           2HB      GLU  73   9.355  -3.786   4.142
  638    HG2  GLU  73           1HG      GLU  73   9.324  -2.751   7.043
  639    HG3  GLU  73           2HG      GLU  73   8.023  -3.487   6.080
  640    H    LEU  74           H        LEU  74  11.477  -0.912   3.409
  641    HA   LEU  74           HA       LEU  74  11.726  -2.009   0.803
  642    HB2  LEU  74           1HB      LEU  74  11.375   0.267   1.499
  643    HB3  LEU  74           2HB      LEU  74  13.101   0.524   1.852
  644    HG   LEU  74           HG       LEU  74  11.957  -0.282  -0.849
  645   HD11  LEU  74          1HD1      LEU  74  12.570   2.047  -1.552
  646   HD12  LEU  74          2HD1      LEU  74  11.363   2.062  -0.246
  647   HD13  LEU  74          3HD1      LEU  74  13.072   2.402   0.117
  648   HD21  LEU  74          3HD2      LEU  74  14.203  -1.119  -0.484
  649   HD22  LEU  74          1HD2      LEU  74  14.231   0.189  -1.688
  650   HD23  LEU  74          2HD2      LEU  74  14.764   0.504  -0.018
  651    H    ALA  75           H        ALA  75  14.264  -1.270   3.194
  652    HA   ALA  75           HA       ALA  75  16.452  -2.158   1.612
  653    HB1  ALA  75           1HB      ALA  75  17.634  -2.431   3.758
  654    HB2  ALA  75           2HB      ALA  75  16.737  -0.894   3.697
  655    HB3  ALA  75           3HB      ALA  75  16.091  -2.267   4.627
  656    H    ASP  76           H        ASP  76  14.280  -3.942   3.787
  657    HA   ASP  76           HA       ASP  76  15.645  -6.463   3.577
  658    HB2  ASP  76           1HB      ASP  76  12.701  -5.831   4.218
  659    HB3  ASP  76           2HB      ASP  76  13.526  -7.407   4.148
  660    H    LEU  77           H        LEU  77  13.192  -4.903   1.574
  661    HA   LEU  77           HA       LEU  77  12.718  -7.188  -0.124
  662    HB2  LEU  77           1HB      LEU  77  12.506  -4.271  -0.420
  663    HB3  LEU  77           2HB      LEU  77  11.941  -5.296  -1.760
  664    HG   LEU  77           HG       LEU  77  10.839  -5.309   1.076
  665   HD11  LEU  77          1HD1      LEU  77   8.794  -4.301   0.029
  666   HD12  LEU  77          2HD1      LEU  77  10.214  -3.252  -0.188
  667   HD13  LEU  77          3HD1      LEU  77   9.635  -4.258  -1.538
  668   HD21  LEU  77          3HD2      LEU  77  10.709  -7.490   0.026
  669   HD22  LEU  77          1HD2      LEU  77   9.083  -6.777   0.149
  670   HD23  LEU  77          2HD2      LEU  77   9.938  -6.783  -1.414
  671    H    GLU  78           H        GLU  78  15.033  -4.507  -0.254
  672    HA   GLU  78           HA       GLU  78  16.196  -5.342  -2.780
  673    HB2  GLU  78           1HB      GLU  78  17.175  -3.610  -0.512
  674    HB3  GLU  78           2HB      GLU  78  18.111  -3.914  -1.996
  675    HG2  GLU  78           1HG      GLU  78  16.224  -2.845  -3.340
  676    HG3  GLU  78           2HG      GLU  78  15.417  -2.641  -1.768
  677    H    HIS  79           H        HIS  79  16.679  -6.241   0.569
  678    HA   HIS  79           HA       HIS  79  19.191  -7.651   0.027
  679    HB2  HIS  79           1HB      HIS  79  17.310  -7.697   2.430
  680    HB3  HIS  79           2HB      HIS  79  18.895  -8.502   2.358
  681    HD2  HIS  79           2HD      HIS  79  19.988  -5.363   0.781
  682    HE1  HIS  79           1HE      HIS  79  19.647  -4.401   4.905
  683    HE2  HIS  79           2HE      HIS  79  20.601  -3.710   2.556
  Start of MODEL    3
    1    H    LYS   3           H        LYS   3   6.222 -13.775  -8.691
    2    HA   LYS   3           HA       LYS   3   5.960 -11.460  -7.076
    3    HB2  LYS   3           1HB      LYS   3   3.630 -12.016  -8.915
    4    HB3  LYS   3           2HB      LYS   3   3.533 -11.034  -7.434
    5    HG2  LYS   3           1HG      LYS   3   5.157  -9.445  -8.377
    6    HG3  LYS   3           2HG      LYS   3   5.263 -10.429  -9.856
    7    HD2  LYS   3           1HD      LYS   3   2.876 -10.047 -10.293
    8    HD3  LYS   3           2HD      LYS   3   2.752  -9.083  -8.802
    9    HE2  LYS   3           1HE      LYS   3   4.256  -7.418  -9.678
   10    HE3  LYS   3           2HE      LYS   3   4.606  -8.418 -11.105
   11    HZ1  LYS   3           3HZ      LYS   3   1.987  -7.231 -10.444
   12    HZ2  LYS   3           1HZ      LYS   3   3.024  -6.681 -11.604
   13    HZ3  LYS   3           2HZ      LYS   3   2.309  -8.159 -11.769
   14    H    ALA   4           H        ALA   4   4.667 -14.539  -8.159
   15    HA   ALA   4           HA       ALA   4   3.004 -15.007  -5.869
   16    HB1  ALA   4           1HB      ALA   4   3.008 -17.354  -6.620
   17    HB2  ALA   4           2HB      ALA   4   2.720 -16.236  -7.974
   18    HB3  ALA   4           3HB      ALA   4   4.322 -16.983  -7.761
   19    H    LYS   5           H        LYS   5   6.423 -15.368  -6.439
   20    HA   LYS   5           HA       LYS   5   6.948 -17.153  -4.217
   21    HB2  LYS   5           1HB      LYS   5   8.675 -15.192  -5.728
   22    HB3  LYS   5           2HB      LYS   5   9.278 -16.280  -4.455
   23    HG2  LYS   5           1HG      LYS   5   8.604 -18.228  -5.793
   24    HG3  LYS   5           2HG      LYS   5   7.979 -17.147  -7.062
   25    HD2  LYS   5           1HD      LYS   5  10.236 -16.230  -7.400
   26    HD3  LYS   5           2HD      LYS   5  10.864 -17.296  -6.121
   27    HE2  LYS   5           1HE      LYS   5  10.206 -19.266  -7.424
   28    HE3  LYS   5           2HE      LYS   5   9.550 -18.212  -8.698
   29    HZ1  LYS   5           3HZ      LYS   5  12.377 -18.335  -7.861
   30    HZ2  LYS   5           1HZ      LYS   5  11.755 -18.996  -9.239
   31    HZ3  LYS   5           2HZ      LYS   5  11.770 -17.357  -9.043
   32    H    LEU   6           H        LEU   6   6.358 -13.744  -4.487
   33    HA   LEU   6           HA       LEU   6   7.349 -13.309  -1.709
   34    HB2  LEU   6           1HB      LEU   6   6.255 -11.503  -3.765
   35    HB3  LEU   6           2HB      LEU   6   6.946 -10.869  -2.255
   36    HG   LEU   6           HG       LEU   6   8.434 -12.302  -4.488
   37   HD11  LEU   6          1HD1      LEU   6   9.630 -10.108  -4.717
   38   HD12  LEU   6          2HD1      LEU   6   7.881  -9.921  -4.979
   39   HD13  LEU   6          3HD1      LEU   6   8.607  -9.432  -3.430
   40   HD21  LEU   6          3HD2      LEU   6   9.325 -12.941  -2.326
   41   HD22  LEU   6          1HD2      LEU   6  10.474 -11.870  -3.163
   42   HD23  LEU   6          2HD2      LEU   6   9.462 -11.234  -1.845
   43    H    SER   7           H        SER   7   6.089 -12.357  -0.104
   44    HA   SER   7           HA       SER   7   3.271 -13.167   0.012
   45    HB2  SER   7           1HB      SER   7   3.218 -12.330   2.094
   46    HB3  SER   7           2HB      SER   7   4.798 -13.120   1.887
   47    HG   SER   7           HG       SER   7   5.098 -11.161   2.904
   48    H    LEU   8           H        LEU   8   1.525 -11.666   0.411
   49    HA   LEU   8           HA       LEU   8   1.369  -9.461  -1.436
   50    HB2  LEU   8           1HB      LEU   8  -0.151 -10.264   0.952
   51    HB3  LEU   8           2HB      LEU   8  -0.767  -8.936  -0.058
   52    HG   LEU   8           HG       LEU   8  -0.421 -11.848  -0.869
   53   HD11  LEU   8          1HD1      LEU   8  -2.915 -11.776  -1.134
   54   HD12  LEU   8          2HD1      LEU   8  -2.430 -11.395   0.536
   55   HD13  LEU   8          3HD1      LEU   8  -2.910 -10.088  -0.573
   56   HD21  LEU   8          3HD2      LEU   8   0.150 -10.382  -2.715
   57   HD22  LEU   8          1HD2      LEU   8  -1.409 -11.179  -3.032
   58   HD23  LEU   8          2HD2      LEU   8  -1.370  -9.479  -2.506
   59    H    THR   9           H        THR   9   2.308  -9.698   1.938
   60    HA   THR   9           HA       THR   9   2.438  -6.869   2.456
   61    HB   THR   9           HB       THR   9   4.114  -9.151   3.582
   62    HG1  THR   9           1HG      THR   9   2.607  -8.912   5.338
   63   HG21  THR   9          3HG2      THR   9   3.699  -6.304   4.576
   64   HG22  THR   9          1HG2      THR   9   4.600  -7.581   5.426
   65   HG23  THR   9          2HG2      THR   9   5.200  -6.950   3.874
   66    H    GLN  10           H        GLN  10   4.907  -9.164   1.280
   67    HA   GLN  10           HA       GLN  10   6.945  -7.168   0.935
   68    HB2  GLN  10           1HB      GLN  10   6.460  -9.844  -0.385
   69    HB3  GLN  10           2HB      GLN  10   7.909  -8.847  -0.663
   70    HG2  GLN  10           1HG      GLN  10   8.487  -9.184   1.931
   71    HG3  GLN  10           2HG      GLN  10   6.867  -9.910   1.816
   72   HE21  GLN  10          2HE2      GLN  10  10.293 -10.285   1.127
   73   HE22  GLN  10          1HE2      GLN  10  10.241 -11.979   0.767
   74    H    LEU  11           H        LEU  11   4.403  -8.378  -1.210
   75    HA   LEU  11           HA       LEU  11   5.397  -7.072  -3.576
   76    HB2  LEU  11           1HB      LEU  11   2.784  -8.037  -2.644
   77    HB3  LEU  11           2HB      LEU  11   2.887  -7.385  -4.295
   78    HG   LEU  11           HG       LEU  11   4.416  -9.788  -3.222
   79   HD11  LEU  11          1HD1      LEU  11   2.963 -11.101  -4.791
   80   HD12  LEU  11          2HD1      LEU  11   1.991 -10.253  -3.565
   81   HD13  LEU  11          3HD1      LEU  11   2.101  -9.604  -5.220
   82   HD21  LEU  11          3HD2      LEU  11   5.688  -8.571  -4.890
   83   HD22  LEU  11          1HD2      LEU  11   5.121 -10.115  -5.567
   84   HD23  LEU  11          2HD2      LEU  11   4.302  -8.596  -6.006
   85    H    ILE  12           H        ILE  12   3.008  -6.100  -1.127
   86    HA   ILE  12           HA       ILE  12   2.355  -3.575  -2.375
   87    HB   ILE  12           HB       ILE  12   2.200  -4.551   0.509
   88   HG12  ILE  12          1HG1      ILE  12   0.010  -3.978  -1.466
   89   HG13  ILE  12          2HG1      ILE  12   0.745  -5.579  -1.221
   90   HG21  ILE  12          1HG2      ILE  12   0.840  -2.535   0.952
   91   HG22  ILE  12          2HG2      ILE  12   2.494  -2.097   0.469
   92   HG23  ILE  12          3HG2      ILE  12   1.160  -1.955  -0.699
   93   HD11  ILE  12          3HD1      ILE  12  -0.713  -3.951   0.889
   94   HD12  ILE  12          1HD1      ILE  12  -1.364  -5.368   0.033
   95   HD13  ILE  12          2HD1      ILE  12   0.023  -5.552   1.135
   96    H    LEU  13           H        LEU  13   4.759  -4.436   0.094
   97    HA   LEU  13           HA       LEU  13   5.574  -1.706   0.530
   98    HB2  LEU  13           1HB      LEU  13   6.849  -4.332   0.904
   99    HB3  LEU  13           2HB      LEU  13   7.655  -2.883   1.550
  100    HG   LEU  13           HG       LEU  13   4.925  -3.941   2.383
  101   HD11  LEU  13          1HD1      LEU  13   6.060  -4.421   4.569
  102   HD12  LEU  13          2HD1      LEU  13   6.818  -5.324   3.236
  103   HD13  LEU  13          3HD1      LEU  13   7.600  -3.860   3.875
  104   HD21  LEU  13          3HD2      LEU  13   5.024  -1.521   2.484
  105   HD22  LEU  13          1HD2      LEU  13   5.019  -2.196   4.130
  106   HD23  LEU  13          2HD2      LEU  13   6.536  -1.591   3.421
  107    H    ILE  14           H        ILE  14   6.683  -4.230  -1.682
  108    HA   ILE  14           HA       ILE  14   8.831  -2.620  -2.818
  109    HB   ILE  14           HB       ILE  14   7.245  -5.002  -3.875
  110   HG12  ILE  14          1HG1      ILE  14  10.111  -4.832  -2.995
  111   HG13  ILE  14          2HG1      ILE  14   8.766  -5.305  -1.931
  112   HG21  ILE  14          1HG2      ILE  14   8.943  -5.123  -5.665
  113   HG22  ILE  14          2HG2      ILE  14   8.033  -3.598  -5.749
  114   HG23  ILE  14          3HG2      ILE  14   9.678  -3.616  -5.072
  115   HD11  ILE  14          3HD1      ILE  14   9.606  -6.735  -4.476
  116   HD12  ILE  14          1HD1      ILE  14   9.936  -7.284  -2.818
  117   HD13  ILE  14          2HD1      ILE  14   8.261  -7.208  -3.413
  118    H    ARG  15           H        ARG  15   5.408  -3.047  -3.597
  119    HA   ARG  15           HA       ARG  15   5.475  -1.427  -5.976
  120    HB2  ARG  15           1HB      ARG  15   3.691  -2.927  -5.573
  121    HB3  ARG  15           2HB      ARG  15   3.221  -2.025  -4.114
  122    HG2  ARG  15           1HG      ARG  15   1.734  -1.492  -5.978
  123    HG3  ARG  15           2HG      ARG  15   2.684  -0.066  -5.490
  124    HD2  ARG  15           1HD      ARG  15   4.216  -0.530  -7.360
  125    HD3  ARG  15           2HD      ARG  15   3.114  -1.828  -7.879
  126    HE   ARG  15           HE       ARG  15   1.603   0.642  -7.844
  127   HH11  ARG  15          1HH1      ARG  15   4.273  -0.753  -9.601
  128   HH12  ARG  15          2HH1      ARG  15   3.827   0.170 -11.023
  129   HH21  ARG  15          1HH2      ARG  15   1.086   1.712  -9.462
  130   HH22  ARG  15          2HH2      ARG  15   2.011   1.577 -10.944
  131    H    LEU  16           H        LEU  16   5.230  -0.651  -2.557
  132    HA   LEU  16           HA       LEU  16   4.513   2.134  -2.996
  133    HB2  LEU  16           1HB      LEU  16   5.691   0.580  -0.793
  134    HB3  LEU  16           2HB      LEU  16   5.328   2.300  -0.519
  135    HG   LEU  16           HG       LEU  16   3.341   0.077  -1.129
  136   HD11  LEU  16          1HD1      LEU  16   2.446   0.645   1.145
  137   HD12  LEU  16          2HD1      LEU  16   4.149   0.137   1.229
  138   HD13  LEU  16          3HD1      LEU  16   3.729   1.863   1.329
  139   HD21  LEU  16          3HD2      LEU  16   2.689   2.120  -2.261
  140   HD22  LEU  16          1HD2      LEU  16   1.595   1.808  -0.892
  141   HD23  LEU  16          2HD2      LEU  16   2.866   3.048  -0.752
  142    H    SER  17           H        SER  17   7.507   0.335  -2.909
  143    HA   SER  17           HA       SER  17   9.328   2.622  -2.854
  144    HB2  SER  17           1HB      SER  17  10.017   0.459  -2.256
  145    HB3  SER  17           2HB      SER  17   9.717  -0.112  -3.914
  146    HG   SER  17           HG       SER  17  11.901   0.491  -3.552
  147    H    ASN  18           H        ASN  18   7.755   0.678  -5.420
  148    HA   ASN  18           HA       ASN  18   8.992   2.101  -7.615
  149    HB2  ASN  18           1HB      ASN  18   6.427   0.340  -7.707
  150    HB3  ASN  18           2HB      ASN  18   7.333   1.326  -8.879
  151   HD21  ASN  18          2HD2      ASN  18   6.804  -1.596  -8.656
  152   HD22  ASN  18          1HD2      ASN  18   8.366  -2.341  -8.735
  153    H    ARG  19           H        ARG  19   5.920   2.490  -5.879
  154    HA   ARG  19           HA       ARG  19   5.781   5.246  -7.034
  155    HB2  ARG  19           1HB      ARG  19   3.495   3.338  -6.843
  156    HB3  ARG  19           2HB      ARG  19   3.366   5.088  -7.140
  157    HG2  ARG  19           1HG      ARG  19   4.898   3.171  -8.920
  158    HG3  ARG  19           2HG      ARG  19   3.205   3.651  -9.198
  159    HD2  ARG  19           1HD      ARG  19   3.933   5.978  -9.361
  160    HD3  ARG  19           2HD      ARG  19   5.618   5.433  -9.192
  161    HE   ARG  19           HE       ARG  19   4.021   5.159 -11.696
  162   HH11  ARG  19          1HH1      ARG  19   6.906   4.238  -9.965
  163   HH12  ARG  19          2HH1      ARG  19   7.651   3.728 -11.466
  164   HH21  ARG  19          1HH2      ARG  19   4.865   4.587 -13.425
  165   HH22  ARG  19          2HH2      ARG  19   6.489   3.926 -13.440
  166    H    GLY  20           H        GLY  20   5.565   6.791  -5.603
  167    HA2  GLY  20           1HA      GLY  20   6.206   6.229  -2.943
  168    HA3  GLY  20           2HA      GLY  20   5.508   7.768  -3.504
  169    H    CYS  21           H        CYS  21   2.996   7.081  -4.288
  170    HA   CYS  21           HA       CYS  21   1.700   5.830  -1.846
  171    HB2  CYS  21           1HB      CYS  21   0.976   8.323  -3.450
  172    HB3  CYS  21           2HB      CYS  21   0.117   7.698  -2.020
  173    HG   CYS  21           HG       CYS  21   1.329   9.862  -1.466
  174    H    GLN  22           H        GLN  22   0.289   4.272  -2.335
  175    HA   GLN  22           HA       GLN  22  -1.028   4.319  -5.021
  176    HB2  GLN  22           1HB      GLN  22   0.246   1.983  -3.588
  177    HB3  GLN  22           2HB      GLN  22  -0.925   1.804  -4.915
  178    HG2  GLN  22           1HG      GLN  22   1.889   3.148  -5.334
  179    HG3  GLN  22           2HG      GLN  22   1.248   1.497  -5.498
  180   HE21  GLN  22          2HE2      GLN  22   0.429   4.869  -6.438
  181   HE22  GLN  22          1HE2      GLN  22  -0.071   4.476  -8.050
  182    H    THR  23           H        THR  23  -3.057   3.355  -5.167
  183    HA   THR  23           HA       THR  23  -4.535   3.385  -2.586
  184    HB   THR  23           HB       THR  23  -6.547   3.436  -3.920
  185    HG1  THR  23           1HG      THR  23  -6.243   3.394  -6.302
  186   HG21  THR  23          3HG2      THR  23  -4.432   5.209  -5.202
  187   HG22  THR  23          1HG2      THR  23  -6.190   5.469  -5.276
  188   HG23  THR  23          2HG2      THR  23  -5.338   5.582  -3.717
  189    H    LEU  24           H        LEU  24  -6.304   1.778  -2.327
  190    HA   LEU  24           HA       LEU  24  -5.216  -0.859  -2.184
  191    HB2  LEU  24           1HB      LEU  24  -6.871  -0.063  -0.793
  192    HB3  LEU  24           2HB      LEU  24  -8.120   0.122  -2.046
  193    HG   LEU  24           HG       LEU  24  -8.009  -2.353  -2.432
  194   HD11  LEU  24          1HD1      LEU  24  -6.928  -3.754  -0.654
  195   HD12  LEU  24          2HD1      LEU  24  -5.734  -2.730  -1.484
  196   HD13  LEU  24          3HD1      LEU  24  -6.330  -2.273   0.129
  197   HD21  LEU  24          3HD2      LEU  24  -9.768  -1.388  -1.070
  198   HD22  LEU  24          1HD2      LEU  24  -9.284  -2.968  -0.407
  199   HD23  LEU  24          2HD2      LEU  24  -8.732  -1.467   0.376
  200    H    GLU  25           H        GLU  25  -7.339   0.666  -4.580
  201    HA   GLU  25           HA       GLU  25  -7.731  -1.757  -6.120
  202    HB2  GLU  25           1HB      GLU  25  -7.975   1.176  -6.794
  203    HB3  GLU  25           2HB      GLU  25  -8.384  -0.141  -7.920
  204    HG2  GLU  25           1HG      GLU  25 -10.191  -0.914  -6.334
  205    HG3  GLU  25           2HG      GLU  25  -9.595   0.348  -5.231
  206    H    GLU  26           H        GLU  26  -5.368   0.874  -6.238
  207    HA   GLU  26           HA       GLU  26  -4.085  -0.072  -8.662
  208    HB2  GLU  26           1HB      GLU  26  -3.225   1.745  -6.414
  209    HB3  GLU  26           2HB      GLU  26  -2.182   1.351  -7.801
  210    HG2  GLU  26           1HG      GLU  26  -3.749   2.480  -9.354
  211    HG3  GLU  26           2HG      GLU  26  -4.914   2.528  -8.013
  212    H    LEU  27           H        LEU  27  -3.730  -0.797  -5.243
  213    HA   LEU  27           HA       LEU  27  -1.334  -2.418  -5.621
  214    HB2  LEU  27           1HB      LEU  27  -3.427  -2.177  -3.569
  215    HB3  LEU  27           2HB      LEU  27  -2.083  -3.305  -3.276
  216    HG   LEU  27           HG       LEU  27  -1.841  -0.296  -3.656
  217   HD11  LEU  27          1HD1      LEU  27  -1.184  -0.292  -1.236
  218   HD12  LEU  27          2HD1      LEU  27  -2.834  -0.921  -1.456
  219   HD13  LEU  27          3HD1      LEU  27  -1.483  -2.044  -1.167
  220   HD21  LEU  27          3HD2      LEU  27   0.089  -1.481  -4.522
  221   HD22  LEU  27          1HD2      LEU  27   0.525  -0.625  -3.023
  222   HD23  LEU  27          2HD2      LEU  27   0.255  -2.384  -2.995
  223    H    GLU  28           H        GLU  28  -4.806  -2.987  -5.726
  224    HA   GLU  28           HA       GLU  28  -4.676  -5.852  -5.947
  225    HB2  GLU  28           1HB      GLU  28  -6.763  -4.798  -5.526
  226    HB3  GLU  28           2HB      GLU  28  -6.613  -3.784  -6.982
  227    HG2  GLU  28           1HG      GLU  28  -6.873  -5.866  -8.413
  228    HG3  GLU  28           2HG      GLU  28  -6.924  -6.755  -6.874
  229    H    GLU  29           H        GLU  29  -4.305  -3.252  -8.316
  230    HA   GLU  29           HA       GLU  29  -4.220  -4.958 -10.634
  231    HB2  GLU  29           1HB      GLU  29  -3.030  -2.248 -10.041
  232    HB3  GLU  29           2HB      GLU  29  -2.942  -3.044 -11.630
  233    HG2  GLU  29           1HG      GLU  29  -5.447  -2.960 -11.813
  234    HG3  GLU  29           2HG      GLU  29  -5.438  -2.353 -10.141
  235    H    PHE  30           H        PHE  30  -1.731  -3.870  -8.363
  236    HA   PHE  30           HA       PHE  30   0.465  -5.005  -9.892
  237    HB2  PHE  30           1HB      PHE  30   0.792  -3.165  -8.248
  238    HB3  PHE  30           2HB      PHE  30   0.316  -4.269  -6.937
  239    HD1  PHE  30           1HD      PHE  30   2.822  -3.799  -9.642
  240    HD2  PHE  30           2HD      PHE  30   1.878  -5.583  -5.876
  241    HE1  PHE  30           1HE      PHE  30   5.174  -4.517  -9.395
  242    HE2  PHE  30           2HE      PHE  30   4.231  -6.302  -5.625
  243    HZ   PHE  30           HZ       PHE  30   5.878  -5.769  -7.387
  244    H    THR  31           H        THR  31  -1.426  -6.121  -7.085
  245    HA   THR  31           HA       THR  31   0.226  -8.583  -6.981
  246    HB   THR  31           HB       THR  31  -0.969  -9.071  -4.910
  247    HG1  THR  31           1HG      THR  31  -2.428  -6.654  -5.164
  248   HG21  THR  31          3HG2      THR  31  -0.206  -6.128  -5.064
  249   HG22  THR  31          1HG2      THR  31  -0.339  -7.092  -3.574
  250   HG23  THR  31          2HG2      THR  31   0.916  -7.480  -4.776
  251    H    GLN  32           H        GLN  32  -2.777  -7.520  -8.277
  252    HA   GLN  32           HA       GLN  32  -4.708  -8.626  -8.940
  253    HB2  GLN  32           1HB      GLN  32  -2.732 -10.887  -9.317
  254    HB3  GLN  32           2HB      GLN  32  -4.391 -10.842  -9.959
  255    HG2  GLN  32           1HG      GLN  32  -2.112  -8.924 -10.973
  256    HG3  GLN  32           2HG      GLN  32  -2.835 -10.456 -11.519
  257   HE21  GLN  32          2HE2      GLN  32  -2.981  -7.077 -11.650
  258   HE22  GLN  32          1HE2      GLN  32  -4.542  -6.913 -12.382
  259    H    ALA  33           H        ALA  33  -4.022  -8.653  -6.126
  260    HA   ALA  33           HA       ALA  33  -5.353 -11.199  -5.323
  261    HB1  ALA  33           1HB      ALA  33  -4.633 -10.627  -3.037
  262    HB2  ALA  33           2HB      ALA  33  -3.251 -10.707  -4.157
  263    HB3  ALA  33           3HB      ALA  33  -3.895  -9.128  -3.647
  264    H    LYS  34           H        LYS  34  -6.943 -11.048  -3.552
  265    HA   LYS  34           HA       LYS  34  -9.094  -9.284  -4.270
  266    HB2  LYS  34           1HB      LYS  34  -9.302 -11.506  -3.161
  267    HB3  LYS  34           2HB      LYS  34  -8.671 -10.763  -1.670
  268    HG2  LYS  34           1HG      LYS  34 -10.593  -9.263  -1.569
  269    HG3  LYS  34           2HG      LYS  34 -11.209  -9.913  -3.108
  270    HD2  LYS  34           1HD      LYS  34 -11.351 -12.168  -2.031
  271    HD3  LYS  34           2HD      LYS  34 -10.891 -11.411  -0.486
  272    HE2  LYS  34           1HE      LYS  34 -12.868  -9.939  -0.636
  273    HE3  LYS  34           2HE      LYS  34 -13.337 -10.741  -2.152
  274    HZ1  LYS  34           3HZ      LYS  34 -13.113 -12.050   0.482
  275    HZ2  LYS  34           1HZ      LYS  34 -14.523 -11.638  -0.268
  276    HZ3  LYS  34           2HZ      LYS  34 -13.548 -12.795  -0.924
  277    H    ARG  35           H        ARG  35  -9.802  -7.401  -3.553
  278    HA   ARG  35           HA       ARG  35  -7.932  -5.596  -2.355
  279    HB2  ARG  35           1HB      ARG  35 -10.876  -5.385  -2.769
  280    HB3  ARG  35           2HB      ARG  35  -9.863  -4.098  -2.075
  281    HG2  ARG  35           1HG      ARG  35  -8.464  -4.252  -4.200
  282    HG3  ARG  35           2HG      ARG  35  -9.774  -5.254  -4.870
  283    HD2  ARG  35           1HD      ARG  35 -10.013  -2.427  -3.891
  284    HD3  ARG  35           2HD      ARG  35  -9.936  -2.962  -5.586
  285    HE   ARG  35           HE       ARG  35 -12.383  -3.147  -3.888
  286   HH11  ARG  35          1HH1      ARG  35 -10.815  -4.087  -6.858
  287   HH12  ARG  35          2HH1      ARG  35 -12.367  -4.516  -7.549
  288   HH21  ARG  35          1HH2      ARG  35 -14.169  -3.626  -4.669
  289   HH22  ARG  35          2HH2      ARG  35 -14.281  -4.252  -6.302
  290    H    GLU  36           H        GLU  36 -10.637  -7.432  -0.975
  291    HA   GLU  36           HA       GLU  36 -10.516  -6.325   1.654
  292    HB2  GLU  36           1HB      GLU  36 -12.327  -7.752   0.827
  293    HB3  GLU  36           2HB      GLU  36 -11.206  -9.133   0.773
  294    HG2  GLU  36           1HG      GLU  36 -10.967  -8.986   3.298
  295    HG3  GLU  36           2HG      GLU  36 -12.044  -7.575   3.182
  296    H    VAL  37           H        VAL  37  -8.817  -9.133   0.258
  297    HA   VAL  37           HA       VAL  37  -7.372  -9.790   2.683
  298    HB   VAL  37           HB       VAL  37  -6.746 -10.335  -0.248
  299   HG11  VAL  37          1HG1      VAL  37  -5.165 -12.027   0.620
  300   HG12  VAL  37          2HG1      VAL  37  -4.703 -10.391   1.142
  301   HG13  VAL  37          3HG1      VAL  37  -5.508 -11.494   2.283
  302   HG21  VAL  37          3HG2      VAL  37  -8.805 -11.371   0.495
  303   HG22  VAL  37          1HG2      VAL  37  -7.537 -12.593   0.245
  304   HG23  VAL  37          2HG2      VAL  37  -7.965 -12.081   1.896
  305    H    LEU  38           H        LEU  38  -6.561  -7.727  -0.088
  306    HA   LEU  38           HA       LEU  38  -3.936  -7.051   0.881
  307    HB2  LEU  38           1HB      LEU  38  -5.919  -5.715  -0.835
  308    HB3  LEU  38           2HB      LEU  38  -4.295  -5.006  -0.690
  309    HG   LEU  38           HG       LEU  38  -4.913  -7.781  -1.775
  310   HD11  LEU  38          1HD1      LEU  38  -4.273  -6.807  -3.997
  311   HD12  LEU  38          2HD1      LEU  38  -5.690  -5.978  -3.313
  312   HD13  LEU  38          3HD1      LEU  38  -4.087  -5.214  -3.229
  313   HD21  LEU  38          3HD2      LEU  38  -2.737  -7.643  -0.714
  314   HD22  LEU  38          1HD2      LEU  38  -2.546  -7.775  -2.478
  315   HD23  LEU  38          2HD2      LEU  38  -2.328  -6.200  -1.675
  316    H    LEU  39           H        LEU  39  -7.144  -5.714   1.484
  317    HA   LEU  39           HA       LEU  39  -6.208  -3.321   2.797
  318    HB2  LEU  39           1HB      LEU  39  -8.321  -3.593   1.849
  319    HB3  LEU  39           2HB      LEU  39  -8.885  -4.805   3.023
  320    HG   LEU  39           HG       LEU  39  -8.572  -3.104   4.836
  321   HD11  LEU  39          1HD1      LEU  39  -8.376  -0.700   4.146
  322   HD12  LEU  39          2HD1      LEU  39  -6.954  -1.637   3.634
  323   HD13  LEU  39          3HD1      LEU  39  -8.214  -1.216   2.451
  324   HD21  LEU  39          3HD2      LEU  39 -10.771  -3.536   3.906
  325   HD22  LEU  39          1HD2      LEU  39 -10.607  -1.808   4.300
  326   HD23  LEU  39          2HD2      LEU  39 -10.487  -2.352   2.609
  327    H    VAL  40           H        VAL  40  -7.043  -6.560   3.965
  328    HA   VAL  40           HA       VAL  40  -6.673  -6.018   6.776
  329    HB   VAL  40           HB       VAL  40  -6.268  -8.553   5.141
  330   HG11  VAL  40          1HG1      VAL  40  -6.300  -9.727   7.317
  331   HG12  VAL  40          2HG1      VAL  40  -4.920  -8.608   7.212
  332   HG13  VAL  40          3HG1      VAL  40  -6.359  -8.162   8.161
  333   HG21  VAL  40          3HG2      VAL  40  -8.556  -7.755   5.146
  334   HG22  VAL  40          1HG2      VAL  40  -8.400  -9.235   6.122
  335   HG23  VAL  40          2HG2      VAL  40  -8.535  -7.650   6.922
  336    H    THR  41           H        THR  41  -4.368  -7.063   4.277
  337    HA   THR  41           HA       THR  41  -2.093  -7.135   6.020
  338    HB   THR  41           HB       THR  41  -2.249  -6.504   3.042
  339    HG1  THR  41           1HG      THR  41  -1.705  -8.931   4.459
  340   HG21  THR  41          3HG2      THR  41   0.104  -7.342   4.780
  341   HG22  THR  41          1HG2      THR  41   0.135  -7.149   3.013
  342   HG23  THR  41          2HG2      THR  41  -0.134  -5.734   4.058
  343    H    LEU  42           H        LEU  42  -3.489  -4.500   4.085
  344    HA   LEU  42           HA       LEU  42  -1.438  -2.588   4.720
  345    HB2  LEU  42           1HB      LEU  42  -4.282  -2.417   3.991
  346    HB3  LEU  42           2HB      LEU  42  -3.338  -0.913   4.087
  347    HG   LEU  42           HG       LEU  42  -2.733  -3.238   2.219
  348   HD11  LEU  42          1HD1      LEU  42  -3.574  -1.721   0.405
  349   HD12  LEU  42          2HD1      LEU  42  -4.852  -2.085   1.589
  350   HD13  LEU  42          3HD1      LEU  42  -4.012  -0.516   1.638
  351   HD21  LEU  42          3HD2      LEU  42  -0.768  -1.957   2.836
  352   HD22  LEU  42          1HD2      LEU  42  -1.188  -1.643   1.135
  353   HD23  LEU  42          2HD2      LEU  42  -1.580  -0.440   2.388
  354    H    THR  43           H        THR  43  -4.481  -3.446   6.315
  355    HA   THR  43           HA       THR  43  -4.366  -1.345   8.286
  356    HB   THR  43           HB       THR  43  -5.686  -4.090   8.410
  357    HG1  THR  43           1HG      THR  43  -7.558  -2.818   7.872
  358   HG21  THR  43          3HG2      THR  43  -6.108  -1.596  10.105
  359   HG22  THR  43          1HG2      THR  43  -7.064  -3.094  10.202
  360   HG23  THR  43          2HG2      THR  43  -5.341  -3.106  10.651
  361    H    ARG  44           H        ARG  44  -3.178  -4.695   8.271
  362    HA   ARG  44           HA       ARG  44  -2.240  -4.647  10.995
  363    HB2  ARG  44           1HB      ARG  44  -1.552  -6.362   8.662
  364    HB3  ARG  44           2HB      ARG  44  -0.783  -6.519  10.259
  365    HG2  ARG  44           1HG      ARG  44  -2.985  -6.939  11.275
  366    HG3  ARG  44           2HG      ARG  44  -3.746  -6.796   9.672
  367    HD2  ARG  44           1HD      ARG  44  -2.590  -8.741   8.910
  368    HD3  ARG  44           2HD      ARG  44  -1.709  -8.856  10.452
  369    HE   ARG  44           HE       ARG  44  -4.554  -9.136  10.992
  370   HH11  ARG  44          1HH1      ARG  44  -1.963 -10.893   9.456
  371   HH12  ARG  44          2HH1      ARG  44  -2.745 -12.409   9.859
  372   HH21  ARG  44          1HH2      ARG  44  -5.467 -10.862  11.453
  373   HH22  ARG  44          2HH2      ARG  44  -4.744 -12.393  10.996
  374    H    LEU  45           H        LEU  45  -0.718  -3.815   7.906
  375    HA   LEU  45           HA       LEU  45   1.899  -3.338   9.033
  376    HB2  LEU  45           1HB      LEU  45   0.436  -2.414   6.657
  377    HB3  LEU  45           2HB      LEU  45   2.137  -1.930   6.839
  378    HG   LEU  45           HG       LEU  45   1.097  -4.780   6.597
  379   HD11  LEU  45          1HD1      LEU  45   2.287  -4.759   4.389
  380   HD12  LEU  45          2HD1      LEU  45   1.012  -3.518   4.449
  381   HD13  LEU  45          3HD1      LEU  45   2.718  -3.054   4.656
  382   HD21  LEU  45          3HD2      LEU  45   3.051  -4.652   8.028
  383   HD22  LEU  45          1HD2      LEU  45   3.480  -5.417   6.479
  384   HD23  LEU  45          2HD2      LEU  45   3.931  -3.722   6.791
  385    H    HIS  46           H        HIS  46  -0.893  -1.233   8.400
  386    HA   HIS  46           HA       HIS  46   0.503   1.212   8.995
  387    HB2  HIS  46           1HB      HIS  46  -1.583   1.243   7.703
  388    HB3  HIS  46           2HB      HIS  46  -2.476   0.556   9.081
  389    HD1  HIS  46           1HD      HIS  46  -0.276   3.631   8.481
  390    HD2  HIS  46           2HD      HIS  46  -3.874   2.580  10.410
  391    HE1  HIS  46           1HE      HIS  46  -1.108   5.679   9.520
  392    H    GLN  47           H        GLN  47  -1.559  -0.898  10.986
  393    HA   GLN  47           HA       GLN  47  -1.399   0.778  13.330
  394    HB2  GLN  47           1HB      GLN  47  -1.993  -2.157  12.921
  395    HB3  GLN  47           2HB      GLN  47  -2.054  -1.354  14.507
  396    HG2  GLN  47           1HG      GLN  47  -4.010   0.197  13.444
  397    HG3  GLN  47           2HG      GLN  47  -3.526  -0.832  12.076
  398   HE21  GLN  47          2HE2      GLN  47  -6.171  -0.599  13.087
  399   HE22  GLN  47          1HE2      GLN  47  -6.637  -2.139  13.728
  400    H    ARG  48           H        ARG  48   0.648  -1.762  12.028
  401    HA   ARG  48           HA       ARG  48   2.348  -1.945  14.381
  402    HB2  ARG  48           1HB      ARG  48   2.704  -2.777  11.547
  403    HB3  ARG  48           2HB      ARG  48   3.987  -2.908  12.774
  404    HG2  ARG  48           1HG      ARG  48   2.597  -4.383  14.119
  405    HG3  ARG  48           2HG      ARG  48   1.247  -4.195  12.973
  406    HD2  ARG  48           1HD      ARG  48   2.549  -5.289  11.258
  407    HD3  ARG  48           2HD      ARG  48   3.902  -5.473  12.398
  408    HE   ARG  48           HE       ARG  48   1.707  -6.898  13.561
  409   HH11  ARG  48          1HH1      ARG  48   3.507  -7.077  10.580
  410   HH12  ARG  48          2HH1      ARG  48   3.234  -8.806  10.511
  411   HH21  ARG  48          1HH2      ARG  48   1.377  -8.877  13.492
  412   HH22  ARG  48          2HH2      ARG  48   2.019  -9.834  12.170
  413    H    GLY  49           H        GLY  49   2.104   0.251  11.697
  414    HA2  GLY  49           1HA      GLY  49   3.039   2.459  11.864
  415    HA3  GLY  49           2HA      GLY  49   4.328   1.816  12.909
  416    H    VAL  50           H        VAL  50   3.491  -0.067  10.144
  417    HA   VAL  50           HA       VAL  50   6.160   0.421   8.949
  418    HB   VAL  50           HB       VAL  50   3.862  -1.393   8.101
  419   HG11  VAL  50          1HG1      VAL  50   5.558  -2.455   6.647
  420   HG12  VAL  50          2HG1      VAL  50   5.324  -0.744   6.216
  421   HG13  VAL  50          3HG1      VAL  50   6.753  -1.239   7.153
  422   HG21  VAL  50          3HG2      VAL  50   4.784  -2.049  10.242
  423   HG22  VAL  50          1HG2      VAL  50   5.245  -3.209   8.974
  424   HG23  VAL  50          2HG2      VAL  50   6.429  -2.020   9.565
  425    H    ILE  51           H        ILE  51   2.765   0.847   7.967
  426    HA   ILE  51           HA       ILE  51   3.765   2.822   5.931
  427    HB   ILE  51           HB       ILE  51   1.860   2.173   4.498
  428   HG12  ILE  51          1HG1      ILE  51   1.358  -0.012   6.500
  429   HG13  ILE  51          2HG1      ILE  51   0.407   1.482   6.347
  430   HG21  ILE  51          1HG2      ILE  51   2.653  -0.061   3.802
  431   HG22  ILE  51          2HG2      ILE  51   4.019   1.020   4.156
  432   HG23  ILE  51          3HG2      ILE  51   3.542  -0.225   5.333
  433   HD11  ILE  51          3HD1      ILE  51   0.729  -0.648   4.203
  434   HD12  ILE  51          1HD1      ILE  51  -0.710  -0.403   5.219
  435   HD13  ILE  51          2HD1      ILE  51  -0.221   0.847   4.049
  436    H    TYR  52           H        TYR  52   2.072   4.331   5.189
  437    HA   TYR  52           HA       TYR  52   0.498   5.239   7.573
  438    HB2  TYR  52           1HB      TYR  52   2.216   6.971   5.785
  439    HB3  TYR  52           2HB      TYR  52   1.225   7.507   7.164
  440    HD1  TYR  52           1HD      TYR  52   4.298   5.704   6.175
  441    HD2  TYR  52           2HD      TYR  52   2.000   7.209   9.434
  442    HE1  TYR  52           1HE      TYR  52   6.224   5.340   7.689
  443    HE2  TYR  52           2HE      TYR  52   3.912   6.853  10.961
  444    HH   TYR  52           HH       TYR  52   6.063   6.133  11.163
  445    H    ARG  53           H        ARG  53  -1.271   6.560   7.187
  446    HA   ARG  53           HA       ARG  53  -2.469   6.119   4.502
  447    HB2  ARG  53           1HB      ARG  53  -3.624   6.974   7.109
  448    HB3  ARG  53           2HB      ARG  53  -4.502   7.045   5.565
  449    HG2  ARG  53           1HG      ARG  53  -4.360   4.657   5.299
  450    HG3  ARG  53           2HG      ARG  53  -3.282   4.517   6.708
  451    HD2  ARG  53           1HD      ARG  53  -6.101   5.519   6.861
  452    HD3  ARG  53           2HD      ARG  53  -5.640   3.811   7.049
  453    HE   ARG  53           HE       ARG  53  -4.172   5.128   9.072
  454   HH11  ARG  53          1HH1      ARG  53  -7.551   5.120   8.209
  455   HH12  ARG  53          2HH1      ARG  53  -7.986   5.369   9.887
  456   HH21  ARG  53          1HH2      ARG  53  -4.654   5.422  10.998
  457   HH22  ARG  53          2HH2      ARG  53  -6.336   5.543  11.479
  458    H    LYS  54           H        LYS  54  -3.087   7.650   3.110
  459    HA   LYS  54           HA       LYS  54  -2.703  10.503   3.895
  460    HB2  LYS  54           1HB      LYS  54  -0.654   9.719   2.762
  461    HB3  LYS  54           2HB      LYS  54  -1.642   9.247   1.359
  462    HG2  LYS  54           1HG      LYS  54  -2.287  11.581   1.000
  463    HG3  LYS  54           2HG      LYS  54  -1.361  12.073   2.438
  464    HD2  LYS  54           1HD      LYS  54   0.718  11.365   1.398
  465    HD3  LYS  54           2HD      LYS  54  -0.167  10.726  -0.006
  466    HE2  LYS  54           1HE      LYS  54  -0.949  12.974  -0.564
  467    HE3  LYS  54           2HE      LYS  54  -0.120  13.631   0.866
  468    HZ1  LYS  54           3HZ      LYS  54   1.195  12.326  -1.430
  469    HZ2  LYS  54           1HZ      LYS  54   1.170  13.948  -1.135
  470    HZ3  LYS  54           2HZ      LYS  54   1.966  12.935  -0.105
  471    H    TRP  55           H        TRP  55  -4.280  11.779   3.323
  472    HA   TRP  55           HA       TRP  55  -6.309  10.686   1.405
  473    HB2  TRP  55           1HB      TRP  55  -6.527  12.618   3.745
  474    HB3  TRP  55           2HB      TRP  55  -7.810  12.429   2.526
  475    HD1  TRP  55           HD       TRP  55  -9.267  10.452   2.666
  476    HE1  TRP  55           1HE      TRP  55  -9.655   8.476   4.469
  477    HE3  TRP  55           3HE      TRP  55  -5.072  11.163   5.446
  478    HZ2  TRP  55           2HZ      TRP  55  -8.277   7.518   6.663
  479    HZ3  TRP  55           3HZ      TRP  55  -4.625   9.745   7.353
  480    HH2  TRP  55           HH       TRP  55  -6.157   7.937   8.001
  481    H    ARG  56           H        ARG  56  -6.207  11.433  -0.550
  482    HA   ARG  56           HA       ARG  56  -5.157  14.201  -0.977
  483    HB2  ARG  56           1HB      ARG  56  -3.986  12.449  -2.120
  484    HB3  ARG  56           2HB      ARG  56  -5.493  11.973  -2.935
  485    HG2  ARG  56           1HG      ARG  56  -5.600  14.171  -4.028
  486    HG3  ARG  56           2HG      ARG  56  -4.093  14.651  -3.210
  487    HD2  ARG  56           1HD      ARG  56  -2.908  12.895  -4.389
  488    HD3  ARG  56           2HD      ARG  56  -4.415  12.449  -5.222
  489    HE   ARG  56           HE       ARG  56  -3.644  15.239  -5.804
  490   HH11  ARG  56          1HH1      ARG  56  -3.014  11.926  -6.694
  491   HH12  ARG  56          2HH1      ARG  56  -2.524  12.443  -8.295
  492   HH21  ARG  56          1HH2      ARG  56  -3.078  15.848  -7.632
  493   HH22  ARG  56          2HH2      ARG  56  -2.558  14.679  -8.832
  494    H    HIS  57           H        HIS  57  -6.509  15.775  -1.230
  495    HA   HIS  57           HA       HIS  57  -9.319  15.358  -1.831
  496    HB2  HIS  57           1HB      HIS  57  -8.376  17.312  -0.498
  497    HB3  HIS  57           2HB      HIS  57  -7.753  17.962  -2.035
  498    HD1  HIS  57           1HD      HIS  57  -9.542  18.700  -3.817
  499    HD2  HIS  57           2HD      HIS  57 -11.172  17.771  -0.046
  500    HE1  HIS  57           1HE      HIS  57 -11.763  19.717  -3.775
  501    H    PHE  58           H        PHE  58 -10.390  15.288  -3.649
  502    HA   PHE  58           HA       PHE  58  -9.263  16.371  -6.141
  503    HB2  PHE  58           1HB      PHE  58  -8.121  14.161  -5.986
  504    HB3  PHE  58           2HB      PHE  58  -9.706  13.367  -5.855
  505    HD1  PHE  58           1HD      PHE  58  -7.703  15.577  -8.082
  506    HD2  PHE  58           2HD      PHE  58 -10.812  12.667  -7.735
  507    HE1  PHE  58           1HE      PHE  58  -7.828  15.418 -10.547
  508    HE2  PHE  58           2HE      PHE  58 -10.937  12.503 -10.199
  509    HZ   PHE  58           HZ       PHE  58  -9.443  13.881 -11.604
  510    H    SER  59           H        SER  59 -10.847  17.345  -7.093
  511    HA   SER  59           HA       SER  59 -13.017  17.729  -8.009
  512    HB2  SER  59           1HB      SER  59 -13.210  14.787  -7.770
  513    HB3  SER  59           2HB      SER  59 -14.300  15.881  -8.653
  514    HG   SER  59           HG       SER  59 -12.689  14.963  -9.996
  515    H    GLY  60           H        GLY  60 -12.542  17.824  -5.040
  516    HA2  GLY  60           1HA      GLY  60 -14.039  18.630  -3.417
  517    HA3  GLY  60           2HA      GLY  60 -15.401  17.997  -4.371
  518    H    ARG  61           H        ARG  61 -12.996  15.666  -4.109
  519    HA   ARG  61           HA       ARG  61 -14.197  14.472  -1.645
  520    HB2  ARG  61           1HB      ARG  61 -13.938  13.077  -4.270
  521    HB3  ARG  61           2HB      ARG  61 -14.293  12.309  -2.707
  522    HG2  ARG  61           1HG      ARG  61 -16.016  14.449  -3.988
  523    HG3  ARG  61           2HG      ARG  61 -16.301  12.699  -4.161
  524    HD2  ARG  61           1HD      ARG  61 -16.559  12.537  -1.742
  525    HD3  ARG  61           2HD      ARG  61 -16.358  14.299  -1.625
  526    HE   ARG  61           HE       ARG  61 -18.858  12.964  -2.560
  527   HH11  ARG  61          1HH1      ARG  61 -17.082  15.950  -2.253
  528   HH12  ARG  61          2HH1      ARG  61 -18.560  16.861  -2.493
  529   HH21  ARG  61          1HH2      ARG  61 -20.560  13.993  -2.828
  530   HH22  ARG  61          2HH2      ARG  61 -20.544  15.746  -2.821
  531    H    LYS  62           H        LYS  62 -12.789  13.742  -0.270
  532    HA   LYS  62           HA       LYS  62  -9.951  13.509  -1.089
  533    HB2  LYS  62           1HB      LYS  62 -11.364  13.245   1.569
  534    HB3  LYS  62           2HB      LYS  62  -9.613  13.044   1.330
  535    HG2  LYS  62           1HG      LYS  62  -9.432  15.367   0.569
  536    HG3  LYS  62           2HG      LYS  62 -11.189  15.577   0.762
  537    HD2  LYS  62           1HD      LYS  62 -10.986  15.137   3.171
  538    HD3  LYS  62           2HD      LYS  62  -9.231  14.903   2.985
  539    HE2  LYS  62           1HE      LYS  62  -9.004  17.220   2.196
  540    HE3  LYS  62           2HE      LYS  62 -10.756  17.454   2.378
  541    HZ1  LYS  62           3HZ      LYS  62  -8.874  16.838   4.564
  542    HZ2  LYS  62           1HZ      LYS  62  -9.543  18.315   4.263
  543    HZ3  LYS  62           2HZ      LYS  62 -10.500  17.055   4.735
  544    H    TYR  63           H        TYR  63  -8.995  11.744  -1.678
  545    HA   TYR  63           HA       TYR  63 -10.371   9.142  -1.094
  546    HB2  TYR  63           1HB      TYR  63  -8.480   9.911  -3.325
  547    HB3  TYR  63           2HB      TYR  63  -9.166   8.291  -3.053
  548    HD1  TYR  63           2HD      TYR  63 -11.611   7.921  -3.370
  549    HD2  TYR  63           1HD      TYR  63  -9.768  11.627  -4.396
  550    HE1  TYR  63           2HE      TYR  63 -13.594   8.522  -4.720
  551    HE2  TYR  63           1HE      TYR  63 -11.747  12.245  -5.753
  552    HH   TYR  63           HH       TYR  63 -14.567  10.082  -6.063
  553    H    ARG  64           H        ARG  64  -9.286   7.423  -0.311
  554    HA   ARG  64           HA       ARG  64  -6.868   8.200   1.225
  555    HB2  ARG  64           1HB      ARG  64  -8.785   7.219   2.356
  556    HB3  ARG  64           2HB      ARG  64  -8.511   5.718   1.443
  557    HG2  ARG  64           1HG      ARG  64  -6.342   5.427   2.482
  558    HG3  ARG  64           2HG      ARG  64  -6.488   6.998   3.304
  559    HD2  ARG  64           1HD      ARG  64  -6.902   5.342   4.894
  560    HD3  ARG  64           2HD      ARG  64  -8.472   6.075   4.486
  561    HE   ARG  64           HE       ARG  64  -8.158   3.591   2.985
  562   HH11  ARG  64          1HH1      ARG  64  -8.712   4.701   6.244
  563   HH12  ARG  64          2HH1      ARG  64  -9.594   3.230   6.602
  564   HH21  ARG  64          1HH2      ARG  64  -9.159   1.897   3.383
  565   HH22  ARG  64          2HH2      ARG  64  -9.849   1.629   4.971
  566    H    GLU  65           H        GLU  65  -4.889   7.525   0.893
  567    HA   GLU  65           HA       GLU  65  -4.477   4.988  -0.613
  568    HB2  GLU  65           1HB      GLU  65  -2.733   5.941  -1.955
  569    HB3  GLU  65           2HB      GLU  65  -4.269   6.793  -2.248
  570    HG2  GLU  65           1HG      GLU  65  -3.398   8.651  -0.662
  571    HG3  GLU  65           2HG      GLU  65  -1.907   7.681  -0.651
  572    H    TYR  66           H        TYR  66  -2.299   4.135  -0.408
  573    HA   TYR  66           HA       TYR  66  -1.291   4.734   2.355
  574    HB2  TYR  66           1HB      TYR  66  -1.390   2.158   0.777
  575    HB3  TYR  66           2HB      TYR  66  -0.516   2.368   2.313
  576    HD1  TYR  66           1HD      TYR  66  -3.870   2.255   0.748
  577    HD2  TYR  66           2HD      TYR  66  -1.693   2.413   4.411
  578    HE1  TYR  66           1HE      TYR  66  -5.946   1.735   1.995
  579    HE2  TYR  66           2HE      TYR  66  -3.757   1.897   5.671
  580    HH   TYR  66           HH       TYR  66  -5.985   1.451   5.550
  581    H    CYS  67           H        CYS  67   0.837   4.869   2.780
  582    HA   CYS  67           HA       CYS  67   2.866   4.517   0.620
  583    HB2  CYS  67           1HB      CYS  67   3.344   6.938   0.620
  584    HB3  CYS  67           2HB      CYS  67   1.657   6.641   0.131
  585    HG   CYS  67           HG       CYS  67   0.630   7.151   2.428
  586    H    LEU  68           H        LEU  68   5.018   4.967   1.403
  587    HA   LEU  68           HA       LEU  68   5.224   4.825   4.390
  588    HB2  LEU  68           1HB      LEU  68   6.079   3.185   2.485
  589    HB3  LEU  68           2HB      LEU  68   7.605   4.058   2.756
  590    HG   LEU  68           HG       LEU  68   6.078   3.023   5.125
  591   HD11  LEU  68          1HD1      LEU  68   7.282   0.829   4.946
  592   HD12  LEU  68          2HD1      LEU  68   6.188   1.079   3.566
  593   HD13  LEU  68          3HD1      LEU  68   7.938   1.335   3.372
  594   HD21  LEU  68          3HD2      LEU  68   8.015   4.437   5.472
  595   HD22  LEU  68          1HD2      LEU  68   8.354   2.790   6.056
  596   HD23  LEU  68          2HD2      LEU  68   9.027   3.340   4.502
  597    H    LYS  69           H        LYS  69   6.242   6.315   5.494
  598    HA   LYS  69           HA       LYS  69   7.027   8.741   4.021
  599    HB2  LYS  69           1HB      LYS  69   6.830   8.052   6.954
  600    HB3  LYS  69           2HB      LYS  69   7.376   9.629   6.339
  601    HG2  LYS  69           1HG      LYS  69   5.195   9.949   5.234
  602    HG3  LYS  69           2HG      LYS  69   4.650   8.377   5.869
  603    HD2  LYS  69           1HD      LYS  69   4.935   9.199   8.167
  604    HD3  LYS  69           2HD      LYS  69   5.504  10.765   7.542
  605    HE2  LYS  69           1HE      LYS  69   3.331  11.092   6.420
  606    HE3  LYS  69           2HE      LYS  69   2.764   9.543   7.085
  607    HZ1  LYS  69           3HZ      LYS  69   3.569  11.897   8.671
  608    HZ2  LYS  69           1HZ      LYS  69   2.017  11.404   8.406
  609    HZ3  LYS  69           2HZ      LYS  69   3.044  10.460   9.288
  610    H    HIS  70           H        HIS  70   8.584   6.129   5.764
  611    HA   HIS  70           HA       HIS  70  11.195   7.534   5.672
  612    HB2  HIS  70           1HB      HIS  70  10.476   4.761   6.726
  613    HB3  HIS  70           2HB      HIS  70  12.035   5.594   6.928
  614    HD1  HIS  70           1HD      HIS  70  11.958   7.830   8.408
  615    HD2  HIS  70           2HD      HIS  70   8.558   5.363   8.734
  616    HE1  HIS  70           1HE      HIS  70  10.854   8.475  10.492
  617    H    ARG  71           H        ARG  71  12.128   7.626   3.779
  618    HA   ARG  71           HA       ARG  71  11.734   5.679   1.690
  619    HB2  ARG  71           1HB      ARG  71  13.725   7.862   2.053
  620    HB3  ARG  71           2HB      ARG  71  13.721   6.756   0.659
  621    HG2  ARG  71           1HG      ARG  71  11.436   7.484   0.097
  622    HG3  ARG  71           2HG      ARG  71  11.456   8.602   1.481
  623    HD2  ARG  71           1HD      ARG  71  13.225   9.863   0.472
  624    HD3  ARG  71           2HD      ARG  71  13.299   8.715  -0.885
  625    HE   ARG  71           HE       ARG  71  10.653   9.903  -0.863
  626   HH11  ARG  71          1HH1      ARG  71  13.955  10.866  -1.433
  627   HH12  ARG  71          2HH1      ARG  71  13.408  12.101  -2.551
  628   HH21  ARG  71          1HH2      ARG  71  10.011  11.318  -2.135
  629   HH22  ARG  71          2HH2      ARG  71  11.159  12.360  -2.951
  630    H    ASP  72           H        ASP  72  14.134   6.019   4.245
  631    HA   ASP  72           HA       ASP  72  15.972   4.055   3.203
  632    HB2  ASP  72           1HB      ASP  72  15.523   5.058   6.080
  633    HB3  ASP  72           2HB      ASP  72  16.699   3.866   5.470
  634    H    GLU  73           H        GLU  73  13.353   3.820   5.617
  635    HA   GLU  73           HA       GLU  73  13.661   0.964   5.973
  636    HB2  GLU  73           1HB      GLU  73  11.368   2.861   6.486
  637    HB3  GLU  73           2HB      GLU  73  11.352   1.134   6.918
  638    HG2  GLU  73           1HG      GLU  73  13.317   1.543   8.473
  639    HG3  GLU  73           2HG      GLU  73  13.259   3.222   7.887
  640    H    LEU  74           H        LEU  74  11.682   2.960   3.822
  641    HA   LEU  74           HA       LEU  74  10.112   0.834   2.728
  642    HB2  LEU  74           1HB      LEU  74   9.561   3.029   2.460
  643    HB3  LEU  74           2HB      LEU  74  11.013   3.518   1.557
  644    HG   LEU  74           HG       LEU  74  10.322   1.966  -0.282
  645   HD11  LEU  74          1HD1      LEU  74   7.944   1.164  -0.292
  646   HD12  LEU  74          2HD1      LEU  74   8.851   0.481   1.076
  647   HD13  LEU  74          3HD1      LEU  74   7.728   1.835   1.340
  648   HD21  LEU  74          3HD2      LEU  74   9.871   4.343  -0.437
  649   HD22  LEU  74          1HD2      LEU  74   8.537   3.424  -1.173
  650   HD23  LEU  74          2HD2      LEU  74   8.339   4.138   0.445
  651    H    ALA  75           H        ALA  75  13.265   2.153   1.742
  652    HA   ALA  75           HA       ALA  75  13.573   0.401  -0.509
  653    HB1  ALA  75           1HB      ALA  75  15.956   1.017  -0.384
  654    HB2  ALA  75           2HB      ALA  75  14.903   2.444  -0.242
  655    HB3  ALA  75           3HB      ALA  75  15.679   1.759   1.207
  656    H    ASP  76           H        ASP  76  14.475   0.112   2.908
  657    HA   ASP  76           HA       ASP  76  15.913  -2.377   2.599
  658    HB2  ASP  76           1HB      ASP  76  14.597  -1.096   5.068
  659    HB3  ASP  76           2HB      ASP  76  15.472  -2.642   4.937
  660    H    LEU  77           H        LEU  77  12.524  -1.574   3.168
  661    HA   LEU  77           HA       LEU  77  11.709  -4.317   3.654
  662    HB2  LEU  77           1HB      LEU  77  10.387  -1.836   2.803
  663    HB3  LEU  77           2HB      LEU  77   9.379  -3.281   3.042
  664    HG   LEU  77           HG       LEU  77  11.080  -1.938   5.178
  665   HD11  LEU  77          1HD1      LEU  77   8.881  -1.245   6.167
  666   HD12  LEU  77          2HD1      LEU  77   9.103  -0.559   4.541
  667   HD13  LEU  77          3HD1      LEU  77   8.044  -1.970   4.774
  668   HD21  LEU  77          3HD2      LEU  77  10.859  -4.329   5.521
  669   HD22  LEU  77          1HD2      LEU  77   9.902  -3.450   6.737
  670   HD23  LEU  77          2HD2      LEU  77   9.090  -4.219   5.352
  671    H    GLU  78           H        GLU  78  11.989  -2.291   0.770
  672    HA   GLU  78           HA       GLU  78  10.949  -4.216  -1.091
  673    HB2  GLU  78           1HB      GLU  78  11.393  -1.884  -1.658
  674    HB3  GLU  78           2HB      GLU  78  13.136  -2.152  -1.410
  675    HG2  GLU  78           1HG      GLU  78  12.964  -3.914  -3.343
  676    HG3  GLU  78           2HG      GLU  78  11.325  -3.244  -3.511
  677    H    HIS  79           H        HIS  79  14.271  -3.665   0.096
  678    HA   HIS  79           HA       HIS  79  15.550  -5.662  -1.439
  679    HB2  HIS  79           1HB      HIS  79  16.152  -4.736   1.406
  680    HB3  HIS  79           2HB      HIS  79  17.247  -5.708   0.394
  681    HD2  HIS  79           2HD      HIS  79  16.479  -3.514  -2.352
  682    HE1  HIS  79           1HE      HIS  79  18.784  -1.026   0.204
  683    HE2  HIS  79           2HE      HIS  79  17.807  -1.399  -2.207
  Start of MODEL    4
    1    H    LYS   3           H        LYS   3   4.894 -13.601  -9.766
    2    HA   LYS   3           HA       LYS   3   4.749 -11.436  -7.943
    3    HB2  LYS   3           1HB      LYS   3   2.319 -11.804  -9.699
    4    HB3  LYS   3           2HB      LYS   3   2.312 -10.956  -8.136
    5    HG2  LYS   3           1HG      LYS   3   3.912  -9.307  -9.019
    6    HG3  LYS   3           2HG      LYS   3   3.922 -10.155 -10.584
    7    HD2  LYS   3           1HD      LYS   3   1.547  -9.691 -10.889
    8    HD3  LYS   3           2HD      LYS   3   1.470  -8.923  -9.285
    9    HE2  LYS   3           1HE      LYS   3   2.962  -7.161  -9.997
   10    HE3  LYS   3           2HE      LYS   3   3.237  -7.968 -11.556
   11    HZ1  LYS   3           3HZ      LYS   3   0.663  -6.868 -10.626
   12    HZ2  LYS   3           1HZ      LYS   3   1.651  -6.176 -11.751
   13    HZ3  LYS   3           2HZ      LYS   3   0.917  -7.617 -12.073
   14    H    ALA   4           H        ALA   4   3.367 -14.397  -9.223
   15    HA   ALA   4           HA       ALA   4   1.828 -15.064  -6.895
   16    HB1  ALA   4           1HB      ALA   4   1.785 -17.337  -7.847
   17    HB2  ALA   4           2HB      ALA   4   1.428 -16.105  -9.081
   18    HB3  ALA   4           3HB      ALA   4   3.035 -16.867  -9.020
   19    H    LYS   5           H        LYS   5   5.210 -15.392  -7.690
   20    HA   LYS   5           HA       LYS   5   5.840 -17.337  -5.634
   21    HB2  LYS   5           1HB      LYS   5   7.503 -15.287  -7.101
   22    HB3  LYS   5           2HB      LYS   5   8.163 -16.469  -5.946
   23    HG2  LYS   5           1HG      LYS   5   7.388 -18.311  -7.376
   24    HG3  LYS   5           2HG      LYS   5   6.705 -17.138  -8.526
   25    HD2  LYS   5           1HD      LYS   5   8.950 -16.219  -8.932
   26    HD3  LYS   5           2HD      LYS   5   9.638 -17.376  -7.769
   27    HE2  LYS   5           1HE      LYS   5   8.880 -19.245  -9.166
   28    HE3  LYS   5           2HE      LYS   5   8.166 -18.098 -10.324
   29    HZ1  LYS   5           3HZ      LYS   5  11.034 -18.303  -9.663
   30    HZ2  LYS   5           1HZ      LYS   5  10.326 -18.859 -11.044
   31    HZ3  LYS   5           2HZ      LYS   5  10.373 -17.240 -10.736
   32    H    LEU   6           H        LEU   6   5.282 -13.912  -5.634
   33    HA   LEU   6           HA       LEU   6   6.442 -13.660  -2.903
   34    HB2  LEU   6           1HB      LEU   6   5.167 -11.751  -4.752
   35    HB3  LEU   6           2HB      LEU   6   5.926 -11.197  -3.242
   36    HG   LEU   6           HG       LEU   6   7.327 -12.436  -5.642
   37   HD11  LEU   6          1HD1      LEU   6   8.432 -10.191  -5.809
   38   HD12  LEU   6          2HD1      LEU   6   6.665 -10.053  -5.961
   39   HD13  LEU   6          3HD1      LEU   6   7.462  -9.628  -4.428
   40   HD21  LEU   6          3HD2      LEU   6   8.363 -13.163  -3.575
   41   HD22  LEU   6          1HD2      LEU   6   9.424 -12.005  -4.411
   42   HD23  LEU   6          2HD2      LEU   6   8.468 -11.482  -3.003
   43    H    SER   7           H        SER   7   5.306 -12.992  -1.118
   44    HA   SER   7           HA       SER   7   2.479 -13.748  -0.899
   45    HB2  SER   7           1HB      SER   7   2.591 -13.163   1.265
   46    HB3  SER   7           2HB      SER   7   4.127 -13.960   0.857
   47    HG   SER   7           HG       SER   7   4.620 -12.168   2.041
   48    H    LEU   8           H        LEU   8   0.824 -12.251  -0.163
   49    HA   LEU   8           HA       LEU   8   0.596  -9.838  -1.718
   50    HB2  LEU   8           1HB      LEU   8  -0.782 -11.233   0.397
   51    HB3  LEU   8           2HB      LEU   8  -1.258  -9.521   0.308
   52    HG   LEU   8           HG       LEU   8  -2.010  -9.802  -1.985
   53   HD11  LEU   8          1HD1      LEU   8  -2.000 -12.069  -3.060
   54   HD12  LEU   8          2HD1      LEU   8  -0.348 -11.527  -2.682
   55   HD13  LEU   8          3HD1      LEU   8  -1.154 -12.722  -1.640
   56   HD21  LEU   8          3HD2      LEU   8  -3.615 -10.274  -0.232
   57   HD22  LEU   8          1HD2      LEU   8  -3.908 -11.341  -1.626
   58   HD23  LEU   8          2HD2      LEU   8  -3.096 -11.975  -0.174
   59    H    THR   9           H        THR   9   1.886 -10.519   1.463
   60    HA   THR   9           HA       THR   9   2.140  -7.757   2.290
   61    HB   THR   9           HB       THR   9   3.795 -10.206   3.037
   62    HG1  THR   9           1HG      THR   9   2.429 -10.113   4.918
   63   HG21  THR   9          3HG2      THR   9   3.567  -7.473   4.359
   64   HG22  THR   9          1HG2      THR   9   4.473  -8.865   4.997
   65   HG23  THR   9          2HG2      THR   9   4.987  -8.086   3.481
   66    H    GLN  10           H        GLN  10   4.391 -10.002   0.668
   67    HA   GLN  10           HA       GLN  10   6.500  -8.068   0.392
   68    HB2  GLN  10           1HB      GLN  10   5.786 -10.553  -1.173
   69    HB3  GLN  10           2HB      GLN  10   7.258  -9.593  -1.453
   70    HG2  GLN  10           1HG      GLN  10   7.998 -10.244   1.043
   71    HG3  GLN  10           2HG      GLN  10   6.347 -10.899   0.960
   72   HE21  GLN  10          2HE2      GLN  10   9.703 -11.309   0.019
   73   HE22  GLN  10          1HE2      GLN  10   9.560 -12.940  -0.544
   74    H    LEU  11           H        LEU  11   3.745  -8.913  -1.662
   75    HA   LEU  11           HA       LEU  11   4.626  -7.387  -3.941
   76    HB2  LEU  11           1HB      LEU  11   2.053  -8.361  -2.915
   77    HB3  LEU  11           2HB      LEU  11   2.046  -7.507  -4.475
   78    HG   LEU  11           HG       LEU  11   3.571 -10.067  -3.859
   79   HD11  LEU  11          1HD1      LEU  11   1.916 -11.145  -5.405
   80   HD12  LEU  11          2HD1      LEU  11   1.109 -10.430  -3.989
   81   HD13  LEU  11          3HD1      LEU  11   1.067  -9.588  -5.556
   82   HD21  LEU  11          3HD2      LEU  11   4.703  -8.684  -5.498
   83   HD22  LEU  11          1HD2      LEU  11   4.013 -10.121  -6.289
   84   HD23  LEU  11          2HD2      LEU  11   3.208  -8.542  -6.452
   85    H    ILE  12           H        ILE  12   2.433  -6.611  -1.244
   86    HA   ILE  12           HA       ILE  12   1.826  -3.943  -2.200
   87    HB   ILE  12           HB       ILE  12   1.684  -5.227   0.562
   88   HG12  ILE  12          1HG1      ILE  12  -0.512  -4.405  -1.315
   89   HG13  ILE  12          2HG1      ILE  12   0.180  -6.041  -1.233
   90   HG21  ILE  12          1HG2      ILE  12   0.380  -3.242   1.240
   91   HG22  ILE  12          2HG2      ILE  12   2.037  -2.790   0.777
   92   HG23  ILE  12          3HG2      ILE  12   0.690  -2.496  -0.345
   93   HD11  ILE  12          3HD1      ILE  12  -1.215  -4.583   1.040
   94   HD12  ILE  12          1HD1      ILE  12  -1.911  -5.894   0.061
   95   HD13  ILE  12          2HD1      ILE  12  -0.521  -6.220   1.123
   96    H    LEU  13           H        LEU  13   4.265  -5.177   0.060
   97    HA   LEU  13           HA       LEU  13   5.210  -2.566   0.816
   98    HB2  LEU  13           1HB      LEU  13   6.380  -5.264   0.748
   99    HB3  LEU  13           2HB      LEU  13   7.312  -3.951   1.507
  100    HG   LEU  13           HG       LEU  13   4.597  -4.991   2.407
  101   HD11  LEU  13          1HD1      LEU  13   5.856  -5.774   4.432
  102   HD12  LEU  13          2HD1      LEU  13   6.480  -6.534   2.948
  103   HD13  LEU  13          3HD1      LEU  13   7.367  -5.188   3.699
  104   HD21  LEU  13          3HD2      LEU  13   4.809  -2.606   2.789
  105   HD22  LEU  13          1HD2      LEU  13   4.885  -3.478   4.339
  106   HD23  LEU  13          2HD2      LEU  13   6.376  -2.845   3.596
  107    H    ILE  14           H        ILE  14   6.293  -4.872  -1.667
  108    HA   ILE  14           HA       ILE  14   8.449  -3.189  -2.635
  109    HB   ILE  14           HB       ILE  14   6.848  -5.441  -3.926
  110   HG12  ILE  14          1HG1      ILE  14   9.704  -5.387  -2.998
  111   HG13  ILE  14          2HG1      ILE  14   8.338  -5.937  -1.999
  112   HG21  ILE  14          1HG2      ILE  14   8.569  -5.425  -5.700
  113   HG22  ILE  14          2HG2      ILE  14   7.679  -3.886  -5.660
  114   HG23  ILE  14          3HG2      ILE  14   9.314  -3.986  -4.965
  115   HD11  ILE  14          3HD1      ILE  14   9.198  -7.144  -4.651
  116   HD12  ILE  14          1HD1      ILE  14   9.499  -7.842  -3.045
  117   HD13  ILE  14          2HD1      ILE  14   7.832  -7.693  -3.652
  118    H    ARG  15           H        ARG  15   5.032  -3.453  -3.483
  119    HA   ARG  15           HA       ARG  15   5.149  -1.667  -5.729
  120    HB2  ARG  15           1HB      ARG  15   3.304  -3.124  -5.385
  121    HB3  ARG  15           2HB      ARG  15   2.876  -2.265  -3.887
  122    HG2  ARG  15           1HG      ARG  15   1.404  -1.549  -5.672
  123    HG3  ARG  15           2HG      ARG  15   2.484  -0.209  -5.214
  124    HD2  ARG  15           1HD      ARG  15   3.850  -0.622  -7.141
  125    HD3  ARG  15           2HD      ARG  15   2.836  -2.014  -7.585
  126    HE   ARG  15           HE       ARG  15   1.144   0.329  -7.616
  127   HH11  ARG  15          1HH1      ARG  15   3.903  -0.897  -9.361
  128   HH12  ARG  15          2HH1      ARG  15   3.372  -0.056 -10.804
  129   HH21  ARG  15          1HH2      ARG  15   0.528   1.305  -9.259
  130   HH22  ARG  15          2HH2      ARG  15   1.448   1.202 -10.746
  131    H    LEU  16           H        LEU  16   4.727  -1.101  -2.256
  132    HA   LEU  16           HA       LEU  16   4.406   1.798  -2.710
  133    HB2  LEU  16           1HB      LEU  16   4.661   0.073  -0.335
  134    HB3  LEU  16           2HB      LEU  16   4.344   1.813  -0.133
  135    HG   LEU  16           HG       LEU  16   2.511  -0.253  -1.408
  136   HD11  LEU  16          1HD1      LEU  16   0.980   0.363   0.480
  137   HD12  LEU  16          2HD1      LEU  16   2.528  -0.269   1.085
  138   HD13  LEU  16          3HD1      LEU  16   2.216   1.483   1.097
  139   HD21  LEU  16          3HD2      LEU  16   2.390   1.838  -2.628
  140   HD22  LEU  16          1HD2      LEU  16   0.899   1.598  -1.687
  141   HD23  LEU  16          2HD2      LEU  16   2.141   2.741  -1.115
  142    H    SER  17           H        SER  17   6.986  -0.347  -2.507
  143    HA   SER  17           HA       SER  17   8.960   1.701  -1.593
  144    HB2  SER  17           1HB      SER  17   9.309  -1.032  -2.668
  145    HB3  SER  17           2HB      SER  17  10.584   0.078  -2.117
  146    HG   SER  17           HG       SER  17   9.912  -1.382  -0.486
  147    H    ASN  18           H        ASN  18   7.582   0.330  -4.557
  148    HA   ASN  18           HA       ASN  18   9.546   1.809  -6.232
  149    HB2  ASN  18           1HB      ASN  18   7.360  -0.175  -7.213
  150    HB3  ASN  18           2HB      ASN  18   8.527   0.935  -7.969
  151   HD21  ASN  18          2HD2      ASN  18   8.159  -2.071  -7.872
  152   HD22  ASN  18          1HD2      ASN  18   9.730  -2.675  -7.464
  153    H    ARG  19           H        ARG  19   6.440   2.215  -4.883
  154    HA   ARG  19           HA       ARG  19   6.092   4.653  -6.581
  155    HB2  ARG  19           1HB      ARG  19   3.942   2.699  -5.899
  156    HB3  ARG  19           2HB      ARG  19   3.688   4.337  -6.543
  157    HG2  ARG  19           1HG      ARG  19   5.285   2.181  -7.956
  158    HG3  ARG  19           2HG      ARG  19   3.558   2.498  -8.254
  159    HD2  ARG  19           1HD      ARG  19   4.135   4.777  -8.925
  160    HD3  ARG  19           2HD      ARG  19   5.855   4.373  -8.717
  161    HE   ARG  19           HE       ARG  19   4.202   3.485 -11.038
  162   HH11  ARG  19          1HH1      ARG  19   7.200   3.146  -9.290
  163   HH12  ARG  19          2HH1      ARG  19   7.936   2.385 -10.686
  164   HH21  ARG  19          1HH2      ARG  19   5.032   2.622 -12.648
  165   HH22  ARG  19          2HH2      ARG  19   6.702   2.086 -12.603
  166    H    GLY  20           H        GLY  20   5.188   6.419  -5.626
  167    HA2  GLY  20           1HA      GLY  20   5.948   6.858  -2.951
  168    HA3  GLY  20           2HA      GLY  20   4.810   7.873  -3.869
  169    H    CYS  21           H        CYS  21   2.688   6.218  -4.288
  170    HA   CYS  21           HA       CYS  21   1.865   4.787  -1.824
  171    HB2  CYS  21           1HB      CYS  21   0.133   6.487  -1.316
  172    HB3  CYS  21           2HB      CYS  21   1.765   7.191  -1.212
  173    HG   CYS  21           HG       CYS  21  -0.379   7.374  -3.671
  174    H    GLN  22           H        GLN  22  -0.186   3.792  -2.064
  175    HA   GLN  22           HA       GLN  22  -1.485   3.957  -4.728
  176    HB2  GLN  22           1HB      GLN  22  -0.326   1.431  -3.531
  177    HB3  GLN  22           2HB      GLN  22  -1.447   1.486  -4.911
  178    HG2  GLN  22           1HG      GLN  22   1.405   2.790  -5.115
  179    HG3  GLN  22           2HG      GLN  22   0.824   1.121  -5.322
  180   HE21  GLN  22          2HE2      GLN  22   0.396   4.484  -6.424
  181   HE22  GLN  22          1HE2      GLN  22  -0.170   4.083  -8.011
  182    H    THR  23           H        THR  23  -3.569   3.201  -4.827
  183    HA   THR  23           HA       THR  23  -4.953   3.150  -2.224
  184    HB   THR  23           HB       THR  23  -7.002   3.167  -3.514
  185    HG1  THR  23           1HG      THR  23  -6.779   3.076  -5.885
  186   HG21  THR  23          3HG2      THR  23  -4.919   4.936  -4.855
  187   HG22  THR  23          1HG2      THR  23  -6.680   5.188  -4.898
  188   HG23  THR  23          2HG2      THR  23  -5.798   5.319  -3.356
  189    H    LEU  24           H        LEU  24  -6.632   1.555  -1.769
  190    HA   LEU  24           HA       LEU  24  -5.607  -1.116  -1.771
  191    HB2  LEU  24           1HB      LEU  24  -7.088  -0.262  -0.206
  192    HB3  LEU  24           2HB      LEU  24  -8.459  -0.082  -1.323
  193    HG   LEU  24           HG       LEU  24  -8.425  -2.553  -1.687
  194   HD11  LEU  24          1HD1      LEU  24  -7.152  -3.958  -0.042
  195   HD12  LEU  24          2HD1      LEU  24  -6.056  -2.952  -1.019
  196   HD13  LEU  24          3HD1      LEU  24  -6.448  -2.480   0.652
  197   HD21  LEU  24          3HD2      LEU  24  -9.996  -1.563  -0.128
  198   HD22  LEU  24          1HD2      LEU  24  -9.452  -3.145   0.482
  199   HD23  LEU  24          2HD2      LEU  24  -8.794  -1.644   1.182
  200    H    GLU  25           H        GLU  25  -7.752   0.579  -3.990
  201    HA   GLU  25           HA       GLU  25  -8.490  -1.813  -5.473
  202    HB2  GLU  25           1HB      GLU  25  -8.582   1.133  -6.127
  203    HB3  GLU  25           2HB      GLU  25  -9.188  -0.149  -7.204
  204    HG2  GLU  25           1HG      GLU  25 -10.880  -0.797  -5.432
  205    HG3  GLU  25           2HG      GLU  25 -10.111   0.450  -4.424
  206    H    GLU  26           H        GLU  26  -5.987   0.671  -5.826
  207    HA   GLU  26           HA       GLU  26  -4.894  -0.388  -8.280
  208    HB2  GLU  26           1HB      GLU  26  -3.778   1.292  -6.043
  209    HB3  GLU  26           2HB      GLU  26  -2.801   0.785  -7.442
  210    HG2  GLU  26           1HG      GLU  26  -4.444   2.011  -8.961
  211    HG3  GLU  26           2HG      GLU  26  -5.311   2.408  -7.460
  212    H    LEU  27           H        LEU  27  -4.322  -1.104  -4.863
  213    HA   LEU  27           HA       LEU  27  -2.169  -2.979  -5.383
  214    HB2  LEU  27           1HB      LEU  27  -4.087  -2.529  -3.201
  215    HB3  LEU  27           2HB      LEU  27  -2.832  -3.771  -2.982
  216    HG   LEU  27           HG       LEU  27  -2.361  -0.794  -3.409
  217   HD11  LEU  27          1HD1      LEU  27  -1.516  -0.849  -1.047
  218   HD12  LEU  27          2HD1      LEU  27  -3.225  -1.337  -1.134
  219   HD13  LEU  27          3HD1      LEU  27  -1.954  -2.571  -0.947
  220   HD21  LEU  27          3HD2      LEU  27  -0.611  -2.135  -4.417
  221   HD22  LEU  27          1HD2      LEU  27   0.011  -1.319  -2.963
  222   HD23  LEU  27          2HD2      LEU  27  -0.401  -3.051  -2.905
  223    H    GLU  28           H        GLU  28  -5.679  -3.229  -5.219
  224    HA   GLU  28           HA       GLU  28  -5.849  -6.086  -5.387
  225    HB2  GLU  28           1HB      GLU  28  -7.741  -4.603  -4.899
  226    HB3  GLU  28           2HB      GLU  28  -7.657  -3.965  -6.559
  227    HG2  GLU  28           1HG      GLU  28  -8.136  -6.392  -7.366
  228    HG3  GLU  28           2HG      GLU  28  -8.348  -6.715  -5.630
  229    H    GLU  29           H        GLU  29  -5.675  -3.603  -7.939
  230    HA   GLU  29           HA       GLU  29  -5.743  -5.539 -10.094
  231    HB2  GLU  29           1HB      GLU  29  -4.821  -2.668  -9.934
  232    HB3  GLU  29           2HB      GLU  29  -4.860  -3.620 -11.437
  233    HG2  GLU  29           1HG      GLU  29  -7.366  -3.830 -11.222
  234    HG3  GLU  29           2HG      GLU  29  -7.182  -3.001  -9.660
  235    H    PHE  30           H        PHE  30  -3.166  -4.051  -8.207
  236    HA   PHE  30           HA       PHE  30  -1.001  -4.960  -9.889
  237    HB2  PHE  30           1HB      PHE  30  -0.687  -3.157  -8.235
  238    HB3  PHE  30           2HB      PHE  30  -1.045  -4.292  -6.913
  239    HD1  PHE  30           1HD      PHE  30   1.321  -3.672  -9.714
  240    HD2  PHE  30           2HD      PHE  30   0.636  -5.498  -5.912
  241    HE1  PHE  30           1HE      PHE  30   3.721  -4.246  -9.558
  242    HE2  PHE  30           2HE      PHE  30   3.037  -6.071  -5.753
  243    HZ   PHE  30           HZ       PHE  30   4.578  -5.447  -7.578
  244    H    THR  31           H        THR  31  -2.511  -6.334  -6.964
  245    HA   THR  31           HA       THR  31  -0.677  -8.656  -7.125
  246    HB   THR  31           HB       THR  31  -1.682  -9.348  -5.008
  247    HG1  THR  31           1HG      THR  31  -3.407  -7.088  -5.326
  248   HG21  THR  31          3HG2      THR  31  -1.140  -6.353  -5.049
  249   HG22  THR  31          1HG2      THR  31  -1.094  -7.399  -3.610
  250   HG23  THR  31          2HG2      THR  31   0.091  -7.630  -4.918
  251    H    GLN  32           H        GLN  32  -3.791  -7.783  -8.227
  252    HA   GLN  32           HA       GLN  32  -5.659  -9.007  -8.875
  253    HB2  GLN  32           1HB      GLN  32  -3.446 -10.945  -9.582
  254    HB3  GLN  32           2HB      GLN  32  -5.143 -11.118 -10.086
  255    HG2  GLN  32           1HG      GLN  32  -3.332  -8.743 -11.078
  256    HG3  GLN  32           2HG      GLN  32  -3.737 -10.362 -11.697
  257   HE21  GLN  32          2HE2      GLN  32  -4.636  -7.088 -11.540
  258   HE22  GLN  32          1HE2      GLN  32  -6.222  -7.228 -12.220
  259    H    ALA  33           H        ALA  33  -5.687  -9.058  -6.304
  260    HA   ALA  33           HA       ALA  33  -6.291 -11.877  -5.596
  261    HB1  ALA  33           1HB      ALA  33  -5.089 -11.655  -3.456
  262    HB2  ALA  33           2HB      ALA  33  -3.985 -11.510  -4.844
  263    HB3  ALA  33           3HB      ALA  33  -4.496 -10.055  -3.957
  264    H    LYS  34           H        LYS  34  -7.337 -11.993  -3.383
  265    HA   LYS  34           HA       LYS  34  -9.760 -10.526  -3.487
  266    HB2  LYS  34           1HB      LYS  34  -9.403 -12.674  -2.314
  267    HB3  LYS  34           2HB      LYS  34  -8.463 -11.807  -1.077
  268    HG2  LYS  34           1HG      LYS  34 -10.683 -12.173  -0.214
  269    HG3  LYS  34           2HG      LYS  34 -10.495 -10.440  -0.571
  270    HD2  LYS  34           1HD      LYS  34 -11.668 -10.749  -2.711
  271    HD3  LYS  34           2HD      LYS  34 -11.850 -12.486  -2.362
  272    HE2  LYS  34           1HE      LYS  34 -13.179 -11.953  -0.369
  273    HE3  LYS  34           2HE      LYS  34 -12.987 -10.216  -0.699
  274    HZ1  LYS  34           3HZ      LYS  34 -14.354 -12.155  -2.454
  275    HZ2  LYS  34           1HZ      LYS  34 -15.099 -11.043  -1.488
  276    HZ3  LYS  34           2HZ      LYS  34 -14.176 -10.544  -2.762
  277    H    ARG  35           H        ARG  35 -10.346  -8.577  -2.989
  278    HA   ARG  35           HA       ARG  35  -8.465  -6.611  -2.098
  279    HB2  ARG  35           1HB      ARG  35 -10.403  -6.128  -3.465
  280    HB3  ARG  35           2HB      ARG  35 -11.444  -6.432  -2.055
  281    HG2  ARG  35           1HG      ARG  35 -10.271  -4.591  -0.854
  282    HG3  ARG  35           2HG      ARG  35  -9.354  -4.251  -2.342
  283    HD2  ARG  35           1HD      ARG  35 -12.332  -4.069  -2.003
  284    HD3  ARG  35           2HD      ARG  35 -11.181  -2.712  -2.028
  285    HE   ARG  35           HE       ARG  35 -10.881  -3.911  -4.574
  286   HH11  ARG  35          1HH1      ARG  35 -13.636  -2.728  -2.796
  287   HH12  ARG  35          2HH1      ARG  35 -14.429  -2.297  -4.299
  288   HH21  ARG  35          1HH2      ARG  35 -11.778  -3.431  -6.304
  289   HH22  ARG  35          2HH2      ARG  35 -13.370  -2.699  -6.300
  290    H    GLU  36           H        GLU  36 -10.916  -8.481  -0.355
  291    HA   GLU  36           HA       GLU  36 -10.712  -7.041   2.119
  292    HB2  GLU  36           1HB      GLU  36 -11.482  -9.888   1.473
  293    HB3  GLU  36           2HB      GLU  36 -11.578  -9.180   3.104
  294    HG2  GLU  36           1HG      GLU  36 -13.268  -7.503   2.255
  295    HG3  GLU  36           2HG      GLU  36 -12.983  -8.212   0.648
  296    H    VAL  37           H        VAL  37  -8.968  -9.883   0.887
  297    HA   VAL  37           HA       VAL  37  -7.397 -10.298   3.295
  298    HB   VAL  37           HB       VAL  37  -6.878 -11.045   0.386
  299   HG11  VAL  37          1HG1      VAL  37  -5.181 -12.592   1.305
  300   HG12  VAL  37          2HG1      VAL  37  -4.773 -10.901   1.677
  301   HG13  VAL  37          3HG1      VAL  37  -5.474 -11.945   2.936
  302   HG21  VAL  37          3HG2      VAL  37  -8.851 -12.108   1.307
  303   HG22  VAL  37          1HG2      VAL  37  -7.538 -13.289   1.091
  304   HG23  VAL  37          2HG2      VAL  37  -7.915 -12.667   2.714
  305    H    LEU  38           H        LEU  38  -6.851  -8.382   0.365
  306    HA   LEU  38           HA       LEU  38  -4.206  -7.534   1.044
  307    HB2  LEU  38           1HB      LEU  38  -6.449  -6.314  -0.416
  308    HB3  LEU  38           2HB      LEU  38  -4.869  -5.500  -0.452
  309    HG   LEU  38           HG       LEU  38  -5.406  -8.316  -1.471
  310   HD11  LEU  38          1HD1      LEU  38  -5.141  -7.311  -3.753
  311   HD12  LEU  38          2HD1      LEU  38  -6.524  -6.599  -2.891
  312   HD13  LEU  38          3HD1      LEU  38  -4.992  -5.701  -3.012
  313   HD21  LEU  38          3HD2      LEU  38  -3.131  -7.987  -0.698
  314   HD22  LEU  38          1HD2      LEU  38  -3.157  -8.117  -2.472
  315   HD23  LEU  38          2HD2      LEU  38  -2.972  -6.524  -1.698
  316    H    LEU  39           H        LEU  39  -7.383  -6.224   1.919
  317    HA   LEU  39           HA       LEU  39  -6.352  -3.906   3.284
  318    HB2  LEU  39           1HB      LEU  39  -8.527  -4.119   2.506
  319    HB3  LEU  39           2HB      LEU  39  -8.999  -5.423   3.621
  320    HG   LEU  39           HG       LEU  39  -8.548  -3.858   5.531
  321   HD11  LEU  39          1HD1      LEU  39  -8.427  -1.407   5.009
  322   HD12  LEU  39          2HD1      LEU  39  -7.043  -2.285   4.317
  323   HD13  LEU  39          3HD1      LEU  39  -8.399  -1.795   3.273
  324   HD21  LEU  39          3HD2      LEU  39 -10.811  -4.251   4.752
  325   HD22  LEU  39          1HD2      LEU  39 -10.629  -2.554   5.259
  326   HD23  LEU  39          2HD2      LEU  39 -10.642  -2.971   3.527
  327    H    VAL  40           H        VAL  40  -7.119  -7.195   4.371
  328    HA   VAL  40           HA       VAL  40  -6.528  -6.761   7.165
  329    HB   VAL  40           HB       VAL  40  -6.334  -9.248   5.418
  330   HG11  VAL  40          1HG1      VAL  40  -6.223 -10.499   7.546
  331   HG12  VAL  40          2HG1      VAL  40  -4.821  -9.416   7.367
  332   HG13  VAL  40          3HG1      VAL  40  -6.163  -8.965   8.446
  333   HG21  VAL  40          3HG2      VAL  40  -8.586  -8.384   5.641
  334   HG22  VAL  40          1HG2      VAL  40  -8.397  -9.903   6.549
  335   HG23  VAL  40          2HG2      VAL  40  -8.417  -8.346   7.413
  336    H    THR  41           H        THR  41  -4.458  -7.705   4.439
  337    HA   THR  41           HA       THR  41  -2.057  -7.954   5.991
  338    HB   THR  41           HB       THR  41  -2.423  -7.129   3.080
  339    HG1  THR  41           1HG      THR  41  -1.906  -9.373   2.753
  340   HG21  THR  41          3HG2      THR  41   0.030  -8.140   4.572
  341   HG22  THR  41          1HG2      THR  41  -0.070  -7.834   2.822
  342   HG23  THR  41          2HG2      THR  41  -0.211  -6.483   3.973
  343    H    LEU  42           H        LEU  42  -3.519  -5.166   4.337
  344    HA   LEU  42           HA       LEU  42  -1.407  -3.325   4.967
  345    HB2  LEU  42           1HB      LEU  42  -4.293  -3.105   4.462
  346    HB3  LEU  42           2HB      LEU  42  -3.363  -1.601   4.657
  347    HG   LEU  42           HG       LEU  42  -2.839  -3.706   2.524
  348   HD11  LEU  42          1HD1      LEU  42  -3.825  -2.036   0.933
  349   HD12  LEU  42          2HD1      LEU  42  -5.017  -2.552   2.148
  350   HD13  LEU  42          3HD1      LEU  42  -4.208  -0.974   2.307
  351   HD21  LEU  42          3HD2      LEU  42  -0.866  -2.443   3.149
  352   HD22  LEU  42          1HD2      LEU  42  -1.400  -1.969   1.518
  353   HD23  LEU  42          2HD2      LEU  42  -1.735  -0.910   2.910
  354    H    THR  43           H        THR  43  -4.310  -4.310   6.735
  355    HA   THR  43           HA       THR  43  -3.994  -2.374   8.856
  356    HB   THR  43           HB       THR  43  -5.391  -5.082   8.848
  357    HG1  THR  43           1HG      THR  43  -7.256  -3.718   8.568
  358   HG21  THR  43          3HG2      THR  43  -5.602  -2.736  10.776
  359   HG22  THR  43          1HG2      THR  43  -6.596  -4.210  10.819
  360   HG23  THR  43          2HG2      THR  43  -4.847  -4.307  11.131
  361    H    ARG  44           H        ARG  44  -2.935  -5.745   8.475
  362    HA   ARG  44           HA       ARG  44  -1.815  -5.932  11.134
  363    HB2  ARG  44           1HB      ARG  44  -1.401  -7.545   8.665
  364    HB3  ARG  44           2HB      ARG  44  -0.562  -7.852  10.203
  365    HG2  ARG  44           1HG      ARG  44  -2.701  -8.221  11.321
  366    HG3  ARG  44           2HG      ARG  44  -3.571  -7.852   9.812
  367    HD2  ARG  44           1HD      ARG  44  -2.627  -9.798   8.769
  368    HD3  ARG  44           2HD      ARG  44  -1.691 -10.153  10.239
  369    HE   ARG  44           HE       ARG  44  -4.477 -10.243  10.977
  370   HH11  ARG  44          1HH1      ARG  44  -2.326 -11.985   8.857
  371   HH12  ARG  44          2HH1      ARG  44  -3.270 -13.442   9.086
  372   HH21  ARG  44          1HH2      ARG  44  -5.573 -11.902  11.243
  373   HH22  ARG  44          2HH2      ARG  44  -5.124 -13.398  10.446
  374    H    LEU  45           H        LEU  45  -0.520  -4.913   8.009
  375    HA   LEU  45           HA       LEU  45   2.178  -4.515   9.025
  376    HB2  LEU  45           1HB      LEU  45   0.605  -3.521   6.750
  377    HB3  LEU  45           2HB      LEU  45   2.306  -3.017   6.880
  378    HG   LEU  45           HG       LEU  45   1.308  -5.879   6.588
  379   HD11  LEU  45          1HD1      LEU  45   2.363  -5.756   4.316
  380   HD12  LEU  45          2HD1      LEU  45   1.065  -4.551   4.491
  381   HD13  LEU  45          3HD1      LEU  45   2.769  -4.049   4.612
  382   HD21  LEU  45          3HD2      LEU  45   3.340  -5.746   7.903
  383   HD22  LEU  45          1HD2      LEU  45   3.695  -6.450   6.307
  384   HD23  LEU  45          2HD2      LEU  45   4.123  -4.756   6.649
  385    H    HIS  46           H        HIS  46  -0.740  -2.554   8.840
  386    HA   HIS  46           HA       HIS  46   0.483  -0.070   9.620
  387    HB2  HIS  46           1HB      HIS  46  -1.834  -0.265   8.667
  388    HB3  HIS  46           2HB      HIS  46  -2.357  -1.029  10.186
  389    HD1  HIS  46           1HD      HIS  46  -0.704   2.231   9.076
  390    HD2  HIS  46           2HD      HIS  46  -3.434   0.845  11.969
  391    HE1  HIS  46           1HE      HIS  46  -1.398   4.201  10.345
  392    H    GLN  47           H        GLN  47  -0.733  -2.826  11.462
  393    HA   GLN  47           HA       GLN  47  -0.625  -1.593  14.043
  394    HB2  GLN  47           1HB      GLN  47  -0.306  -4.451  13.117
  395    HB3  GLN  47           2HB      GLN  47  -0.308  -3.973  14.831
  396    HG2  GLN  47           1HG      GLN  47  -2.825  -3.080  14.410
  397    HG3  GLN  47           2HG      GLN  47  -2.319  -3.606  12.788
  398   HE21  GLN  47          2HE2      GLN  47  -4.648  -4.530  14.052
  399   HE22  GLN  47          1HE2      GLN  47  -4.460  -6.216  14.398
  400    H    ARG  48           H        ARG  48   1.865  -2.919  11.980
  401    HA   ARG  48           HA       ARG  48   3.852  -2.735  14.191
  402    HB2  ARG  48           1HB      ARG  48   4.101  -3.819  11.421
  403    HB3  ARG  48           2HB      ARG  48   5.413  -3.704  12.618
  404    HG2  ARG  48           1HG      ARG  48   2.854  -5.291  12.989
  405    HG3  ARG  48           2HG      ARG  48   4.411  -5.977  12.463
  406    HD2  ARG  48           1HD      ARG  48   3.854  -4.628  15.086
  407    HD3  ARG  48           2HD      ARG  48   3.985  -6.380  14.799
  408    HE   ARG  48           HE       ARG  48   6.523  -5.269  14.067
  409   HH11  ARG  48          1HH1      ARG  48   4.578  -5.398  16.957
  410   HH12  ARG  48          2HH1      ARG  48   6.029  -5.384  17.941
  411   HH21  ARG  48          1HH2      ARG  48   8.194  -5.244  15.180
  412   HH22  ARG  48          2HH2      ARG  48   8.091  -5.294  16.928
  413    H    GLY  49           H        GLY  49   2.471  -0.646  12.100
  414    HA2  GLY  49           1HA      GLY  49   3.054   1.569  11.695
  415    HA3  GLY  49           2HA      GLY  49   4.583   1.293  12.563
  416    H    VAL  50           H        VAL  50   3.542  -0.730   9.889
  417    HA   VAL  50           HA       VAL  50   5.982   0.072   8.367
  418    HB   VAL  50           HB       VAL  50   3.945  -2.141   7.873
  419   HG11  VAL  50          1HG1      VAL  50   5.634  -2.990   6.280
  420   HG12  VAL  50          2HG1      VAL  50   5.079  -1.364   5.817
  421   HG13  VAL  50          3HG1      VAL  50   6.658  -1.572   6.610
  422   HG21  VAL  50          3HG2      VAL  50   5.177  -2.527   9.922
  423   HG22  VAL  50          1HG2      VAL  50   5.692  -3.661   8.652
  424   HG23  VAL  50          2HG2      VAL  50   6.718  -2.268   9.068
  425    H    ILE  51           H        ILE  51   2.497  -0.326   7.702
  426    HA   ILE  51           HA       ILE  51   2.819   1.839   5.635
  427    HB   ILE  51           HB       ILE  51   0.905  -0.540   5.650
  428   HG12  ILE  51          1HG1      ILE  51   3.102   0.154   3.719
  429   HG13  ILE  51          2HG1      ILE  51   3.232  -1.037   5.034
  430   HG21  ILE  51          1HG2      ILE  51   0.137   0.349   3.475
  431   HG22  ILE  51          2HG2      ILE  51  -0.157   1.517   4.782
  432   HG23  ILE  51          3HG2      ILE  51   1.211   1.753   3.669
  433   HD11  ILE  51          3HD1      ILE  51   1.292  -1.170   2.698
  434   HD12  ILE  51          1HD1      ILE  51   2.773  -2.138   2.879
  435   HD13  ILE  51          2HD1      ILE  51   1.421  -2.361   4.014
  436    H    TYR  52           H        TYR  52   1.646   3.565   5.723
  437    HA   TYR  52           HA       TYR  52  -0.612   3.589   7.702
  438    HB2  TYR  52           1HB      TYR  52  -0.157   5.891   8.122
  439    HB3  TYR  52           2HB      TYR  52   1.330   4.947   8.387
  440    HD1  TYR  52           2HD      TYR  52   3.231   5.170   6.856
  441    HD2  TYR  52           1HD      TYR  52  -0.302   7.490   6.295
  442    HE1  TYR  52           2HE      TYR  52   4.459   6.641   5.295
  443    HE2  TYR  52           1HE      TYR  52   0.914   8.976   4.728
  444    HH   TYR  52           HH       TYR  52   4.354   8.462   3.932
  445    H    ARG  53           H        ARG  53  -2.221   5.333   7.262
  446    HA   ARG  53           HA       ARG  53  -2.828   5.301   4.323
  447    HB2  ARG  53           1HB      ARG  53  -5.077   4.923   4.717
  448    HB3  ARG  53           2HB      ARG  53  -4.122   3.649   5.513
  449    HG2  ARG  53           1HG      ARG  53  -4.415   4.945   7.671
  450    HG3  ARG  53           2HG      ARG  53  -5.591   5.962   6.806
  451    HD2  ARG  53           1HD      ARG  53  -6.955   4.012   6.376
  452    HD3  ARG  53           2HD      ARG  53  -5.779   2.998   7.245
  453    HE   ARG  53           HE       ARG  53  -6.875   5.061   9.029
  454   HH11  ARG  53          1HH1      ARG  53  -7.663   2.000   7.557
  455   HH12  ARG  53          2HH1      ARG  53  -8.734   1.627   8.894
  456   HH21  ARG  53          1HH2      ARG  53  -8.103   4.652  10.563
  457   HH22  ARG  53          2HH2      ARG  53  -8.985   3.137  10.609
  458    H    LYS  54           H        LYS  54  -4.011   6.987   3.458
  459    HA   LYS  54           HA       LYS  54  -4.468   9.368   5.166
  460    HB2  LYS  54           1HB      LYS  54  -3.189  10.826   3.754
  461    HB3  LYS  54           2HB      LYS  54  -2.141   9.568   4.450
  462    HG2  LYS  54           1HG      LYS  54  -2.249   8.328   2.303
  463    HG3  LYS  54           2HG      LYS  54  -3.228   9.644   1.615
  464    HD2  LYS  54           1HD      LYS  54  -1.387  11.227   2.005
  465    HD3  LYS  54           2HD      LYS  54  -0.407   9.918   2.707
  466    HE2  LYS  54           1HE      LYS  54  -0.427   8.721   0.586
  467    HE3  LYS  54           2HE      LYS  54  -1.486   9.960  -0.127
  468    HZ1  LYS  54           3HZ      LYS  54   1.265  10.407   0.844
  469    HZ2  LYS  54           1HZ      LYS  54   0.813  10.294  -0.739
  470    HZ3  LYS  54           2HZ      LYS  54   0.283  11.556   0.181
  471    H    TRP  55           H        TRP  55  -5.582  11.098   4.050
  472    HA   TRP  55           HA       TRP  55  -7.313  10.002   1.855
  473    HB2  TRP  55           1HB      TRP  55  -8.061  11.675   4.285
  474    HB3  TRP  55           2HB      TRP  55  -9.118  11.485   2.868
  475    HD1  TRP  55           HD       TRP  55 -10.361   9.372   2.613
  476    HE1  TRP  55           1HE      TRP  55 -10.835   7.228   4.189
  477    HE3  TRP  55           3HE      TRP  55  -6.775  10.229   6.112
  478    HZ2  TRP  55           2HZ      TRP  55  -9.742   6.220   6.519
  479    HZ3  TRP  55           3HZ      TRP  55  -6.503   8.706   7.969
  480    HH2  TRP  55           HH       TRP  55  -7.926   6.719   8.224
  481    H    ARG  56           H        ARG  56  -7.471  11.104   0.067
  482    HA   ARG  56           HA       ARG  56  -6.805  14.015   0.105
  483    HB2  ARG  56           1HB      ARG  56  -5.596  12.025  -1.761
  484    HB3  ARG  56           2HB      ARG  56  -5.553  13.792  -1.953
  485    HG2  ARG  56           1HG      ARG  56  -4.426  12.322   0.444
  486    HG3  ARG  56           2HG      ARG  56  -3.464  12.773  -0.985
  487    HD2  ARG  56           1HD      ARG  56  -4.038  15.121  -0.565
  488    HD3  ARG  56           2HD      ARG  56  -4.860  14.613   0.929
  489    HE   ARG  56           HE       ARG  56  -1.897  14.787   0.632
  490   HH11  ARG  56          1HH1      ARG  56  -4.570  13.650   2.561
  491   HH12  ARG  56          2HH1      ARG  56  -3.507  13.480   3.944
  492   HH21  ARG  56          1HH2      ARG  56  -0.669  14.604   2.209
  493   HH22  ARG  56          2HH2      ARG  56  -1.282  14.024   3.745
  494    H    HIS  57           H        HIS  57  -7.818  15.276  -1.366
  495    HA   HIS  57           HA       HIS  57 -10.202  14.002  -2.617
  496    HB2  HIS  57           1HB      HIS  57  -9.499  16.925  -2.082
  497    HB3  HIS  57           2HB      HIS  57 -10.991  16.367  -2.875
  498    HD2  HIS  57           2HD      HIS  57  -9.617  16.938   0.758
  499    HE1  HIS  57           1HE      HIS  57 -13.348  14.915   0.963
  500    HE2  HIS  57           2HE      HIS  57 -11.458  16.186   2.276
  501    H    PHE  58           H        PHE  58 -10.190  13.429  -4.627
  502    HA   PHE  58           HA       PHE  58  -8.578  15.077  -6.554
  503    HB2  PHE  58           1HB      PHE  58  -9.242  12.100  -6.659
  504    HB3  PHE  58           2HB      PHE  58  -8.418  13.016  -7.940
  505    HD1  PHE  58           2HD      PHE  58  -6.154  13.836  -7.622
  506    HD2  PHE  58           1HD      PHE  58  -8.112  11.435  -4.681
  507    HE1  PHE  58           2HE      PHE  58  -3.972  13.359  -6.561
  508    HE2  PHE  58           1HE      PHE  58  -5.932  10.958  -3.617
  509    HZ   PHE  58           HZ       PHE  58  -3.863  11.922  -4.557
  510    H    SER  59           H        SER  59  -9.690  16.236  -7.894
  511    HA   SER  59           HA       SER  59 -11.551  17.041  -9.154
  512    HB2  SER  59           1HB      SER  59 -12.308  14.183  -9.208
  513    HB3  SER  59           2HB      SER  59 -12.967  15.513 -10.188
  514    HG   SER  59           HG       SER  59 -11.320  14.346 -11.266
  515    H    GLY  60           H        GLY  60 -11.602  16.682  -6.098
  516    HA2  GLY  60           1HA      GLY  60 -13.180  17.555  -4.594
  517    HA3  GLY  60           2HA      GLY  60 -14.435  17.426  -5.849
  518    H    ARG  61           H        ARG  61 -12.693  14.567  -5.710
  519    HA   ARG  61           HA       ARG  61 -14.788  13.313  -3.964
  520    HB2  ARG  61           1HB      ARG  61 -13.331  12.176  -6.306
  521    HB3  ARG  61           2HB      ARG  61 -14.345  11.251  -5.173
  522    HG2  ARG  61           1HG      ARG  61 -16.299  12.564  -5.811
  523    HG3  ARG  61           2HG      ARG  61 -15.297  13.561  -6.895
  524    HD2  ARG  61           1HD      ARG  61 -14.871  11.653  -8.287
  525    HD3  ARG  61           2HD      ARG  61 -15.806  10.616  -7.184
  526    HE   ARG  61           HE       ARG  61 -17.588  12.661  -8.214
  527   HH11  ARG  61          1HH1      ARG  61 -15.811   9.900  -9.387
  528   HH12  ARG  61          2HH1      ARG  61 -17.029   9.631 -10.619
  529   HH21  ARG  61          1HH2      ARG  61 -18.986  12.373  -9.623
  530   HH22  ARG  61          2HH2      ARG  61 -18.841  11.042 -10.755
  531    H    LYS  62           H        LYS  62 -14.255  12.189  -2.249
  532    HA   LYS  62           HA       LYS  62 -11.454  12.342  -1.374
  533    HB2  LYS  62           1HB      LYS  62 -13.486  12.761   0.066
  534    HB3  LYS  62           2HB      LYS  62 -13.789  11.008  -0.006
  535    HG2  LYS  62           1HG      LYS  62 -11.718  10.533   1.129
  536    HG3  LYS  62           2HG      LYS  62 -11.218  12.238   1.033
  537    HD2  LYS  62           1HD      LYS  62 -11.991  12.043   3.230
  538    HD3  LYS  62           2HD      LYS  62 -13.389  12.722   2.365
  539    HE2  LYS  62           1HE      LYS  62 -14.381  10.499   2.175
  540    HE3  LYS  62           2HE      LYS  62 -12.962   9.780   2.972
  541    HZ1  LYS  62           3HZ      LYS  62 -14.826  11.707   4.204
  542    HZ2  LYS  62           1HZ      LYS  62 -14.785  10.084   4.506
  543    HZ3  LYS  62           2HZ      LYS  62 -13.510  11.039   4.943
  544    H    TYR  63           H        TYR  63  -9.960  10.920  -1.723
  545    HA   TYR  63           HA       TYR  63 -10.771   8.036  -1.884
  546    HB2  TYR  63           1HB      TYR  63  -8.589   9.483  -3.397
  547    HB3  TYR  63           2HB      TYR  63  -8.812   7.717  -3.358
  548    HD1  TYR  63           2HD      TYR  63 -10.762   6.691  -4.478
  549    HD2  TYR  63           1HD      TYR  63 -10.018  10.880  -4.749
  550    HE1  TYR  63           2HE      TYR  63 -12.339   6.838  -6.376
  551    HE2  TYR  63           1HE      TYR  63 -11.595  11.047  -6.653
  552    HH   TYR  63           HH       TYR  63 -13.328   8.195  -7.915
  553    H    ARG  64           H        ARG  64  -9.414   6.511  -1.001
  554    HA   ARG  64           HA       ARG  64  -7.542   7.638   1.051
  555    HB2  ARG  64           1HB      ARG  64  -9.485   6.435   1.893
  556    HB3  ARG  64           2HB      ARG  64  -8.887   4.975   1.072
  557    HG2  ARG  64           1HG      ARG  64  -6.862   5.010   2.433
  558    HG3  ARG  64           2HG      ARG  64  -7.401   6.511   3.225
  559    HD2  ARG  64           1HD      ARG  64  -7.846   4.839   4.743
  560    HD3  ARG  64           2HD      ARG  64  -9.414   5.188   3.979
  561    HE   ARG  64           HE       ARG  64  -7.895   2.620   3.531
  562   HH11  ARG  64          1HH1      ARG  64 -10.814   4.494   3.186
  563   HH12  ARG  64          2HH1      ARG  64 -11.672   3.067   2.638
  564   HH21  ARG  64          1HH2      ARG  64  -8.865   0.975   2.914
  565   HH22  ARG  64          2HH2      ARG  64 -10.563   1.060   2.484
  566    H    GLU  65           H        GLU  65  -5.475   7.213   1.033
  567    HA   GLU  65           HA       GLU  65  -4.507   5.138  -0.911
  568    HB2  GLU  65           1HB      GLU  65  -3.318   7.836  -0.244
  569    HB3  GLU  65           2HB      GLU  65  -2.540   6.585  -1.244
  570    HG2  GLU  65           1HG      GLU  65  -4.446   6.816  -2.922
  571    HG3  GLU  65           2HG      GLU  65  -5.106   8.019  -1.791
  572    H    TYR  66           H        TYR  66  -2.697   3.969  -0.409
  573    HA   TYR  66           HA       TYR  66  -1.830   4.157   2.460
  574    HB2  TYR  66           1HB      TYR  66  -1.878   1.793   0.572
  575    HB3  TYR  66           2HB      TYR  66  -1.183   1.791   2.211
  576    HD1  TYR  66           1HD      TYR  66  -4.323   1.928   0.266
  577    HD2  TYR  66           2HD      TYR  66  -2.608   1.706   4.164
  578    HE1  TYR  66           1HE      TYR  66  -6.543   1.353   1.200
  579    HE2  TYR  66           2HE      TYR  66  -4.816   1.132   5.114
  580    HH   TYR  66           HH       TYR  66  -6.990   0.547   4.630
  581    H    CYS  67           H        CYS  67   0.271   4.172   2.996
  582    HA   CYS  67           HA       CYS  67   2.323   4.241   0.780
  583    HB2  CYS  67           1HB      CYS  67   1.327   6.489   1.112
  584    HB3  CYS  67           2HB      CYS  67   1.696   6.391   2.851
  585    HG   CYS  67           HG       CYS  67   3.191   8.079   1.586
  586    H    LEU  68           H        LEU  68   4.245   3.431   1.403
  587    HA   LEU  68           HA       LEU  68   4.509   2.201   4.031
  588    HB2  LEU  68           1HB      LEU  68   5.372   1.617   1.726
  589    HB3  LEU  68           2HB      LEU  68   6.826   2.573   2.096
  590    HG   LEU  68           HG       LEU  68   5.827   0.423   3.973
  591   HD11  LEU  68          1HD1      LEU  68   7.443  -1.156   2.883
  592   HD12  LEU  68          2HD1      LEU  68   6.171  -0.647   1.748
  593   HD13  LEU  68          3HD1      LEU  68   7.792   0.077   1.649
  594   HD21  LEU  68          3HD2      LEU  68   7.447   2.004   4.845
  595   HD22  LEU  68          1HD2      LEU  68   8.192   0.394   4.688
  596   HD23  LEU  68          2HD2      LEU  68   8.551   1.663   3.491
  597    H    LYS  69           H        LYS  69   5.288   2.955   5.827
  598    HA   LYS  69           HA       LYS  69   6.188   5.716   6.005
  599    HB2  LYS  69           1HB      LYS  69   4.928   4.523   7.772
  600    HB3  LYS  69           2HB      LYS  69   6.346   3.481   8.035
  601    HG2  LYS  69           1HG      LYS  69   7.664   5.347   8.799
  602    HG3  LYS  69           2HG      LYS  69   6.386   6.499   8.342
  603    HD2  LYS  69           1HD      LYS  69   4.892   5.571  10.029
  604    HD3  LYS  69           2HD      LYS  69   6.092   4.322  10.441
  605    HE2  LYS  69           1HE      LYS  69   7.655   6.036  11.199
  606    HE3  LYS  69           2HE      LYS  69   6.509   7.312  10.731
  607    HZ1  LYS  69           3HZ      LYS  69   6.042   5.265  12.803
  608    HZ2  LYS  69           1HZ      LYS  69   6.410   6.847  13.086
  609    HZ3  LYS  69           2HZ      LYS  69   4.978   6.449  12.369
  610    H    HIS  70           H        HIS  70   8.040   6.383   5.270
  611    HA   HIS  70           HA       HIS  70  10.526   5.324   6.301
  612    HB2  HIS  70           1HB      HIS  70  10.024   3.571   4.567
  613    HB3  HIS  70           2HB      HIS  70  10.009   4.852   3.332
  614    HD1  HIS  70           1HD      HIS  70  12.397   3.431   5.950
  615    HD2  HIS  70           2HD      HIS  70  12.518   5.186   2.121
  616    HE1  HIS  70           1HE      HIS  70  14.748   3.436   5.286
  617    H    ARG  71           H        ARG  71  12.167   6.710   6.129
  618    HA   ARG  71           HA       ARG  71  11.609   9.435   5.597
  619    HB2  ARG  71           1HB      ARG  71  13.435   8.568   6.984
  620    HB3  ARG  71           2HB      ARG  71  14.309   8.175   5.486
  621    HG2  ARG  71           1HG      ARG  71  14.296  10.541   4.846
  622    HG3  ARG  71           2HG      ARG  71  13.396  10.944   6.327
  623    HD2  ARG  71           1HD      ARG  71  15.277  10.182   7.659
  624    HD3  ARG  71           2HD      ARG  71  16.177   9.829   6.164
  625    HE   ARG  71           HE       ARG  71  16.562  12.270   5.952
  626   HH11  ARG  71          1HH1      ARG  71  14.306  11.616   8.530
  627   HH12  ARG  71          2HH1      ARG  71  14.493  13.256   9.117
  628   HH21  ARG  71          1HH2      ARG  71  16.780  14.153   6.608
  629   HH22  ARG  71          2HH2      ARG  71  15.904  14.706   8.022
  630    H    ASP  72           H        ASP  72  11.541  10.696   3.905
  631    HA   ASP  72           HA       ASP  72  11.477   9.526   1.272
  632    HB2  ASP  72           1HB      ASP  72  11.499  12.472   2.162
  633    HB3  ASP  72           2HB      ASP  72  11.430  11.792   0.517
  634    H    GLU  73           H        GLU  73  13.944  11.298   3.066
  635    HA   GLU  73           HA       GLU  73  15.740  11.643   0.827
  636    HB2  GLU  73           1HB      GLU  73  16.157  11.541   3.815
  637    HB3  GLU  73           2HB      GLU  73  17.462  11.860   2.646
  638    HG2  GLU  73           1HG      GLU  73  16.245  13.949   1.898
  639    HG3  GLU  73           2HG      GLU  73  14.958  13.451   3.017
  640    H    LEU  74           H        LEU  74  15.353   9.090   3.262
  641    HA   LEU  74           HA       LEU  74  17.575   7.514   2.244
  642    HB2  LEU  74           1HB      LEU  74  15.184   6.972   3.869
  643    HB3  LEU  74           2HB      LEU  74  16.361   5.662   3.621
  644    HG   LEU  74           HG       LEU  74  16.860   8.310   5.036
  645   HD11  LEU  74          1HD1      LEU  74  17.179   6.861   7.059
  646   HD12  LEU  74          2HD1      LEU  74  15.543   6.676   6.383
  647   HD13  LEU  74          3HD1      LEU  74  16.779   5.431   6.079
  648   HD21  LEU  74          3HD2      LEU  74  18.823   7.597   3.804
  649   HD22  LEU  74          1HD2      LEU  74  19.094   7.393   5.551
  650   HD23  LEU  74          2HD2      LEU  74  18.729   5.977   4.536
  651    H    ALA  75           H        ALA  75  14.140   7.733   1.520
  652    HA   ALA  75           HA       ALA  75  14.018   5.403  -0.148
  653    HB1  ALA  75           1HB      ALA  75  11.995   6.452  -1.087
  654    HB2  ALA  75           2HB      ALA  75  12.006   6.530   0.690
  655    HB3  ALA  75           3HB      ALA  75  12.406   7.976  -0.267
  656    H    ASP  76           H        ASP  76  14.950   8.761  -0.763
  657    HA   ASP  76           HA       ASP  76  15.255   8.416  -3.630
  658    HB2  ASP  76           1HB      ASP  76  16.409  10.524  -1.706
  659    HB3  ASP  76           2HB      ASP  76  16.648  10.354  -3.462
  660    H    LEU  77           H        LEU  77  17.371   7.969  -0.846
  661    HA   LEU  77           HA       LEU  77  19.764   7.564  -2.452
  662    HB2  LEU  77           1HB      LEU  77  18.927   6.911   0.290
  663    HB3  LEU  77           2HB      LEU  77  20.595   6.532  -0.199
  664    HG   LEU  77           HG       LEU  77  19.342   9.304  -0.124
  665   HD11  LEU  77          1HD1      LEU  77  20.936   9.703   1.772
  666   HD12  LEU  77          2HD1      LEU  77  19.803   8.384   2.148
  667   HD13  LEU  77          3HD1      LEU  77  21.472   8.012   1.657
  668   HD21  LEU  77          3HD2      LEU  77  20.981   9.093  -1.897
  669   HD22  LEU  77          1HD2      LEU  77  21.628  10.114  -0.590
  670   HD23  LEU  77          2HD2      LEU  77  22.173   8.427  -0.756
  671    H    GLU  78           H        GLU  78  17.286   5.452  -1.075
  672    HA   GLU  78           HA       GLU  78  18.713   3.016  -1.866
  673    HB2  GLU  78           1HB      GLU  78  15.916   3.567  -0.876
  674    HB3  GLU  78           2HB      GLU  78  16.522   1.944  -1.284
  675    HG2  GLU  78           1HG      GLU  78  18.249   2.145   0.546
  676    HG3  GLU  78           2HG      GLU  78  17.653   3.807   0.762
  677    H    HIS  79           H        HIS  79  16.080   4.988  -3.166
  678    HA   HIS  79           HA       HIS  79  15.983   3.133  -5.522
  679    HB2  HIS  79           1HB      HIS  79  13.814   4.998  -4.453
  680    HB3  HIS  79           2HB      HIS  79  13.675   3.930  -5.871
  681    HD2  HIS  79           2HD      HIS  79  13.353   3.708  -1.928
  682    HE1  HIS  79           1HE      HIS  79  12.715  -0.115  -3.665
  683    HE2  HIS  79           2HE      HIS  79  12.606   1.361  -1.494
  Start of MODEL    5
    1    H    LYS   3           H        LYS   3   4.734 -13.245  -9.331
    2    HA   LYS   3           HA       LYS   3   4.974 -11.064  -7.538
    3    HB2  LYS   3           1HB      LYS   3   2.400 -11.141  -9.118
    4    HB3  LYS   3           2HB      LYS   3   2.633 -10.254  -7.592
    5    HG2  LYS   3           1HG      LYS   3   4.440  -8.930  -8.704
    6    HG3  LYS   3           2HG      LYS   3   4.039  -9.744 -10.235
    7    HD2  LYS   3           1HD      LYS   3   2.012  -8.197  -8.597
    8    HD3  LYS   3           2HD      LYS   3   2.995  -7.450  -9.879
    9    HE2  LYS   3           1HE      LYS   3   2.115  -9.159 -11.472
   10    HE3  LYS   3           2HE      LYS   3   1.045  -9.754 -10.183
   11    HZ1  LYS   3           3HZ      LYS   3   1.019  -7.028 -11.311
   12    HZ2  LYS   3           1HZ      LYS   3  -0.084  -8.210 -11.635
   13    HZ3  LYS   3           2HZ      LYS   3   0.026  -7.579 -10.114
   14    H    ALA   4           H        ALA   4   2.929 -13.712  -8.693
   15    HA   ALA   4           HA       ALA   4   1.659 -14.194  -6.166
   16    HB1  ALA   4           1HB      ALA   4   1.031 -16.367  -7.145
   17    HB2  ALA   4           2HB      ALA   4   0.740 -15.030  -8.283
   18    HB3  ALA   4           3HB      ALA   4   2.158 -16.084  -8.492
   19    H    LYS   5           H        LYS   5   4.784 -15.017  -7.430
   20    HA   LYS   5           HA       LYS   5   5.397 -17.151  -5.584
   21    HB2  LYS   5           1HB      LYS   5   7.118 -15.162  -7.064
   22    HB3  LYS   5           2HB      LYS   5   7.764 -16.484  -6.062
   23    HG2  LYS   5           1HG      LYS   5   6.666 -18.132  -7.523
   24    HG3  LYS   5           2HG      LYS   5   6.011 -16.812  -8.522
   25    HD2  LYS   5           1HD      LYS   5   8.302 -16.093  -9.073
   26    HD3  LYS   5           2HD      LYS   5   8.956 -17.412  -8.073
   27    HE2  LYS   5           1HE      LYS   5   7.876 -19.063  -9.525
   28    HE3  LYS   5           2HE      LYS   5   7.188 -17.757 -10.515
   29    HZ1  LYS   5           3HZ      LYS   5  10.064 -18.308 -10.165
   30    HZ2  LYS   5           1HZ      LYS   5   9.175 -18.672 -11.506
   31    HZ3  LYS   5           2HZ      LYS   5   9.427 -17.096 -11.083
   32    H    LEU   6           H        LEU   6   5.385 -13.661  -5.319
   33    HA   LEU   6           HA       LEU   6   6.709 -13.765  -2.676
   34    HB2  LEU   6           1HB      LEU   6   5.383 -11.636  -4.225
   35    HB3  LEU   6           2HB      LEU   6   6.269 -11.250  -2.733
   36    HG   LEU   6           HG       LEU   6   7.448 -12.333  -5.321
   37   HD11  LEU   6          1HD1      LEU   6   8.627 -10.120  -5.390
   38   HD12  LEU   6          2HD1      LEU   6   6.862  -9.911  -5.407
   39   HD13  LEU   6          3HD1      LEU   6   7.776  -9.637  -3.905
   40   HD21  LEU   6          3HD2      LEU   6   8.592 -13.257  -3.393
   41   HD22  LEU   6          1HD2      LEU   6   9.640 -12.072  -4.209
   42   HD23  LEU   6          2HD2      LEU   6   8.802 -11.631  -2.701
   43    H    SER   7           H        SER   7   5.784 -13.110  -0.737
   44    HA   SER   7           HA       SER   7   2.995 -13.848  -0.245
   45    HB2  SER   7           1HB      SER   7   3.332 -13.317   1.908
   46    HB3  SER   7           2HB      SER   7   4.826 -14.085   1.323
   47    HG   SER   7           HG       SER   7   5.391 -12.303   2.512
   48    H    LEU   8           H        LEU   8   1.399 -12.397   0.637
   49    HA   LEU   8           HA       LEU   8   0.971 -10.017  -0.909
   50    HB2  LEU   8           1HB      LEU   8  -0.720 -11.317  -0.014
   51    HB3  LEU   8           2HB      LEU   8  -0.338 -10.982   1.691
   52    HG   LEU   8           HG       LEU   8  -0.827  -8.572   1.284
   53   HD11  LEU   8          1HD1      LEU   8  -2.061  -7.956  -0.813
   54   HD12  LEU   8          2HD1      LEU   8  -0.428  -8.563  -1.178
   55   HD13  LEU   8          3HD1      LEU   8  -1.842  -9.618  -1.410
   56   HD21  LEU   8          3HD2      LEU   8  -2.520 -10.011   2.254
   57   HD22  LEU   8          1HD2      LEU   8  -3.285  -8.807   1.189
   58   HD23  LEU   8          2HD2      LEU   8  -3.084 -10.488   0.635
   59    H    THR   9           H        THR   9   2.253 -10.535   2.356
   60    HA   THR   9           HA       THR   9   2.575  -7.772   3.036
   61    HB   THR   9           HB       THR   9   4.256 -10.186   3.833
   62    HG1  THR   9           1HG      THR   9   2.928 -10.026   5.737
   63   HG21  THR   9          3HG2      THR   9   4.054  -7.409   5.062
   64   HG22  THR   9          1HG2      THR   9   4.974  -8.778   5.730
   65   HG23  THR   9          2HG2      THR   9   5.456  -8.054   4.177
   66    H    GLN  10           H        GLN  10   4.759 -10.034   1.362
   67    HA   GLN  10           HA       GLN  10   6.881  -8.116   1.027
   68    HB2  GLN  10           1HB      GLN  10   6.097 -10.641  -0.429
   69    HB3  GLN  10           2HB      GLN  10   7.517  -9.668  -0.885
   70    HG2  GLN  10           1HG      GLN  10   8.548 -10.221   1.503
   71    HG3  GLN  10           2HG      GLN  10   6.879 -10.805   1.695
   72   HE21  GLN  10          2HE2      GLN  10   9.560 -12.135   1.990
   73   HE22  GLN  10          1HE2      GLN  10   9.475 -13.536   0.974
   74    H    LEU  11           H        LEU  11   4.101  -9.006  -0.988
   75    HA   LEU  11           HA       LEU  11   4.854  -7.420  -3.257
   76    HB2  LEU  11           1HB      LEU  11   2.331  -8.385  -2.111
   77    HB3  LEU  11           2HB      LEU  11   2.248  -7.501  -3.651
   78    HG   LEU  11           HG       LEU  11   3.767 -10.094  -3.163
   79   HD11  LEU  11          1HD1      LEU  11   2.026 -11.112  -4.654
   80   HD12  LEU  11          2HD1      LEU  11   1.294 -10.416  -3.189
   81   HD13  LEU  11          3HD1      LEU  11   1.198  -9.539  -4.735
   82   HD21  LEU  11          3HD2      LEU  11   4.846  -8.694  -4.822
   83   HD22  LEU  11          1HD2      LEU  11   4.099 -10.103  -5.611
   84   HD23  LEU  11          2HD2      LEU  11   3.314  -8.506  -5.705
   85    H    ILE  12           H        ILE  12   2.876  -6.665  -0.401
   86    HA   ILE  12           HA       ILE  12   2.187  -3.991  -1.282
   87    HB   ILE  12           HB       ILE  12   2.289  -5.279   1.480
   88   HG12  ILE  12          1HG1      ILE  12  -0.091  -4.484  -0.166
   89   HG13  ILE  12          2HG1      ILE  12   0.655  -6.099  -0.227
   90   HG21  ILE  12          1HG2      ILE  12   1.010  -3.312   2.255
   91   HG22  ILE  12          2HG2      ILE  12   2.614  -2.835   1.655
   92   HG23  ILE  12          3HG2      ILE  12   1.174  -2.571   0.645
   93   HD11  ILE  12          3HD1      ILE  12  -0.539  -4.782   2.239
   94   HD12  ILE  12          1HD1      ILE  12  -1.293  -6.076   1.281
   95   HD13  ILE  12          2HD1      ILE  12   0.209  -6.395   2.179
   96    H    LEU  13           H        LEU  13   4.725  -5.172   0.918
   97    HA   LEU  13           HA       LEU  13   5.727  -2.533   1.477
   98    HB2  LEU  13           1HB      LEU  13   5.980  -4.675   2.662
   99    HB3  LEU  13           2HB      LEU  13   7.352  -5.120   1.620
  100    HG   LEU  13           HG       LEU  13   7.178  -2.620   3.348
  101   HD11  LEU  13          1HD1      LEU  13   8.940  -3.740   4.739
  102   HD12  LEU  13          2HD1      LEU  13   7.438  -4.694   4.706
  103   HD13  LEU  13          3HD1      LEU  13   8.824  -5.180   3.699
  104   HD21  LEU  13          3HD2      LEU  13   8.502  -2.283   1.344
  105   HD22  LEU  13          1HD2      LEU  13   9.564  -2.335   2.773
  106   HD23  LEU  13          2HD2      LEU  13   9.453  -3.747   1.692
  107    H    ILE  14           H        ILE  14   6.777  -5.038  -0.831
  108    HA   ILE  14           HA       ILE  14   9.044  -3.528  -1.802
  109    HB   ILE  14           HB       ILE  14   7.403  -5.789  -3.024
  110   HG12  ILE  14          1HG1      ILE  14  10.199  -5.799  -1.926
  111   HG13  ILE  14          2HG1      ILE  14   8.750  -6.218  -0.981
  112   HG21  ILE  14          1HG2      ILE  14   9.221  -5.987  -4.686
  113   HG22  ILE  14          2HG2      ILE  14   8.411  -4.410  -4.811
  114   HG23  ILE  14          3HG2      ILE  14   9.997  -4.535  -4.014
  115   HD11  ILE  14          3HD1      ILE  14   9.714  -7.643  -3.485
  116   HD12  ILE  14          1HD1      ILE  14   9.880  -8.240  -1.819
  117   HD13  ILE  14          2HD1      ILE  14   8.265  -8.061  -2.543
  118    H    ARG  15           H        ARG  15   5.687  -3.750  -2.907
  119    HA   ARG  15           HA       ARG  15   6.068  -2.052  -5.204
  120    HB2  ARG  15           1HB      ARG  15   4.192  -3.494  -5.035
  121    HB3  ARG  15           2HB      ARG  15   3.604  -2.603  -3.612
  122    HG2  ARG  15           1HG      ARG  15   2.337  -1.925  -5.561
  123    HG3  ARG  15           2HG      ARG  15   3.363  -0.576  -5.017
  124    HD2  ARG  15           1HD      ARG  15   4.986  -1.209  -6.768
  125    HD3  ARG  15           2HD      ARG  15   3.798  -2.392  -7.362
  126    HE   ARG  15           HE       ARG  15   2.567   0.238  -7.422
  127   HH11  ARG  15          1HH1      ARG  15   5.113  -1.515  -9.033
  128   HH12  ARG  15          2HH1      ARG  15   4.843  -0.580 -10.490
  129   HH21  ARG  15          1HH2      ARG  15   2.251   1.323  -9.079
  130   HH22  ARG  15          2HH2      ARG  15   3.211   1.041 -10.518
  131    H    LEU  16           H        LEU  16   5.342  -1.387  -1.809
  132    HA   LEU  16           HA       LEU  16   4.987   1.492  -2.399
  133    HB2  LEU  16           1HB      LEU  16   4.977  -0.161   0.040
  134    HB3  LEU  16           2HB      LEU  16   4.623   1.579   0.156
  135    HG   LEU  16           HG       LEU  16   2.978  -0.527  -1.302
  136   HD11  LEU  16          1HD1      LEU  16   1.230   0.059   0.401
  137   HD12  LEU  16          2HD1      LEU  16   2.710  -0.552   1.177
  138   HD13  LEU  16          3HD1      LEU  16   2.371   1.195   1.159
  139   HD21  LEU  16          3HD2      LEU  16   2.967   1.568  -2.522
  140   HD22  LEU  16          1HD2      LEU  16   1.382   1.302  -1.759
  141   HD23  LEU  16          2HD2      LEU  16   2.532   2.460  -1.044
  142    H    SER  17           H        SER  17   7.564  -0.582  -1.835
  143    HA   SER  17           HA       SER  17   9.354   1.582  -0.770
  144    HB2  SER  17           1HB      SER  17  11.002   0.034  -0.646
  145    HB3  SER  17           2HB      SER  17   9.527  -0.657   0.066
  146    HG   SER  17           HG       SER  17  10.639  -2.135  -1.287
  147    H    ASN  18           H        ASN  18   8.298   0.078  -3.758
  148    HA   ASN  18           HA       ASN  18  10.576   1.268  -5.268
  149    HB2  ASN  18           1HB      ASN  18   8.390  -0.670  -6.346
  150    HB3  ASN  18           2HB      ASN  18   9.669   0.340  -7.065
  151   HD21  ASN  18          2HD2      ASN  18   9.150  -2.641  -6.779
  152   HD22  ASN  18          1HD2      ASN  18  10.654  -3.272  -6.198
  153    H    ARG  19           H        ARG  19   7.502   2.122  -4.229
  154    HA   ARG  19           HA       ARG  19   7.444   4.296  -6.290
  155    HB2  ARG  19           1HB      ARG  19   5.098   2.748  -5.290
  156    HB3  ARG  19           2HB      ARG  19   5.015   4.287  -6.177
  157    HG2  ARG  19           1HG      ARG  19   6.290   1.749  -7.241
  158    HG3  ARG  19           2HG      ARG  19   4.625   2.270  -7.599
  159    HD2  ARG  19           1HD      ARG  19   5.497   4.289  -8.629
  160    HD3  ARG  19           2HD      ARG  19   7.153   3.728  -8.301
  161    HE   ARG  19           HE       ARG  19   5.430   2.651 -10.493
  162   HH11  ARG  19          1HH1      ARG  19   8.373   2.329  -8.653
  163   HH12  ARG  19          2HH1      ARG  19   9.041   1.284  -9.891
  164   HH21  ARG  19          1HH2      ARG  19   6.181   1.462 -11.924
  165   HH22  ARG  19          2HH2      ARG  19   7.792   0.789 -11.757
  166    H    GLY  20           H        GLY  20   6.678   3.229  -3.012
  167    HA2  GLY  20           1HA      GLY  20   7.223   4.708  -1.160
  168    HA3  GLY  20           2HA      GLY  20   6.810   6.097  -2.190
  169    H    CYS  21           H        CYS  21   4.402   5.395  -3.256
  170    HA   CYS  21           HA       CYS  21   2.526   4.608  -1.057
  171    HB2  CYS  21           1HB      CYS  21   3.181   6.964  -0.648
  172    HB3  CYS  21           2HB      CYS  21   2.719   7.378  -2.318
  173    HG   CYS  21           HG       CYS  21   0.245   6.750  -2.065
  174    H    GLN  22           H        GLN  22   0.820   3.602  -1.922
  175    HA   GLN  22           HA       GLN  22  -0.016   4.339  -4.700
  176    HB2  GLN  22           1HB      GLN  22   0.108   1.569  -3.487
  177    HB3  GLN  22           2HB      GLN  22  -0.620   1.981  -5.057
  178    HG2  GLN  22           1HG      GLN  22   2.466   2.333  -4.562
  179    HG3  GLN  22           2HG      GLN  22   1.461   0.949  -5.059
  180   HE21  GLN  22          2HE2      GLN  22   1.703   4.463  -5.807
  181   HE22  GLN  22          1HE2      GLN  22   1.648   4.268  -7.528
  182    H    THR  23           H        THR  23  -2.240   3.575  -5.210
  183    HA   THR  23           HA       THR  23  -4.045   4.217  -2.965
  184    HB   THR  23           HB       THR  23  -5.828   4.120  -4.610
  185    HG1  THR  23           1HG      THR  23  -4.707   3.664  -6.903
  186   HG21  THR  23          3HG2      THR  23  -3.353   5.428  -5.808
  187   HG22  THR  23          1HG2      THR  23  -5.038   5.797  -6.242
  188   HG23  THR  23          2HG2      THR  23  -4.441   6.164  -4.607
  189    H    LEU  24           H        LEU  24  -5.851   2.921  -2.376
  190    HA   LEU  24           HA       LEU  24  -5.210   0.209  -1.776
  191    HB2  LEU  24           1HB      LEU  24  -6.713   1.410  -0.562
  192    HB3  LEU  24           2HB      LEU  24  -7.888   1.693  -1.868
  193    HG   LEU  24           HG       LEU  24  -8.249  -0.793  -1.976
  194   HD11  LEU  24          1HD1      LEU  24  -7.519  -2.141   0.010
  195   HD12  LEU  24          2HD1      LEU  24  -6.123  -1.477  -0.870
  196   HD13  LEU  24          3HD1      LEU  24  -6.665  -0.716   0.644
  197   HD21  LEU  24          3HD2      LEU  24  -9.824   0.652  -0.832
  198   HD22  LEU  24          1HD2      LEU  24  -9.680  -0.894   0.037
  199   HD23  LEU  24          2HD2      LEU  24  -8.868   0.560   0.666
  200    H    GLU  25           H        GLU  25  -7.078   1.610  -4.448
  201    HA   GLU  25           HA       GLU  25  -7.869  -0.960  -5.531
  202    HB2  GLU  25           1HB      GLU  25  -7.708   1.815  -6.706
  203    HB3  GLU  25           2HB      GLU  25  -8.326   0.397  -7.589
  204    HG2  GLU  25           1HG      GLU  25 -10.169   0.171  -5.855
  205    HG3  GLU  25           2HG      GLU  25  -9.392   1.549  -5.043
  206    H    GLU  26           H        GLU  26  -5.119   1.191  -6.048
  207    HA   GLU  26           HA       GLU  26  -4.040  -0.268  -8.299
  208    HB2  GLU  26           1HB      GLU  26  -3.407   2.030  -7.733
  209    HB3  GLU  26           2HB      GLU  26  -2.671   1.447  -6.221
  210    HG2  GLU  26           1HG      GLU  26  -0.833   1.768  -7.848
  211    HG3  GLU  26           2HG      GLU  26  -1.179   0.049  -7.549
  212    H    LEU  27           H        LEU  27  -3.501  -0.470  -4.791
  213    HA   LEU  27           HA       LEU  27  -1.594  -2.642  -4.993
  214    HB2  LEU  27           1HB      LEU  27  -3.408  -1.629  -2.911
  215    HB3  LEU  27           2HB      LEU  27  -2.284  -2.942  -2.492
  216    HG   LEU  27           HG       LEU  27  -1.513  -0.147  -3.420
  217   HD11  LEU  27          1HD1      LEU  27  -0.637   0.114  -1.083
  218   HD12  LEU  27          2HD1      LEU  27  -2.389  -0.199  -1.085
  219   HD13  LEU  27          3HD1      LEU  27  -1.251  -1.509  -0.688
  220   HD21  LEU  27          3HD2      LEU  27   0.067  -1.819  -4.181
  221   HD22  LEU  27          1HD2      LEU  27   0.799  -0.838  -2.889
  222   HD23  LEU  27          2HD2      LEU  27   0.207  -2.480  -2.534
  223    H    GLU  28           H        GLU  28  -5.109  -2.470  -4.746
  224    HA   GLU  28           HA       GLU  28  -5.590  -5.269  -4.386
  225    HB2  GLU  28           1HB      GLU  28  -7.306  -3.554  -4.137
  226    HB3  GLU  28           2HB      GLU  28  -7.190  -3.180  -5.875
  227    HG2  GLU  28           1HG      GLU  28  -8.001  -5.573  -6.354
  228    HG3  GLU  28           2HG      GLU  28  -8.100  -5.719  -4.585
  229    H    GLU  29           H        GLU  29  -5.273  -3.335  -7.366
  230    HA   GLU  29           HA       GLU  29  -5.627  -5.651  -9.090
  231    HB2  GLU  29           1HB      GLU  29  -4.544  -2.871  -9.553
  232    HB3  GLU  29           2HB      GLU  29  -4.719  -4.096 -10.832
  233    HG2  GLU  29           1HG      GLU  29  -7.219  -4.106 -10.450
  234    HG3  GLU  29           2HG      GLU  29  -6.894  -2.982  -9.110
  235    H    PHE  30           H        PHE  30  -2.854  -3.998  -7.675
  236    HA   PHE  30           HA       PHE  30  -0.834  -5.301  -9.245
  237    HB2  PHE  30           1HB      PHE  30  -0.323  -3.325  -7.875
  238    HB3  PHE  30           2HB      PHE  30  -0.726  -4.223  -6.394
  239    HD1  PHE  30           1HD      PHE  30   1.602  -4.191  -9.291
  240    HD2  PHE  30           2HD      PHE  30   0.885  -5.412  -5.261
  241    HE1  PHE  30           1HE      PHE  30   3.956  -4.922  -9.096
  242    HE2  PHE  30           2HE      PHE  30   3.238  -6.143  -5.061
  243    HZ   PHE  30           HZ       PHE  30   4.774  -5.899  -6.981
  244    H    THR  31           H        THR  31  -2.206  -6.138  -6.054
  245    HA   THR  31           HA       THR  31  -0.631  -8.636  -6.025
  246    HB   THR  31           HB       THR  31  -1.552  -8.985  -3.812
  247    HG1  THR  31           1HG      THR  31  -3.138  -6.645  -4.092
  248   HG21  THR  31          3HG2      THR  31  -0.927  -6.034  -4.228
  249   HG22  THR  31          1HG2      THR  31  -0.858  -6.902  -2.678
  250   HG23  THR  31          2HG2      THR  31   0.273  -7.326  -3.987
  251    H    GLN  32           H        GLN  32  -3.798  -7.596  -6.946
  252    HA   GLN  32           HA       GLN  32  -5.769  -8.744  -7.389
  253    HB2  GLN  32           1HB      GLN  32  -3.803 -10.957  -8.021
  254    HB3  GLN  32           2HB      GLN  32  -5.523 -10.929  -8.479
  255    HG2  GLN  32           1HG      GLN  32  -4.859  -8.736  -9.974
  256    HG3  GLN  32           2HG      GLN  32  -3.316  -9.234  -9.240
  257   HE21  GLN  32          2HE2      GLN  32  -3.430  -8.999 -11.936
  258   HE22  GLN  32          1HE2      GLN  32  -3.418 -10.560 -12.690
  259    H    ALA  33           H        ALA  33  -4.650  -8.839  -4.672
  260    HA   ALA  33           HA       ALA  33  -5.563 -11.458  -3.681
  261    HB1  ALA  33           1HB      ALA  33  -4.990 -10.548  -1.464
  262    HB2  ALA  33           2HB      ALA  33  -3.640 -10.375  -2.611
  263    HB3  ALA  33           3HB      ALA  33  -4.648  -8.967  -2.204
  264    H    LYS  34           H        LYS  34  -7.216 -11.698  -2.084
  265    HA   LYS  34           HA       LYS  34  -9.695 -10.455  -2.730
  266    HB2  LYS  34           1HB      LYS  34  -9.388 -12.613  -1.540
  267    HB3  LYS  34           2HB      LYS  34  -8.869 -11.701  -0.104
  268    HG2  LYS  34           1HG      LYS  34 -11.085 -10.584  -0.045
  269    HG3  LYS  34           2HG      LYS  34 -11.597 -11.574  -1.433
  270    HD2  LYS  34           1HD      LYS  34 -11.147 -13.620  -0.077
  271    HD3  LYS  34           2HD      LYS  34 -10.778 -12.576   1.315
  272    HE2  LYS  34           1HE      LYS  34 -13.074 -11.584   1.076
  273    HE3  LYS  34           2HE      LYS  34 -13.417 -12.820  -0.156
  274    HZ1  LYS  34           3HZ      LYS  34 -12.687 -13.355   2.652
  275    HZ2  LYS  34           1HZ      LYS  34 -14.203 -13.484   2.014
  276    HZ3  LYS  34           2HZ      LYS  34 -13.005 -14.502   1.510
  277    H    ARG  35           H        ARG  35 -10.860  -8.811  -1.952
  278    HA   ARG  35           HA       ARG  35  -9.496  -6.515  -0.975
  279    HB2  ARG  35           1HB      ARG  35 -12.394  -7.210  -0.976
  280    HB3  ARG  35           2HB      ARG  35 -11.738  -5.657  -0.407
  281    HG2  ARG  35           1HG      ARG  35 -10.793  -5.228  -2.623
  282    HG3  ARG  35           2HG      ARG  35 -11.404  -6.797  -3.199
  283    HD2  ARG  35           1HD      ARG  35 -13.677  -6.030  -2.815
  284    HD3  ARG  35           2HD      ARG  35 -13.044  -4.452  -2.292
  285    HE   ARG  35           HE       ARG  35 -12.164  -4.893  -5.016
  286   HH11  ARG  35          1HH1      ARG  35 -15.155  -4.396  -3.292
  287   HH12  ARG  35          2HH1      ARG  35 -15.850  -3.630  -4.707
  288   HH21  ARG  35          1HH2      ARG  35 -12.948  -4.024  -6.646
  289   HH22  ARG  35          2HH2      ARG  35 -14.592  -3.417  -6.621
  290    H    GLU  36           H        GLU  36 -11.443  -8.926   0.783
  291    HA   GLU  36           HA       GLU  36 -11.169  -7.764   3.372
  292    HB2  GLU  36           1HB      GLU  36 -12.711  -9.576   2.858
  293    HB3  GLU  36           2HB      GLU  36 -11.338 -10.666   2.544
  294    HG2  GLU  36           1HG      GLU  36 -10.666 -10.412   5.004
  295    HG3  GLU  36           2HG      GLU  36 -12.098  -9.362   5.123
  296    H    VAL  37           H        VAL  37  -9.164 -10.289   1.820
  297    HA   VAL  37           HA       VAL  37  -7.337 -10.508   4.052
  298    HB   VAL  37           HB       VAL  37  -6.996 -11.202   1.105
  299   HG11  VAL  37          1HG1      VAL  37  -5.088 -12.577   1.869
  300   HG12  VAL  37          2HG1      VAL  37  -4.817 -10.853   2.221
  301   HG13  VAL  37          3HG1      VAL  37  -5.308 -11.962   3.524
  302   HG21  VAL  37          3HG2      VAL  37  -8.774 -12.453   2.176
  303   HG22  VAL  37          1HG2      VAL  37  -7.375 -13.501   1.842
  304   HG23  VAL  37          2HG2      VAL  37  -7.677 -12.918   3.498
  305    H    LEU  38           H        LEU  38  -7.302  -8.507   1.139
  306    HA   LEU  38           HA       LEU  38  -4.654  -7.480   1.506
  307    HB2  LEU  38           1HB      LEU  38  -5.806  -7.316  -0.468
  308    HB3  LEU  38           2HB      LEU  38  -7.123  -6.285   0.136
  309    HG   LEU  38           HG       LEU  38  -5.390  -4.523   0.645
  310   HD11  LEU  38          1HD1      LEU  38  -3.191  -4.724  -0.547
  311   HD12  LEU  38          2HD1      LEU  38  -3.400  -6.025   0.649
  312   HD13  LEU  38          3HD1      LEU  38  -3.649  -6.358  -1.082
  313   HD21  LEU  38          3HD2      LEU  38  -6.814  -4.366  -1.311
  314   HD22  LEU  38          1HD2      LEU  38  -5.185  -3.759  -1.696
  315   HD23  LEU  38          2HD2      LEU  38  -5.687  -5.376  -2.249
  316    H    LEU  39           H        LEU  39  -7.806  -6.275   2.644
  317    HA   LEU  39           HA       LEU  39  -6.686  -3.913   3.875
  318    HB2  LEU  39           1HB      LEU  39  -9.152  -5.482   4.198
  319    HB3  LEU  39           2HB      LEU  39  -8.986  -3.970   5.123
  320    HG   LEU  39           HG       LEU  39  -9.000  -4.224   2.090
  321   HD11  LEU  39          1HD1      LEU  39 -11.190  -3.009   2.250
  322   HD12  LEU  39          2HD1      LEU  39 -11.249  -4.565   3.111
  323   HD13  LEU  39          3HD1      LEU  39 -11.064  -3.049   4.025
  324   HD21  LEU  39          3HD2      LEU  39  -7.566  -2.419   2.841
  325   HD22  LEU  39          1HD2      LEU  39  -9.039  -1.753   2.098
  326   HD23  LEU  39          2HD2      LEU  39  -8.866  -1.773   3.869
  327    H    VAL  40           H        VAL  40  -7.307  -7.191   5.013
  328    HA   VAL  40           HA       VAL  40  -6.744  -6.650   7.815
  329    HB   VAL  40           HB       VAL  40  -6.600  -9.192   6.146
  330   HG11  VAL  40          1HG1      VAL  40  -6.438 -10.381   8.308
  331   HG12  VAL  40          2HG1      VAL  40  -5.037  -9.316   8.056
  332   HG13  VAL  40          3HG1      VAL  40  -6.343  -8.822   9.159
  333   HG21  VAL  40          3HG2      VAL  40  -8.840  -8.305   6.407
  334   HG22  VAL  40          1HG2      VAL  40  -8.637  -9.798   7.353
  335   HG23  VAL  40          2HG2      VAL  40  -8.621  -8.217   8.171
  336    H    THR  41           H        THR  41  -4.709  -7.775   5.126
  337    HA   THR  41           HA       THR  41  -2.320  -7.961   6.735
  338    HB   THR  41           HB       THR  41  -2.646  -7.532   3.734
  339    HG1  THR  41           1HG      THR  41  -3.517  -9.516   4.557
  340   HG21  THR  41          3HG2      THR  41  -0.241  -8.430   5.372
  341   HG22  THR  41          1HG2      THR  41  -0.324  -8.364   3.596
  342   HG23  THR  41          2HG2      THR  41  -0.412  -6.862   4.548
  343    H    LEU  42           H        LEU  42  -3.705  -5.361   4.753
  344    HA   LEU  42           HA       LEU  42  -1.530  -3.519   5.163
  345    HB2  LEU  42           1HB      LEU  42  -4.398  -3.303   4.572
  346    HB3  LEU  42           2HB      LEU  42  -3.453  -1.797   4.631
  347    HG   LEU  42           HG       LEU  42  -2.906  -4.125   2.751
  348   HD11  LEU  42          1HD1      LEU  42  -3.816  -2.620   0.963
  349   HD12  LEU  42          2HD1      LEU  42  -5.050  -2.984   2.191
  350   HD13  LEU  42          3HD1      LEU  42  -4.216  -1.411   2.206
  351   HD21  LEU  42          3HD2      LEU  42  -0.927  -2.834   3.294
  352   HD22  LEU  42          1HD2      LEU  42  -1.408  -2.527   1.608
  353   HD23  LEU  42          2HD2      LEU  42  -1.760  -1.321   2.870
  354    H    THR  43           H        THR  43  -4.473  -4.214   7.002
  355    HA   THR  43           HA       THR  43  -4.083  -2.101   8.935
  356    HB   THR  43           HB       THR  43  -5.546  -4.764   9.181
  357    HG1  THR  43           1HG      THR  43  -7.378  -3.383   8.809
  358   HG21  THR  43          3HG2      THR  43  -5.670  -2.258  10.904
  359   HG22  THR  43          1HG2      THR  43  -6.699  -3.697  11.086
  360   HG23  THR  43          2HG2      THR  43  -4.948  -3.812  11.381
  361    H    ARG  44           H        ARG  44  -3.021  -5.479   8.774
  362    HA   ARG  44           HA       ARG  44  -1.829  -5.498  11.406
  363    HB2  ARG  44           1HB      ARG  44  -1.427  -7.206   9.002
  364    HB3  ARG  44           2HB      ARG  44  -0.515  -7.406  10.516
  365    HG2  ARG  44           1HG      ARG  44  -2.579  -7.824  11.741
  366    HG3  ARG  44           2HG      ARG  44  -3.536  -7.538  10.266
  367    HD2  ARG  44           1HD      ARG  44  -2.569  -9.482   9.238
  368    HD3  ARG  44           2HD      ARG  44  -1.553  -9.755  10.675
  369    HE   ARG  44           HE       ARG  44  -4.309  -9.913  11.531
  370   HH11  ARG  44          1HH1      ARG  44  -2.155 -11.664   9.420
  371   HH12  ARG  44          2HH1      ARG  44  -3.027 -13.147   9.751
  372   HH21  ARG  44          1HH2      ARG  44  -5.323 -11.602  11.913
  373   HH22  ARG  44          2HH2      ARG  44  -4.834 -13.114  11.172
  374    H    LEU  45           H        LEU  45  -0.618  -4.645   8.192
  375    HA   LEU  45           HA       LEU  45   2.088  -4.131   9.159
  376    HB2  LEU  45           1HB      LEU  45   0.527  -3.396   6.775
  377    HB3  LEU  45           2HB      LEU  45   2.241  -2.925   6.855
  378    HG   LEU  45           HG       LEU  45   1.136  -5.759   6.831
  379   HD11  LEU  45          1HD1      LEU  45   2.316  -5.914   4.624
  380   HD12  LEU  45          2HD1      LEU  45   1.080  -4.635   4.608
  381   HD13  LEU  45          3HD1      LEU  45   2.799  -4.209   4.780
  382   HD21  LEU  45          3HD2      LEU  45   3.098  -5.600   8.246
  383   HD22  LEU  45          1HD2      LEU  45   3.500  -6.474   6.748
  384   HD23  LEU  45          2HD2      LEU  45   4.000  -4.777   6.951
  385    H    HIS  46           H        HIS  46  -0.890  -2.345   9.044
  386    HA   HIS  46           HA       HIS  46   0.328   0.239   9.608
  387    HB2  HIS  46           1HB      HIS  46  -2.015  -0.043   8.712
  388    HB3  HIS  46           2HB      HIS  46  -2.485  -0.725  10.287
  389    HD2  HIS  46           2HD      HIS  46  -3.344   1.224  12.136
  390    HE1  HIS  46           1HE      HIS  46  -1.720   4.526  10.013
  391    HE2  HIS  46           2HE      HIS  46  -3.164   3.717  12.055
  392    H    GLN  47           H        GLN  47  -0.970  -2.403  11.593
  393    HA   GLN  47           HA       GLN  47  -0.442  -1.037  14.103
  394    HB2  GLN  47           1HB      GLN  47  -0.882  -3.937  13.374
  395    HB3  GLN  47           2HB      GLN  47  -0.660  -3.355  15.042
  396    HG2  GLN  47           1HG      GLN  47  -2.925  -1.917  14.653
  397    HG3  GLN  47           2HG      GLN  47  -2.667  -2.691  13.072
  398   HE21  GLN  47          2HE2      GLN  47  -5.056  -2.936  14.502
  399   HE22  GLN  47          1HE2      GLN  47  -5.234  -4.578  15.024
  400    H    ARG  48           H        ARG  48   1.417  -3.105  11.966
  401    HA   ARG  48           HA       ARG  48   3.577  -3.539  13.875
  402    HB2  ARG  48           1HB      ARG  48   3.359  -3.935  10.933
  403    HB3  ARG  48           2HB      ARG  48   4.863  -4.179  11.850
  404    HG2  ARG  48           1HG      ARG  48   3.831  -5.917  13.178
  405    HG3  ARG  48           2HG      ARG  48   2.251  -5.609  12.421
  406    HD2  ARG  48           1HD      ARG  48   3.142  -6.347  10.289
  407    HD3  ARG  48           2HD      ARG  48   4.707  -6.680  11.067
  408    HE   ARG  48           HE       ARG  48   2.825  -8.347  12.420
  409   HH11  ARG  48          1HH1      ARG  48   3.841  -7.947   9.108
  410   HH12  ARG  48          2HH1      ARG  48   3.519  -9.643   8.800
  411   HH21  ARG  48          1HH2      ARG  48   2.445 -10.288  12.080
  412   HH22  ARG  48          2HH2      ARG  48   2.723 -10.978  10.493
  413    H    GLY  49           H        GLY  49   2.677  -0.979  11.720
  414    HA2  GLY  49           1HA      GLY  49   3.559   1.202  11.788
  415    HA3  GLY  49           2HA      GLY  49   4.942   0.606  12.735
  416    H    VAL  50           H        VAL  50   3.890  -0.974   9.786
  417    HA   VAL  50           HA       VAL  50   6.416  -0.049   8.425
  418    HB   VAL  50           HB       VAL  50   4.672  -2.494   7.901
  419   HG11  VAL  50          1HG1      VAL  50   6.483  -3.139   6.346
  420   HG12  VAL  50          2HG1      VAL  50   5.742  -1.596   5.861
  421   HG13  VAL  50          3HG1      VAL  50   7.320  -1.606   6.686
  422   HG21  VAL  50          3HG2      VAL  50   5.901  -2.717   9.977
  423   HG22  VAL  50          1HG2      VAL  50   6.574  -3.787   8.725
  424   HG23  VAL  50          2HG2      VAL  50   7.414  -2.276   9.150
  425    H    ILE  51           H        ILE  51   2.999  -0.802   7.726
  426    HA   ILE  51           HA       ILE  51   3.181   1.205   5.492
  427    HB   ILE  51           HB       ILE  51   1.317  -1.200   5.741
  428   HG12  ILE  51          1HG1      ILE  51   3.540  -1.954   5.348
  429   HG13  ILE  51          2HG1      ILE  51   2.541  -2.155   3.890
  430   HG21  ILE  51          1HG2      ILE  51   0.695  -0.625   3.418
  431   HG22  ILE  51          2HG2      ILE  51   0.342   0.721   4.528
  432   HG23  ILE  51          3HG2      ILE  51   1.777   0.787   3.478
  433   HD11  ILE  51          3HD1      ILE  51   4.570   0.057   4.363
  434   HD12  ILE  51          1HD1      ILE  51   4.800  -1.361   3.316
  435   HD13  ILE  51          2HD1      ILE  51   3.569  -0.144   2.906
  436    H    TYR  52           H        TYR  52   2.174   2.985   5.718
  437    HA   TYR  52           HA       TYR  52  -0.022   3.095   7.758
  438    HB2  TYR  52           1HB      TYR  52   1.866   5.215   6.715
  439    HB3  TYR  52           2HB      TYR  52   0.480   5.531   7.788
  440    HD1  TYR  52           2HD      TYR  52   0.526   4.782  10.129
  441    HD2  TYR  52           1HD      TYR  52   3.884   4.175   7.571
  442    HE1  TYR  52           2HE      TYR  52   1.930   4.299  12.104
  443    HE2  TYR  52           1HE      TYR  52   5.305   3.688   9.541
  444    HH   TYR  52           HH       TYR  52   5.387   3.456  11.799
  445    H    ARG  53           H        ARG  53  -1.637   4.849   7.369
  446    HA   ARG  53           HA       ARG  53  -2.481   4.699   4.492
  447    HB2  ARG  53           1HB      ARG  53  -4.692   4.246   5.085
  448    HB3  ARG  53           2HB      ARG  53  -3.609   2.995   5.740
  449    HG2  ARG  53           1HG      ARG  53  -3.784   3.988   7.969
  450    HG3  ARG  53           2HG      ARG  53  -4.828   5.278   7.325
  451    HD2  ARG  53           1HD      ARG  53  -6.512   3.641   6.767
  452    HD3  ARG  53           2HD      ARG  53  -5.468   2.346   7.397
  453    HE   ARG  53           HE       ARG  53  -6.173   3.038   9.661
  454   HH11  ARG  53          1HH1      ARG  53  -7.161   5.441   7.334
  455   HH12  ARG  53          2HH1      ARG  53  -8.175   6.202   8.543
  456   HH21  ARG  53          1HH2      ARG  53  -7.326   3.904  11.058
  457   HH22  ARG  53          2HH2      ARG  53  -8.271   5.327  10.667
  458    H    LYS  54           H        LYS  54  -3.823   6.311   3.715
  459    HA   LYS  54           HA       LYS  54  -4.556   8.562   5.457
  460    HB2  LYS  54           1HB      LYS  54  -3.352  10.240   4.271
  461    HB3  LYS  54           2HB      LYS  54  -2.204   9.039   4.909
  462    HG2  LYS  54           1HG      LYS  54  -2.020   8.019   2.681
  463    HG3  LYS  54           2HG      LYS  54  -3.183   9.202   2.038
  464    HD2  LYS  54           1HD      LYS  54  -1.638  11.033   2.636
  465    HD3  LYS  54           2HD      LYS  54  -0.472   9.838   3.251
  466    HE2  LYS  54           1HE      LYS  54  -0.287   8.844   1.026
  467    HE3  LYS  54           2HE      LYS  54  -1.494   9.989   0.398
  468    HZ1  LYS  54           3HZ      LYS  54   1.145  10.713   1.499
  469    HZ2  LYS  54           1HZ      LYS  54   0.747  10.695  -0.101
  470    HZ3  LYS  54           2HZ      LYS  54   0.027  11.776   0.918
  471    H    TRP  55           H        TRP  55  -5.843  10.166   4.398
  472    HA   TRP  55           HA       TRP  55  -7.210   9.047   1.968
  473    HB2  TRP  55           1HB      TRP  55  -8.321  10.617   4.331
  474    HB3  TRP  55           2HB      TRP  55  -9.217  10.347   2.818
  475    HD1  TRP  55           HD       TRP  55  -7.837   8.565   5.780
  476    HE1  TRP  55           1HE      TRP  55  -9.139   6.218   6.093
  477    HE3  TRP  55           3HE      TRP  55 -10.563   8.662   1.491
  478    HZ2  TRP  55           2HZ      TRP  55 -11.006   4.795   4.636
  479    HZ3  TRP  55           3HZ      TRP  55 -12.070   6.844   0.969
  480    HH2  TRP  55           HH       TRP  55 -12.334   4.919   2.473
  481    H    ARG  56           H        ARG  56  -6.750  10.087   0.203
  482    HA   ARG  56           HA       ARG  56  -6.250  13.022   0.314
  483    HB2  ARG  56           1HB      ARG  56  -4.692  11.703  -0.927
  484    HB3  ARG  56           2HB      ARG  56  -6.008  11.106  -1.964
  485    HG2  ARG  56           1HG      ARG  56  -6.411  13.363  -2.796
  486    HG3  ARG  56           2HG      ARG  56  -5.155  14.007  -1.711
  487    HD2  ARG  56           1HD      ARG  56  -3.490  12.682  -2.905
  488    HD3  ARG  56           2HD      ARG  56  -4.763  12.131  -4.021
  489    HE   ARG  56           HE       ARG  56  -4.634  15.023  -4.181
  490   HH11  ARG  56          1HH1      ARG  56  -2.644  12.269  -4.967
  491   HH12  ARG  56          2HH1      ARG  56  -1.915  13.164  -6.283
  492   HH21  ARG  56          1HH2      ARG  56  -3.803  16.064  -5.681
  493   HH22  ARG  56          2HH2      ARG  56  -2.573  15.329  -6.692
  494    H    HIS  57           H        HIS  57  -7.493  14.546  -0.572
  495    HA   HIS  57           HA       HIS  57 -10.167  13.628  -1.578
  496    HB2  HIS  57           1HB      HIS  57  -9.565  16.068   0.156
  497    HB3  HIS  57           2HB      HIS  57 -11.161  15.591  -0.470
  498    HD2  HIS  57           2HD      HIS  57  -8.848  14.838   2.622
  499    HE1  HIS  57           1HE      HIS  57 -12.200  12.229   2.686
  500    HE2  HIS  57           2HE      HIS  57 -10.115  13.166   3.984
  501    H    PHE  58           H        PHE  58 -10.654  14.194  -3.531
  502    HA   PHE  58           HA       PHE  58  -9.780  16.809  -4.599
  503    HB2  PHE  58           1HB      PHE  58  -7.859  15.330  -5.139
  504    HB3  PHE  58           2HB      PHE  58  -8.966  14.190  -5.935
  505    HD1  PHE  58           1HD      PHE  58  -7.774  17.712  -6.058
  506    HD2  PHE  58           2HD      PHE  58  -9.449  14.397  -8.170
  507    HE1  PHE  58           1HE      PHE  58  -7.494  18.930  -8.191
  508    HE2  PHE  58           2HE      PHE  58  -9.167  15.611 -10.305
  509    HZ   PHE  58           HZ       PHE  58  -8.191  17.879 -10.314
  510    H    SER  59           H        SER  59 -11.350  17.709  -5.648
  511    HA   SER  59           HA       SER  59 -13.313  17.944  -6.988
  512    HB2  SER  59           1HB      SER  59 -12.612  15.208  -7.865
  513    HB3  SER  59           2HB      SER  59 -13.834  16.294  -8.566
  514    HG   SER  59           HG       SER  59 -11.822  16.403  -9.653
  515    H    GLY  60           H        GLY  60 -13.249  16.658  -4.169
  516    HA2  GLY  60           1HA      GLY  60 -15.034  16.175  -2.736
  517    HA3  GLY  60           2HA      GLY  60 -16.107  16.019  -4.147
  518    H    ARG  61           H        ARG  61 -13.325  14.255  -4.705
  519    HA   ARG  61           HA       ARG  61 -14.751  11.725  -4.004
  520    HB2  ARG  61           1HB      ARG  61 -12.530  12.233  -5.932
  521    HB3  ARG  61           2HB      ARG  61 -13.209  10.641  -5.518
  522    HG2  ARG  61           1HG      ARG  61 -15.414  11.390  -6.358
  523    HG3  ARG  61           2HG      ARG  61 -14.686  12.945  -6.828
  524    HD2  ARG  61           1HD      ARG  61 -13.191  11.733  -8.342
  525    HD3  ARG  61           2HD      ARG  61 -14.046  10.229  -7.928
  526    HE   ARG  61           HE       ARG  61 -15.978  12.093  -9.035
  527   HH11  ARG  61          1HH1      ARG  61 -13.213  10.240 -10.076
  528   HH12  ARG  61          2HH1      ARG  61 -13.889  10.126 -11.688
  529   HH21  ARG  61          1HH2      ARG  61 -16.761  11.979 -10.879
  530   HH22  ARG  61          2HH2      ARG  61 -15.911  11.119 -12.148
  531    H    LYS  62           H        LYS  62 -13.846  10.088  -2.874
  532    HA   LYS  62           HA       LYS  62 -11.551  10.918  -1.151
  533    HB2  LYS  62           1HB      LYS  62 -13.650   8.765  -0.871
  534    HB3  LYS  62           2HB      LYS  62 -12.276   8.984   0.238
  535    HG2  LYS  62           1HG      LYS  62 -13.101  11.214   0.840
  536    HG3  LYS  62           2HG      LYS  62 -14.460  11.027  -0.293
  537    HD2  LYS  62           1HD      LYS  62 -15.270   9.092   1.000
  538    HD3  LYS  62           2HD      LYS  62 -13.916   9.290   2.138
  539    HE2  LYS  62           1HE      LYS  62 -14.731  11.519   2.744
  540    HE3  LYS  62           2HE      LYS  62 -16.067  11.356   1.582
  541    HZ1  LYS  62           3HZ      LYS  62 -15.643   9.658   3.956
  542    HZ2  LYS  62           1HZ      LYS  62 -16.771  10.854   3.822
  543    HZ3  LYS  62           2HZ      LYS  62 -16.883   9.505   2.879
  544    H    TYR  63           H        TYR  63  -9.631  10.083  -1.307
  545    HA   TYR  63           HA       TYR  63  -9.328   7.547  -2.888
  546    HB2  TYR  63           1HB      TYR  63  -7.468   9.930  -2.739
  547    HB3  TYR  63           2HB      TYR  63  -7.149   8.403  -3.598
  548    HD1  TYR  63           2HD      TYR  63  -8.345   7.870  -5.674
  549    HD2  TYR  63           1HD      TYR  63  -8.996  11.574  -3.664
  550    HE1  TYR  63           2HE      TYR  63  -9.450   8.761  -7.698
  551    HE2  TYR  63           1HE      TYR  63 -10.108  12.483  -5.684
  552    HH   TYR  63           HH       TYR  63 -10.491  10.546  -8.655
  553    H    ARG  64           H        ARG  64  -9.149   6.053  -1.362
  554    HA   ARG  64           HA       ARG  64  -7.488   6.467   1.017
  555    HB2  ARG  64           1HB      ARG  64  -9.484   5.085   1.039
  556    HB3  ARG  64           2HB      ARG  64  -8.658   3.929  -0.033
  557    HG2  ARG  64           1HG      ARG  64  -6.992   3.470   1.658
  558    HG3  ARG  64           2HG      ARG  64  -7.663   4.737   2.715
  559    HD2  ARG  64           1HD      ARG  64  -9.739   3.439   2.864
  560    HD3  ARG  64           2HD      ARG  64  -8.957   2.149   1.920
  561    HE   ARG  64           HE       ARG  64  -7.323   2.460   4.231
  562   HH11  ARG  64          1HH1      ARG  64 -10.700   1.784   3.694
  563   HH12  ARG  64          2HH1      ARG  64 -10.750   0.838   5.169
  564   HH21  ARG  64          1HH2      ARG  64  -7.367   1.388   5.926
  565   HH22  ARG  64          2HH2      ARG  64  -8.850   0.612   6.442
  566    H    GLU  65           H        GLU  65  -5.405   6.323   1.168
  567    HA   GLU  65           HA       GLU  65  -3.940   4.717  -0.899
  568    HB2  GLU  65           1HB      GLU  65  -3.263   7.453   0.190
  569    HB3  GLU  65           2HB      GLU  65  -2.186   6.456  -0.818
  570    HG2  GLU  65           1HG      GLU  65  -3.977   6.582  -2.672
  571    HG3  GLU  65           2HG      GLU  65  -4.834   7.642  -1.531
  572    H    TYR  66           H        TYR  66  -2.023   3.768  -0.314
  573    HA   TYR  66           HA       TYR  66  -1.352   3.896   2.609
  574    HB2  TYR  66           1HB      TYR  66  -1.327   1.524   0.734
  575    HB3  TYR  66           2HB      TYR  66  -0.554   1.546   2.339
  576    HD1  TYR  66           1HD      TYR  66  -3.821   1.738   0.577
  577    HD2  TYR  66           2HD      TYR  66  -1.847   1.239   4.322
  578    HE1  TYR  66           1HE      TYR  66  -5.973   1.083   1.614
  579    HE2  TYR  66           2HE      TYR  66  -3.984   0.582   5.375
  580    HH   TYR  66           HH       TYR  66  -6.743  -0.279   3.660
  581    H    CYS  67           H        CYS  67   0.780   3.819   3.203
  582    HA   CYS  67           HA       CYS  67   2.789   4.343   1.003
  583    HB2  CYS  67           1HB      CYS  67   1.624   6.428   1.652
  584    HB3  CYS  67           2HB      CYS  67   2.007   6.112   3.362
  585    HG   CYS  67           HG       CYS  67   3.374   8.066   2.489
  586    H    LEU  68           H        LEU  68   4.823   3.716   1.515
  587    HA   LEU  68           HA       LEU  68   5.262   2.116   3.909
  588    HB2  LEU  68           1HB      LEU  68   6.208   1.620   1.852
  589    HB3  LEU  68           2HB      LEU  68   7.190   3.099   1.734
  590    HG   LEU  68           HG       LEU  68   8.326   2.351   3.891
  591   HD11  LEU  68          1HD1      LEU  68   8.227  -0.110   4.368
  592   HD12  LEU  68          2HD1      LEU  68   6.628   0.649   4.552
  593   HD13  LEU  68          3HD1      LEU  68   7.004  -0.293   3.089
  594   HD21  LEU  68          3HD2      LEU  68   9.425   2.225   1.733
  595   HD22  LEU  68          1HD2      LEU  68   9.858   0.808   2.717
  596   HD23  LEU  68          2HD2      LEU  68   8.665   0.648   1.405
  597    H    LYS  69           H        LYS  69   6.206   2.558   5.766
  598    HA   LYS  69           HA       LYS  69   6.312   5.113   6.862
  599    HB2  LYS  69           1HB      LYS  69   6.562   3.013   8.113
  600    HB3  LYS  69           2HB      LYS  69   8.197   2.822   7.438
  601    HG2  LYS  69           1HG      LYS  69   8.921   4.872   8.570
  602    HG3  LYS  69           2HG      LYS  69   7.280   5.105   9.220
  603    HD2  LYS  69           1HD      LYS  69   7.450   3.032  10.489
  604    HD3  LYS  69           2HD      LYS  69   9.047   2.698   9.777
  605    HE2  LYS  69           1HE      LYS  69   9.937   4.741  10.819
  606    HE3  LYS  69           2HE      LYS  69   8.344   5.070  11.536
  607    HZ1  LYS  69           3HZ      LYS  69  10.026   2.710  12.099
  608    HZ2  LYS  69           1HZ      LYS  69   9.822   4.005  13.101
  609    HZ3  LYS  69           2HZ      LYS  69   8.547   3.014  12.764
  610    H    HIS  70           H        HIS  70   8.966   3.439   5.174
  611    HA   HIS  70           HA       HIS  70  11.003   5.321   5.653
  612    HB2  HIS  70           1HB      HIS  70  11.385   3.133   4.530
  613    HB3  HIS  70           2HB      HIS  70  10.529   3.732   3.090
  614    HD1  HIS  70           1HD      HIS  70  13.561   4.709   5.201
  615    HD2  HIS  70           2HD      HIS  70  12.302   4.763   1.179
  616    HE1  HIS  70           1HE      HIS  70  15.430   5.624   3.923
  617    H    ARG  71           H        ARG  71  11.471   7.293   5.079
  618    HA   ARG  71           HA       ARG  71   9.564   9.045   4.008
  619    HB2  ARG  71           1HB      ARG  71  11.563   9.687   5.249
  620    HB3  ARG  71           2HB      ARG  71  12.518   9.394   3.776
  621    HG2  ARG  71           1HG      ARG  71  11.241  11.122   2.595
  622    HG3  ARG  71           2HG      ARG  71  10.265  11.407   4.056
  623    HD2  ARG  71           1HD      ARG  71  12.221  12.171   5.231
  624    HD3  ARG  71           2HD      ARG  71  13.220  11.852   3.794
  625    HE   ARG  71           HE       ARG  71  12.322  13.955   2.840
  626   HH11  ARG  71          1HH1      ARG  71  10.597  13.118   5.753
  627   HH12  ARG  71          2HH1      ARG  71   9.893  14.722   5.802
  628   HH21  ARG  71          1HH2      ARG  71  11.518  15.794   2.880
  629   HH22  ARG  71          2HH2      ARG  71  10.417  16.249   4.165
  630    H    ASP  72           H        ASP  72   8.788   9.567   2.119
  631    HA   ASP  72           HA       ASP  72   9.366   7.923  -0.177
  632    HB2  ASP  72           1HB      ASP  72   7.766  10.542   0.065
  633    HB3  ASP  72           2HB      ASP  72   8.072   9.538  -1.374
  634    H    GLU  73           H        GLU  73  10.415  11.156   0.800
  635    HA   GLU  73           HA       GLU  73  11.795  11.842  -1.607
  636    HB2  GLU  73           1HB      GLU  73  11.338  13.392   0.245
  637    HB3  GLU  73           2HB      GLU  73  12.493  12.496   1.261
  638    HG2  GLU  73           1HG      GLU  73  14.358  13.170  -0.314
  639    HG3  GLU  73           2HG      GLU  73  13.083  13.934  -1.293
  640    H    LEU  74           H        LEU  74  12.908  10.068   1.276
  641    HA   LEU  74           HA       LEU  74  15.569   9.625   0.248
  642    HB2  LEU  74           1HB      LEU  74  13.839   8.275   2.207
  643    HB3  LEU  74           2HB      LEU  74  15.525   7.733   2.042
  644    HG   LEU  74           HG       LEU  74  14.584  10.489   2.927
  645   HD11  LEU  74          1HD1      LEU  74  15.620   9.847   5.120
  646   HD12  LEU  74          2HD1      LEU  74  14.312   8.728   4.671
  647   HD13  LEU  74          3HD1      LEU  74  16.012   8.246   4.450
  648   HD21  LEU  74          3HD2      LEU  74  16.624  10.632   1.627
  649   HD22  LEU  74          1HD2      LEU  74  16.974  10.955   3.341
  650   HD23  LEU  74          2HD2      LEU  74  17.388   9.377   2.630
  651    H    ALA  75           H        ALA  75  12.534   7.841  -0.016
  652    HA   ALA  75           HA       ALA  75  13.623   5.518  -1.276
  653    HB1  ALA  75           1HB      ALA  75  11.332   5.156  -2.108
  654    HB2  ALA  75           2HB      ALA  75  11.338   5.596  -0.384
  655    HB3  ALA  75           3HB      ALA  75  10.891   6.805  -1.609
  656    H    ASP  76           H        ASP  76  12.449   8.601  -2.608
  657    HA   ASP  76           HA       ASP  76  12.811   7.867  -5.370
  658    HB2  ASP  76           1HB      ASP  76  12.733  10.631  -4.016
  659    HB3  ASP  76           2HB      ASP  76  12.937  10.231  -5.739
  660    H    LEU  77           H        LEU  77  14.974   9.263  -2.949
  661    HA   LEU  77           HA       LEU  77  17.169   9.717  -4.772
  662    HB2  LEU  77           1HB      LEU  77  16.921   9.183  -1.890
  663    HB3  LEU  77           2HB      LEU  77  18.525   9.584  -2.545
  664    HG   LEU  77           HG       LEU  77  16.070  11.380  -2.605
  665   HD11  LEU  77          1HD1      LEU  77  17.365  12.789  -0.983
  666   HD12  LEU  77          2HD1      LEU  77  17.060  11.164  -0.328
  667   HD13  LEU  77          3HD1      LEU  77  18.662  11.572  -0.986
  668   HD21  LEU  77          3HD2      LEU  77  17.490  11.714  -4.541
  669   HD22  LEU  77          1HD2      LEU  77  17.621  13.109  -3.445
  670   HD23  LEU  77          2HD2      LEU  77  18.921  11.891  -3.498
  671    H    GLU  78           H        GLU  78  16.087   6.918  -2.914
  672    HA   GLU  78           HA       GLU  78  18.390   5.285  -3.647
  673    HB2  GLU  78           1HB      GLU  78  15.631   4.645  -2.603
  674    HB3  GLU  78           2HB      GLU  78  16.874   3.414  -2.937
  675    HG2  GLU  78           1HG      GLU  78  18.355   4.455  -1.178
  676    HG3  GLU  78           2HG      GLU  78  17.106   5.714  -1.042
  677    H    HIS  79           H        HIS  79  15.291   6.034  -5.095
  678    HA   HIS  79           HA       HIS  79  15.286   3.855  -6.989
  679    HB2  HIS  79           1HB      HIS  79  13.935   6.591  -7.059
  680    HB3  HIS  79           2HB      HIS  79  13.623   5.276  -8.218
  681    HD2  HIS  79           2HD      HIS  79  13.562   3.022  -5.392
  682    HE1  HIS  79           1HE      HIS  79   9.960   5.225  -4.930
  683    HE2  HIS  79           2HE      HIS  79  11.331   3.085  -4.261
  Start of MODEL    6
    1    H    LYS   3           H        LYS   3   4.517 -14.595  -9.643
    2    HA   LYS   3           HA       LYS   3   4.711 -12.307  -7.981
    3    HB2  LYS   3           1HB      LYS   3   2.165 -12.529  -9.589
    4    HB3  LYS   3           2HB      LYS   3   2.306 -11.615  -8.070
    5    HG2  LYS   3           1HG      LYS   3   4.007 -10.163  -9.096
    6    HG3  LYS   3           2HG      LYS   3   3.875 -11.080 -10.614
    7    HD2  LYS   3           1HD      LYS   3   1.544 -10.412 -10.857
    8    HD3  LYS   3           2HD      LYS   3   1.598  -9.572  -9.291
    9    HE2  LYS   3           1HE      LYS   3   3.166  -7.960 -10.119
   10    HE3  LYS   3           2HE      LYS   3   3.393  -8.876 -11.628
   11    HZ1  LYS   3           3HZ      LYS   3   0.895  -7.550 -10.786
   12    HZ2  LYS   3           1HZ      LYS   3   1.934  -6.994 -11.939
   13    HZ3  LYS   3           2HZ      LYS   3   1.104  -8.400 -12.184
   14    H    ALA   4           H        ALA   4   2.889 -15.155  -8.958
   15    HA   ALA   4           HA       ALA   4   1.505 -15.502  -6.470
   16    HB1  ALA   4           1HB      ALA   4   1.105 -17.800  -7.266
   17    HB2  ALA   4           2HB      ALA   4   0.785 -16.602  -8.543
   18    HB3  ALA   4           3HB      ALA   4   2.289 -17.552  -8.569
   19    H    LYS   5           H        LYS   5   4.749 -16.221  -7.495
   20    HA   LYS   5           HA       LYS   5   5.354 -18.135  -5.403
   21    HB2  LYS   5           1HB      LYS   5   7.077 -16.298  -7.069
   22    HB3  LYS   5           2HB      LYS   5   7.715 -17.488  -5.910
   23    HG2  LYS   5           1HG      LYS   5   6.686 -19.309  -7.200
   24    HG3  LYS   5           2HG      LYS   5   6.026 -18.124  -8.353
   25    HD2  LYS   5           1HD      LYS   5   8.305 -17.423  -8.949
   26    HD3  LYS   5           2HD      LYS   5   8.973 -18.593  -7.786
   27    HE2  LYS   5           1HE      LYS   5   7.961 -20.438  -9.044
   28    HE3  LYS   5           2HE      LYS   5   7.267 -19.278 -10.199
   29    HZ1  LYS   5           3HZ      LYS   5  10.147 -19.713  -9.726
   30    HZ2  LYS   5           1HZ      LYS   5   9.296 -20.256 -11.031
   31    HZ3  LYS   5           2HZ      LYS   5   9.503 -18.637 -10.798
   32    H    LEU   6           H        LEU   6   5.096 -14.676  -5.509
   33    HA   LEU   6           HA       LEU   6   6.485 -14.422  -2.891
   34    HB2  LEU   6           1HB      LEU   6   5.197 -12.482  -4.699
   35    HB3  LEU   6           2HB      LEU   6   6.134 -11.941  -3.288
   36    HG   LEU   6           HG       LEU   6   7.201 -13.360  -5.760
   37   HD11  LEU   6          1HD1      LEU   6   8.467 -11.221  -6.098
   38   HD12  LEU   6          2HD1      LEU   6   6.711 -10.939  -6.093
   39   HD13  LEU   6          3HD1      LEU   6   7.680 -10.545  -4.653
   40   HD21  LEU   6          3HD2      LEU   6   8.363 -14.122  -3.772
   41   HD22  LEU   6          1HD2      LEU   6   9.433 -13.077  -4.739
   42   HD23  LEU   6          2HD2      LEU   6   8.659 -12.441  -3.265
   43    H    SER   7           H        SER   7   5.549 -13.455  -1.084
   44    HA   SER   7           HA       SER   7   2.760 -14.186  -0.533
   45    HB2  SER   7           1HB      SER   7   3.079 -13.443   1.559
   46    HB3  SER   7           2HB      SER   7   4.581 -14.257   1.064
   47    HG   SER   7           HG       SER   7   5.224 -12.405   2.009
   48    H    LEU   8           H        LEU   8   1.203 -12.606   0.293
   49    HA   LEU   8           HA       LEU   8   0.776 -10.353  -1.449
   50    HB2  LEU   8           1HB      LEU   8  -0.252 -11.155   1.189
   51    HB3  LEU   8           2HB      LEU   8  -0.992  -9.762   0.366
   52    HG   LEU   8           HG       LEU   8  -0.969 -12.646  -0.607
   53   HD11  LEU   8          1HD1      LEU   8  -3.452 -12.493  -0.275
   54   HD12  LEU   8          2HD1      LEU   8  -2.578 -12.217   1.250
   55   HD13  LEU   8          3HD1      LEU   8  -3.251 -10.839   0.347
   56   HD21  LEU   8          3HD2      LEU   8  -0.788 -11.099  -2.465
   57   HD22  LEU   8          1HD2      LEU   8  -2.408 -11.834  -2.444
   58   HD23  LEU   8          2HD2      LEU   8  -2.180 -10.167  -1.863
   59    H    THR   9           H        THR   9   2.262 -10.688   1.736
   60    HA   THR   9           HA       THR   9   2.629  -7.883   2.233
   61    HB   THR   9           HB       THR   9   4.342 -10.259   3.074
   62    HG1  THR   9           1HG      THR   9   3.130  -9.978   5.040
   63   HG21  THR   9          3HG2      THR   9   4.220  -7.412   4.145
   64   HG22  THR   9          1HG2      THR   9   5.175  -8.745   4.838
   65   HG23  THR   9          2HG2      THR   9   5.565  -8.118   3.217
   66    H    GLN  10           H        GLN  10   4.734 -10.277   0.633
   67    HA   GLN  10           HA       GLN  10   6.849  -8.427   0.064
   68    HB2  GLN  10           1HB      GLN  10   5.940 -10.990  -1.252
   69    HB3  GLN  10           2HB      GLN  10   7.378 -10.081  -1.779
   70    HG2  GLN  10           1HG      GLN  10   8.386 -10.544   0.677
   71    HG3  GLN  10           2HG      GLN  10   6.743 -11.215   0.804
   72   HE21  GLN  10          2HE2      GLN  10   9.986 -11.648  -0.478
   73   HE22  GLN  10          1HE2      GLN  10   9.808 -13.316  -0.915
   74    H    LEU  11           H        LEU  11   4.035  -9.446  -1.866
   75    HA   LEU  11           HA       LEU  11   4.792  -8.018  -4.228
   76    HB2  LEU  11           1HB      LEU  11   2.250  -8.906  -3.056
   77    HB3  LEU  11           2HB      LEU  11   2.212  -8.182  -4.680
   78    HG   LEU  11           HG       LEU  11   3.723 -10.701  -3.888
   79   HD11  LEU  11          1HD1      LEU  11   2.034 -11.875  -5.325
   80   HD12  LEU  11          2HD1      LEU  11   1.254 -11.041  -3.960
   81   HD13  LEU  11          3HD1      LEU  11   1.204 -10.323  -5.589
   82   HD21  LEU  11          3HD2      LEU  11   4.851  -9.467  -5.644
   83   HD22  LEU  11          1HD2      LEU  11   4.133 -10.953  -6.311
   84   HD23  LEU  11          2HD2      LEU  11   3.346  -9.379  -6.589
   85    H    ILE  12           H        ILE  12   2.690  -7.085  -1.510
   86    HA   ILE  12           HA       ILE  12   1.999  -4.498  -2.582
   87    HB   ILE  12           HB       ILE  12   2.104  -5.569   0.270
   88   HG12  ILE  12          1HG1      ILE  12  -0.263  -4.922  -1.459
   89   HG13  ILE  12          2HG1      ILE  12   0.482  -6.534  -1.350
   90   HG21  ILE  12          1HG2      ILE  12   0.812  -3.559   0.897
   91   HG22  ILE  12          2HG2      ILE  12   2.417  -3.117   0.270
   92   HG23  ILE  12          3HG2      ILE  12   0.977  -2.934  -0.760
   93   HD11  ILE  12          3HD1      ILE  12  -0.746  -4.983   0.956
   94   HD12  ILE  12          1HD1      ILE  12  -1.489  -6.365   0.118
   95   HD13  ILE  12          HD13      ILE  12   0.000  -6.595   1.065
   96    H    LEU  13           H        LEU  13   4.609  -5.506  -0.394
   97    HA   LEU  13           HA       LEU  13   5.489  -2.786   0.059
   98    HB2  LEU  13           1HB      LEU  13   6.722  -5.446   0.335
   99    HB3  LEU  13           2HB      LEU  13   7.593  -4.023   0.952
  100    HG   LEU  13           HG       LEU  13   4.922  -5.102   1.930
  101   HD11  LEU  13          1HD1      LEU  13   6.177  -5.472   4.072
  102   HD12  LEU  13          2HD1      LEU  13   6.910  -6.380   2.728
  103   HD13  LEU  13          3HD1      LEU  13   7.656  -4.865   3.292
  104   HD21  LEU  13          3HD2      LEU  13   4.919  -2.678   1.964
  105   HD22  LEU  13          1HD2      LEU  13   5.019  -3.307   3.626
  106   HD23  LEU  13          2HD2      LEU  13   6.474  -2.659   2.830
  107    H    ILE  14           H        ILE  14   6.347  -5.282  -2.277
  108    HA   ILE  14           HA       ILE  14   8.591  -3.858  -3.434
  109    HB   ILE  14           HB       ILE  14   6.670  -5.949  -4.544
  110   HG12  ILE  14          1HG1      ILE  14   9.588  -6.181  -3.878
  111   HG13  ILE  14          2HG1      ILE  14   8.278  -6.542  -2.730
  112   HG21  ILE  14          1HG2      ILE  14   8.228  -6.139  -6.453
  113   HG22  ILE  14          2HG2      ILE  14   7.501  -4.517  -6.380
  114   HG23  ILE  14          3HG2      ILE  14   9.171  -4.769  -5.822
  115   HD11  ILE  14          3HD1      ILE  14   8.733  -7.916  -5.402
  116   HD12  ILE  14          1HD1      ILE  14   9.114  -8.597  -3.803
  117   HD13  ILE  14          2HD1      ILE  14   7.422  -8.279  -4.255
  118    H    ARG  15           H        ARG  15   5.125  -3.877  -4.201
  119    HA   ARG  15           HA       ARG  15   5.384  -2.086  -6.444
  120    HB2  ARG  15           1HB      ARG  15   3.488  -3.500  -6.185
  121    HB3  ARG  15           2HB      ARG  15   3.022  -2.635  -4.702
  122    HG2  ARG  15           1HG      ARG  15   1.651  -1.877  -6.553
  123    HG3  ARG  15           2HG      ARG  15   2.733  -0.567  -6.025
  124    HD2  ARG  15           1HD      ARG  15   4.221  -1.095  -7.887
  125    HD3  ARG  15           2HD      ARG  15   3.059  -2.327  -8.432
  126    HE   ARG  15           HE       ARG  15   1.714   0.252  -8.394
  127   HH11  ARG  15          1HH1      ARG  15   4.219  -1.401 -10.172
  128   HH12  ARG  15          2HH1      ARG  15   3.821  -0.475 -11.605
  129   HH21  ARG  15          1HH2      ARG  15   1.253   1.328 -10.025
  130   HH22  ARG  15          2HH2      ARG  15   2.132   1.082 -11.522
  131    H    LEU  16           H        LEU  16   4.891  -1.559  -2.981
  132    HA   LEU  16           HA       LEU  16   4.443   1.310  -3.322
  133    HB2  LEU  16           1HB      LEU  16   5.064  -0.467  -1.059
  134    HB3  LEU  16           2HB      LEU  16   4.739   1.252  -0.740
  135    HG   LEU  16           HG       LEU  16   2.806  -0.801  -1.880
  136   HD11  LEU  16          1HD1      LEU  16   1.509  -0.322   0.213
  137   HD12  LEU  16          2HD1      LEU  16   3.135  -0.939   0.587
  138   HD13  LEU  16          3HD1      LEU  16   2.789   0.801   0.731
  139   HD21  LEU  16          3HD2      LEU  16   2.489   1.343  -2.965
  140   HD22  LEU  16          1HD2      LEU  16   1.134   1.016  -1.859
  141   HD23  LEU  16          2HD2      LEU  16   2.411   2.162  -1.386
  142    H    SER  17           H        SER  17   7.199  -0.773  -2.729
  143    HA   SER  17           HA       SER  17   9.100   1.352  -2.034
  144    HB2  SER  17           1HB      SER  17  10.738  -0.205  -2.227
  145    HB3  SER  17           2HB      SER  17   9.349  -0.940  -1.393
  146    HG   SER  17           HG       SER  17  10.045  -1.288  -4.122
  147    H    ASN  18           H        ASN  18   7.693   0.085  -4.985
  148    HA   ASN  18           HA       ASN  18   9.817   1.217  -6.701
  149    HB2  ASN  18           1HB      ASN  18   7.190  -0.206  -7.580
  150    HB3  ASN  18           2HB      ASN  18   8.484   0.698  -8.406
  151   HD21  ASN  18          2HD2      ASN  18   7.610  -2.128  -8.561
  152   HD22  ASN  18          1HD2      ASN  18   9.037  -3.063  -8.260
  153    H    ARG  19           H        ARG  19   6.403   1.896  -5.927
  154    HA   ARG  19           HA       ARG  19   6.630   4.364  -7.614
  155    HB2  ARG  19           1HB      ARG  19   4.201   2.811  -6.838
  156    HB3  ARG  19           2HB      ARG  19   4.228   4.347  -7.736
  157    HG2  ARG  19           1HG      ARG  19   5.593   1.814  -8.690
  158    HG3  ARG  19           2HG      ARG  19   3.932   2.270  -9.144
  159    HD2  ARG  19           1HD      ARG  19   4.841   4.362 -10.081
  160    HD3  ARG  19           2HD      ARG  19   6.476   3.733  -9.764
  161    HE   ARG  19           HE       ARG  19   5.148   1.837 -11.494
  162   HH11  ARG  19          1HH1      ARG  19   6.232   5.148 -11.637
  163   HH12  ARG  19          2HH1      ARG  19   6.505   4.992 -13.361
  164   HH21  ARG  19          1HH2      ARG  19   5.449   1.643 -13.468
  165   HH22  ARG  19          2HH2      ARG  19   6.058   2.994 -14.407
  166    H    GLY  20           H        GLY  20   6.719   3.371  -4.450
  167    HA2  GLY  20           1HA      GLY  20   6.971   4.801  -2.605
  168    HA3  GLY  20           2HA      GLY  20   6.330   6.149  -3.572
  169    H    CYS  21           H        CYS  21   3.913   5.544  -4.335
  170    HA   CYS  21           HA       CYS  21   2.329   4.514  -1.983
  171    HB2  CYS  21           1HB      CYS  21   2.855   6.903  -1.634
  172    HB3  CYS  21           2HB      CYS  21   2.232   7.283  -3.258
  173    HG   CYS  21           HG       CYS  21  -0.172   6.512  -2.803
  174    H    GLN  22           H        GLN  22   0.631   3.373  -2.669
  175    HA   GLN  22           HA       GLN  22  -0.537   3.999  -5.350
  176    HB2  GLN  22           1HB      GLN  22   0.146   1.287  -4.202
  177    HB3  GLN  22           2HB      GLN  22  -0.929   1.540  -5.597
  178    HG2  GLN  22           1HG      GLN  22   2.118   2.318  -5.692
  179    HG3  GLN  22           2HG      GLN  22   1.200   0.843  -6.072
  180   HE21  GLN  22          2HE2      GLN  22   1.068   4.385  -6.678
  181   HE22  GLN  22          1HE2      GLN  22   0.636   4.253  -8.349
  182    H    THR  23           H        THR  23  -2.712   3.320  -5.659
  183    HA   THR  23           HA       THR  23  -4.317   3.521  -3.197
  184    HB   THR  23           HB       THR  23  -6.243   3.550  -4.669
  185    HG1  THR  23           1HG      THR  23  -5.598   3.393  -7.063
  186   HG21  THR  23          3HG2      THR  23  -3.954   5.123  -5.915
  187   HG22  THR  23          1HG2      THR  23  -5.688   5.456  -6.136
  188   HG23  THR  23          2HG2      THR  23  -4.943   5.646  -4.530
  189    H    LEU  24           H        LEU  24  -6.112   2.056  -2.780
  190    HA   LEU  24           HA       LEU  24  -5.230  -0.659  -2.521
  191    HB2  LEU  24           1HB      LEU  24  -6.744   0.355  -1.104
  192    HB3  LEU  24           2HB      LEU  24  -8.031   0.573  -2.310
  193    HG   LEU  24           HG       LEU  24  -8.135  -1.919  -2.556
  194   HD11  LEU  24          1HD1      LEU  24  -7.096  -3.303  -0.739
  195   HD12  LEU  24          2HD1      LEU  24  -5.860  -2.430  -1.673
  196   HD13  LEU  24          3HD1      LEU  24  -6.349  -1.833  -0.069
  197   HD21  LEU  24          3HD2      LEU  24  -9.752  -0.739  -1.190
  198   HD22  LEU  24          1HD2      LEU  24  -9.369  -2.312  -0.452
  199   HD23  LEU  24          2HD2      LEU  24  -8.666  -0.819   0.217
  200    H    GLU  25           H        GLU  25  -7.309   0.936  -4.907
  201    HA   GLU  25           HA       GLU  25  -7.997  -1.442  -6.366
  202    HB2  GLU  25           1HB      GLU  25  -9.126   0.717  -6.630
  203    HB3  GLU  25           2HB      GLU  25  -7.638   1.401  -7.330
  204    HG2  GLU  25           1HG      GLU  25  -7.856  -0.211  -9.279
  205    HG3  GLU  25           2HG      GLU  25  -9.277  -0.848  -8.420
  206    H    GLU  26           H        GLU  26  -5.288   0.845  -6.713
  207    HA   GLU  26           HA       GLU  26  -4.137  -0.484  -8.999
  208    HB2  GLU  26           1HB      GLU  26  -3.025   1.350  -6.879
  209    HB3  GLU  26           2HB      GLU  26  -2.043   0.704  -8.216
  210    HG2  GLU  26           1HG      GLU  26  -3.394   1.939  -9.874
  211    HG3  GLU  26           2HG      GLU  26  -4.581   2.225  -8.583
  212    H    LEU  27           H        LEU  27  -3.724  -0.891  -5.508
  213    HA   LEU  27           HA       LEU  27  -1.596  -2.835  -5.721
  214    HB2  LEU  27           1HB      LEU  27  -3.670  -2.184  -3.745
  215    HB3  LEU  27           2HB      LEU  27  -2.492  -3.451  -3.331
  216    HG   LEU  27           HG       LEU  27  -1.833  -0.546  -3.953
  217   HD11  LEU  27          1HD1      LEU  27  -1.252  -0.404  -1.516
  218   HD12  LEU  27          2HD1      LEU  27  -2.966  -0.819  -1.749
  219   HD13  LEU  27          3HD1      LEU  27  -1.797  -2.085  -1.304
  220   HD21  LEU  27          3HD2      LEU  27  -0.065  -2.062  -4.627
  221   HD22  LEU  27          1HD2      LEU  27   0.444  -1.135  -3.195
  222   HD23  LEU  27          2HD2      LEU  27  -0.072  -2.830  -3.023
  223    H    GLU  28           H        GLU  28  -5.125  -3.071  -5.722
  224    HA   GLU  28           HA       GLU  28  -5.236  -5.949  -5.777
  225    HB2  GLU  28           1HB      GLU  28  -7.173  -4.572  -5.289
  226    HB3  GLU  28           2HB      GLU  28  -7.092  -3.855  -6.917
  227    HG2  GLU  28           1HG      GLU  28  -7.722  -6.041  -7.937
  228    HG3  GLU  28           2HG      GLU  28  -7.495  -6.753  -6.324
  229    H    GLU  29           H        GLU  29  -4.968  -3.507  -8.340
  230    HA   GLU  29           HA       GLU  29  -5.150  -5.404 -10.510
  231    HB2  GLU  29           1HB      GLU  29  -3.988  -2.629 -10.280
  232    HB3  GLU  29           2HB      GLU  29  -4.025  -3.558 -11.800
  233    HG2  GLU  29           1HG      GLU  29  -6.545  -3.570 -11.714
  234    HG3  GLU  29           2HG      GLU  29  -6.380  -2.782 -10.128
  235    H    PHE  30           H        PHE  30  -2.526  -4.322  -8.461
  236    HA   PHE  30           HA       PHE  30  -0.443  -5.474 -10.171
  237    HB2  PHE  30           1HB      PHE  30   0.055  -3.565  -8.672
  238    HB3  PHE  30           2HB      PHE  30  -0.356  -4.567  -7.260
  239    HD1  PHE  30           1HD      PHE  30   2.015  -4.193 -10.077
  240    HD2  PHE  30           2HD      PHE  30   1.199  -5.998  -6.292
  241    HE1  PHE  30           1HE      PHE  30   4.362  -4.958  -9.938
  242    HE2  PHE  30           2HE      PHE  30   3.547  -6.763  -6.148
  243    HZ   PHE  30           HZ       PHE  30   5.127  -6.242  -7.974
  244    H    THR  31           H        THR  31  -1.882  -6.392  -7.020
  245    HA   THR  31           HA       THR  31  -0.135  -8.733  -6.883
  246    HB   THR  31           HB       THR  31  -1.272  -9.219  -4.781
  247    HG1  THR  31           1HG      THR  31  -3.013  -7.024  -5.311
  248   HG21  THR  31          3HG2      THR  31  -0.840  -6.224  -5.121
  249   HG22  THR  31          1HG2      THR  31  -0.868  -7.102  -3.574
  250   HG23  THR  31          2HG2      THR  31   0.425  -7.421  -4.756
  251    H    GLN  32           H        GLN  32  -3.233  -8.076  -8.219
  252    HA   GLN  32           HA       GLN  32  -4.821  -9.471  -9.183
  253    HB2  GLN  32           1HB      GLN  32  -3.031 -11.811  -8.564
  254    HB3  GLN  32           2HB      GLN  32  -4.267 -11.660  -9.834
  255    HG2  GLN  32           1HG      GLN  32  -1.405 -10.388  -9.979
  256    HG3  GLN  32           2HG      GLN  32  -2.343 -11.661 -10.794
  257   HE21  GLN  32          2HE2      GLN  32  -1.430  -8.392 -10.792
  258   HE22  GLN  32          1HE2      GLN  32  -2.534  -7.818 -11.998
  259    H    ALA  33           H        ALA  33  -4.117  -9.227  -6.108
  260    HA   ALA  33           HA       ALA  33  -5.965 -11.391  -5.220
  261    HB1  ALA  33           1HB      ALA  33  -5.173 -10.856  -2.949
  262    HB2  ALA  33           2HB      ALA  33  -3.823 -11.267  -4.031
  263    HB3  ALA  33           3HB      ALA  33  -4.143  -9.568  -3.613
  264    H    LYS  34           H        LYS  34  -7.806 -11.001  -4.063
  265    HA   LYS  34           HA       LYS  34  -9.322  -8.713  -4.809
  266    HB2  LYS  34           1HB      LYS  34 -10.146 -10.960  -3.996
  267    HB3  LYS  34           2HB      LYS  34  -9.760 -10.405  -2.351
  268    HG2  LYS  34           1HG      LYS  34 -11.340  -8.538  -2.601
  269    HG3  LYS  34           2HG      LYS  34 -11.721  -9.078  -4.253
  270    HD2  LYS  34           1HD      LYS  34 -12.519 -11.242  -3.332
  271    HD3  LYS  34           2HD      LYS  34 -12.206 -10.633  -1.688
  272    HE2  LYS  34           1HE      LYS  34 -13.786  -8.763  -2.123
  273    HE3  LYS  34           2HE      LYS  34 -14.149  -9.476  -3.712
  274    HZ1  LYS  34           3HZ      LYS  34 -14.620 -10.771  -1.102
  275    HZ2  LYS  34           1HZ      LYS  34 -15.780 -10.099  -2.062
  276    HZ3  LYS  34           2HZ      LYS  34 -14.957 -11.433  -2.575
  277    H    ARG  35           H        ARG  35  -9.621  -6.757  -4.058
  278    HA   ARG  35           HA       ARG  35  -7.759  -5.527  -2.320
  279    HB2  ARG  35           1HB      ARG  35  -9.141  -3.650  -2.245
  280    HB3  ARG  35           2HB      ARG  35  -9.099  -4.318  -3.893
  281    HG2  ARG  35           1HG      ARG  35 -11.320  -5.384  -3.442
  282    HG3  ARG  35           2HG      ARG  35 -11.363  -4.522  -1.886
  283    HD2  ARG  35           1HD      ARG  35 -12.695  -3.384  -3.494
  284    HD3  ARG  35           2HD      ARG  35 -11.266  -2.404  -3.088
  285    HE   ARG  35           HE       ARG  35 -10.785  -3.823  -5.598
  286   HH11  ARG  35          1HH1      ARG  35 -12.660  -1.173  -4.320
  287   HH12  ARG  35          2HH1      ARG  35 -12.630  -0.388  -5.887
  288   HH21  ARG  35          1HH2      ARG  35 -10.750  -2.939  -7.401
  289   HH22  ARG  35          2HH2      ARG  35 -11.542  -1.395  -7.644
  290    H    GLU  36           H        GLU  36 -10.796  -7.152  -1.581
  291    HA   GLU  36           HA       GLU  36 -10.971  -6.386   1.173
  292    HB2  GLU  36           1HB      GLU  36 -12.763  -7.498  -0.078
  293    HB3  GLU  36           2HB      GLU  36 -11.770  -8.971  -0.177
  294    HG2  GLU  36           1HG      GLU  36 -11.877  -9.153   2.363
  295    HG3  GLU  36           2HG      GLU  36 -12.824  -7.649   2.288
  296    H    VAL  37           H        VAL  37  -9.243  -9.056  -0.417
  297    HA   VAL  37           HA       VAL  37  -8.170 -10.128   2.084
  298    HB   VAL  37           HB       VAL  37  -7.291 -10.456  -0.814
  299   HG11  VAL  37          1HG1      VAL  37  -5.964 -12.366   0.028
  300   HG12  VAL  37          2HG1      VAL  37  -5.422 -10.836   0.759
  301   HG13  VAL  37          3HG1      VAL  37  -6.438 -11.959   1.694
  302   HG21  VAL  37          3HG2      VAL  37  -9.499 -11.355  -0.388
  303   HG22  VAL  37          1HG2      VAL  37  -8.322 -12.664  -0.635
  304   HG23  VAL  37          2HG2      VAL  37  -8.880 -12.268   1.008
  305    H    LEU  38           H        LEU  38  -6.995  -7.826  -0.330
  306    HA   LEU  38           HA       LEU  38  -4.362  -7.582   0.795
  307    HB2  LEU  38           1HB      LEU  38  -6.118  -5.784  -0.737
  308    HB3  LEU  38           2HB      LEU  38  -4.424  -5.316  -0.468
  309    HG   LEU  38           HG       LEU  38  -5.385  -7.768  -1.993
  310   HD11  LEU  38          1HD1      LEU  38  -4.448  -6.582  -3.996
  311   HD12  LEU  38          2HD1      LEU  38  -5.752  -5.637  -3.237
  312   HD13  LEU  38          3HD1      LEU  38  -4.052  -5.187  -2.965
  313   HD21  LEU  38          3HD2      LEU  38  -3.291  -8.180  -0.843
  314   HD22  LEU  38          1HD2      LEU  38  -3.007  -8.062  -2.595
  315   HD23  LEU  38          2HD2      LEU  38  -2.587  -6.697  -1.532
  316    H    LEU  39           H        LEU  39  -7.437  -6.051   1.556
  317    HA   LEU  39           HA       LEU  39  -6.499  -3.943   3.198
  318    HB2  LEU  39           1HB      LEU  39  -8.676  -4.157   2.514
  319    HB3  LEU  39           2HB      LEU  39  -9.036  -5.651   3.407
  320    HG   LEU  39           HG       LEU  39  -8.607  -4.393   5.539
  321   HD11  LEU  39          1HD1      LEU  39  -8.663  -1.887   5.421
  322   HD12  LEU  39          2HD1      LEU  39  -7.253  -2.545   4.558
  323   HD13  LEU  39          3HD1      LEU  39  -8.675  -1.987   3.645
  324   HD21  LEU  39          3HD2      LEU  39 -10.868  -4.810   4.767
  325   HD22  LEU  39          1HD2      LEU  39 -10.776  -3.209   5.539
  326   HD23  LEU  39          2HD2      LEU  39 -10.828  -3.341   3.765
  327    H    VAL  40           H        VAL  40  -6.954  -7.372   3.947
  328    HA   VAL  40           HA       VAL  40  -6.471  -7.161   6.788
  329    HB   VAL  40           HB       VAL  40  -5.992  -9.454   4.838
  330   HG11  VAL  40          1HG1      VAL  40  -5.911 -10.875   6.860
  331   HG12  VAL  40          2HG1      VAL  40  -4.597  -9.675   6.869
  332   HG13  VAL  40          3HG1      VAL  40  -6.037  -9.425   7.884
  333   HG21  VAL  40          3HG2      VAL  40  -8.318  -8.793   4.974
  334   HG22  VAL  40          1HG2      VAL  40  -8.061 -10.366   5.765
  335   HG23  VAL  40          2HG2      VAL  40  -8.265  -8.897   6.750
  336    H    THR  41           H        THR  41  -4.236  -7.923   4.115
  337    HA   THR  41           HA       THR  41  -1.929  -8.046   5.842
  338    HB   THR  41           HB       THR  41  -2.114  -7.482   2.853
  339    HG1  THR  41           1HG      THR  41  -2.928  -9.545   3.520
  340   HG21  THR  41          3HG2      THR  41   0.237  -8.349   4.582
  341   HG22  THR  41          1HG2      THR  41   0.251  -8.192   2.810
  342   HG23  THR  41          2HG2      THR  41   0.035  -6.750   3.830
  343    H    LEU  42           H        LEU  42  -3.421  -5.431   3.981
  344    HA   LEU  42           HA       LEU  42  -1.270  -3.556   4.369
  345    HB2  LEU  42           1HB      LEU  42  -4.149  -3.384   3.820
  346    HB3  LEU  42           2HB      LEU  42  -3.229  -1.862   3.874
  347    HG   LEU  42           HG       LEU  42  -2.679  -4.172   1.972
  348   HD11  LEU  42          1HD1      LEU  42  -3.622  -2.659   0.206
  349   HD12  LEU  42          2HD1      LEU  42  -4.838  -3.041   1.447
  350   HD13  LEU  42          3HD1      LEU  42  -4.015  -1.463   1.464
  351   HD21  LEU  42          3HD2      LEU  42  -0.701  -2.871   2.500
  352   HD22  LEU  42          1HD2      LEU  42  -1.206  -2.554   0.823
  353   HD23  LEU  42          2HD2      LEU  42  -1.552  -1.361   2.097
  354    H    THR  43           H        THR  43  -4.249  -4.201   6.193
  355    HA   THR  43           HA       THR  43  -3.822  -2.058   8.093
  356    HB   THR  43           HB       THR  43  -5.442  -4.630   8.326
  357    HG1  THR  43           1HG      THR  43  -7.157  -3.281   7.744
  358   HG21  THR  43          3HG2      THR  43  -5.480  -2.098  10.016
  359   HG22  THR  43          1HG2      THR  43  -6.598  -3.473  10.176
  360   HG23  THR  43          2HG2      THR  43  -4.868  -3.686  10.537
  361    H    ARG  44           H        ARG  44  -2.942  -5.492   8.041
  362    HA   ARG  44           HA       ARG  44  -1.898  -5.554  10.725
  363    HB2  ARG  44           1HB      ARG  44  -1.432  -7.274   8.343
  364    HB3  ARG  44           2HB      ARG  44  -0.602  -7.509   9.900
  365    HG2  ARG  44           1HG      ARG  44  -2.751  -7.831  11.018
  366    HG3  ARG  44           2HG      ARG  44  -3.607  -7.539   9.486
  367    HD2  ARG  44           1HD      ARG  44  -2.653  -9.527   8.545
  368    HD3  ARG  44           2HD      ARG  44  -1.718  -9.806  10.033
  369    HE   ARG  44           HE       ARG  44  -4.529  -9.870  10.734
  370   HH11  ARG  44          1HH1      ARG  44  -2.269 -11.733   8.843
  371   HH12  ARG  44          2HH1      ARG  44  -3.186 -13.191   9.172
  372   HH21  ARG  44          1HH2      ARG  44  -5.594 -11.527  11.112
  373   HH22  ARG  44          2HH2      ARG  44  -5.083 -13.075  10.465
  374    H    LEU  45           H        LEU  45  -0.411  -4.840   7.581
  375    HA   LEU  45           HA       LEU  45   2.235  -4.413   8.694
  376    HB2  LEU  45           1HB      LEU  45   0.810  -3.590   6.260
  377    HB3  LEU  45           2HB      LEU  45   2.521  -3.133   6.427
  378    HG   LEU  45           HG       LEU  45   1.420  -5.969   6.343
  379   HD11  LEU  45          1HD1      LEU  45   2.618  -6.100   4.143
  380   HD12  LEU  45          2HD1      LEU  45   1.370  -4.832   4.124
  381   HD13  LEU  45          3HD1      LEU  45   3.085  -4.392   4.312
  382   HD21  LEU  45          3HD2      LEU  45   3.370  -5.799   7.773
  383   HD22  LEU  45          1HD2      LEU  45   3.790  -6.662   6.273
  384   HD23  LEU  45          2HD2      LEU  45   4.274  -4.962   6.490
  385    H    HIS  46           H        HIS  46  -0.584  -2.366   8.160
  386    HA   HIS  46           HA       HIS  46   0.709   0.130   8.769
  387    HB2  HIS  46           1HB      HIS  46  -1.552  -0.044   7.700
  388    HB3  HIS  46           2HB      HIS  46  -2.199  -0.663   9.238
  389    HD1  HIS  46           1HD      HIS  46  -0.294   2.427   8.034
  390    HD2  HIS  46           2HD      HIS  46  -3.354   1.396  10.743
  391    HE1  HIS  46           1HE      HIS  46  -0.995   4.518   9.087
  392    H    GLN  47           H        GLN  47  -0.898  -2.291  10.810
  393    HA   GLN  47           HA       GLN  47  -0.492  -0.842  13.276
  394    HB2  GLN  47           1HB      GLN  47  -0.860  -3.772  12.636
  395    HB3  GLN  47           2HB      GLN  47  -0.725  -3.135  14.292
  396    HG2  GLN  47           1HG      GLN  47  -2.983  -1.758  13.793
  397    HG3  GLN  47           2HG      GLN  47  -2.626  -2.491  12.212
  398   HE21  GLN  47          2HE2      GLN  47  -5.086  -2.757  13.589
  399   HE22  GLN  47          1HE2      GLN  47  -5.286  -4.423  14.020
  400    H    ARG  48           H        ARG  48   1.493  -3.089  11.420
  401    HA   ARG  48           HA       ARG  48   3.557  -3.340  13.442
  402    HB2  ARG  48           1HB      ARG  48   3.546  -3.858  10.509
  403    HB3  ARG  48           2HB      ARG  48   4.972  -4.067  11.552
  404    HG2  ARG  48           1HG      ARG  48   3.853  -5.767  12.844
  405    HG3  ARG  48           2HG      ARG  48   2.321  -5.473  11.987
  406    HD2  ARG  48           1HD      ARG  48   3.322  -6.284   9.937
  407    HD3  ARG  48           2HD      ARG  48   4.845  -6.589  10.805
  408    HE   ARG  48           HE       ARG  48   2.850  -8.204  12.093
  409   HH11  ARG  48          1HH1      ARG  48   4.222  -7.955   8.896
  410   HH12  ARG  48          2HH1      ARG  48   3.958  -9.669   8.644
  411   HH21  ARG  48          1HH2      ARG  48   2.535 -10.166  11.816
  412   HH22  ARG  48          2HH2      ARG  48   2.996 -10.932  10.307
  413    H    GLY  49           H        GLY  49   2.830  -0.979  10.968
  414    HA2  GLY  49           1HA      GLY  49   3.684   1.256  11.083
  415    HA3  GLY  49           2HA      GLY  49   5.097   0.656  11.984
  416    H    VAL  50           H        VAL  50   3.993  -1.106   9.198
  417    HA   VAL  50           HA       VAL  50   6.531  -0.408   7.774
  418    HB   VAL  50           HB       VAL  50   4.443  -2.559   7.221
  419   HG11  VAL  50          1HG1      VAL  50   6.140  -3.450   5.660
  420   HG12  VAL  50          2HG1      VAL  50   5.639  -1.808   5.192
  421   HG13  VAL  50          3HG1      VAL  50   7.197  -2.064   6.016
  422   HG21  VAL  50          3HG2      VAL  50   5.621  -2.985   9.294
  423   HG22  VAL  50          1HG2      VAL  50   6.130  -4.130   8.030
  424   HG23  VAL  50          2HG2      VAL  50   7.185  -2.767   8.472
  425    H    ILE  51           H        ILE  51   3.022  -0.430   7.225
  426    HA   ILE  51           HA       ILE  51   3.525   1.448   4.927
  427    HB   ILE  51           HB       ILE  51   1.276  -0.586   5.296
  428   HG12  ILE  51          1HG1      ILE  51   3.450  -0.462   3.223
  429   HG13  ILE  51          2HG1      ILE  51   3.440  -1.530   4.646
  430   HG21  ILE  51          1HG2      ILE  51   0.526   0.179   3.068
  431   HG22  ILE  51          2HG2      ILE  51   0.498   1.512   4.245
  432   HG23  ILE  51          3HG2      ILE  51   1.816   1.404   3.054
  433   HD11  ILE  51          3HD1      ILE  51   1.398  -1.547   2.396
  434   HD12  ILE  51          1HD1      ILE  51   2.703  -2.734   2.627
  435   HD13  ILE  51          2HD1      ILE  51   1.388  -2.613   3.820
  436    H    TYR  52           H        TYR  52   2.758   3.367   4.996
  437    HA   TYR  52           HA       TYR  52   0.776   4.002   7.147
  438    HB2  TYR  52           1HB      TYR  52   2.844   5.275   7.204
  439    HB3  TYR  52           2HB      TYR  52   2.609   5.761   5.507
  440    HD1  TYR  52           1HD      TYR  52   1.075   6.031   8.905
  441    HD2  TYR  52           2HD      TYR  52   1.382   7.705   4.994
  442    HE1  TYR  52           1HE      TYR  52  -0.222   8.006   9.655
  443    HE2  TYR  52           2HE      TYR  52   0.090   9.681   5.727
  444    HH   TYR  52           HH       TYR  52  -0.990  10.702   7.452
  445    H    ARG  53           H        ARG  53  -1.188   4.731   6.767
  446    HA   ARG  53           HA       ARG  53  -1.959   5.099   3.887
  447    HB2  ARG  53           1HB      ARG  53  -4.025   4.112   4.250
  448    HB3  ARG  53           2HB      ARG  53  -2.739   2.990   4.750
  449    HG2  ARG  53           1HG      ARG  53  -3.176   3.753   7.133
  450    HG3  ARG  53           2HG      ARG  53  -4.632   4.566   6.508
  451    HD2  ARG  53           1HD      ARG  53  -5.522   2.465   5.777
  452    HD3  ARG  53           2HD      ARG  53  -4.045   1.630   6.310
  453    HE   ARG  53           HE       ARG  53  -5.457   2.938   8.561
  454   HH11  ARG  53          1HH1      ARG  53  -5.354   0.064   6.590
  455   HH12  ARG  53          2HH1      ARG  53  -6.067  -0.865   7.895
  456   HH21  ARG  53          1HH2      ARG  53  -6.281   1.891  10.061
  457   HH22  ARG  53          2HH2      ARG  53  -6.598   0.178   9.875
  458    H    LYS  54           H        LYS  54  -3.550   6.578   3.385
  459    HA   LYS  54           HA       LYS  54  -4.626   8.359   5.443
  460    HB2  LYS  54           1HB      LYS  54  -3.530  10.354   4.741
  461    HB3  LYS  54           2HB      LYS  54  -2.309   9.160   5.243
  462    HG2  LYS  54           1HG      LYS  54  -1.817   8.650   2.896
  463    HG3  LYS  54           2HG      LYS  54  -3.067   9.804   2.372
  464    HD2  LYS  54           1HD      LYS  54  -1.824  11.638   3.449
  465    HD3  LYS  54           2HD      LYS  54  -0.572  10.484   3.966
  466    HE2  LYS  54           1HE      LYS  54  -0.088   9.950   1.619
  467    HE3  LYS  54           2HE      LYS  54  -1.343  11.096   1.096
  468    HZ1  LYS  54           3HZ      LYS  54   1.097  11.795   2.600
  469    HZ2  LYS  54           1HZ      LYS  54   0.849  12.070   0.993
  470    HZ3  LYS  54           2HZ      LYS  54  -0.067  12.859   2.116
  471    H    TRP  55           H        TRP  55  -6.028   9.985   4.617
  472    HA   TRP  55           HA       TRP  55  -7.269   9.104   2.053
  473    HB2  TRP  55           1HB      TRP  55  -8.263  10.843   4.349
  474    HB3  TRP  55           2HB      TRP  55  -9.163  10.595   2.833
  475    HD1  TRP  55           HD       TRP  55  -8.131   8.936   5.968
  476    HE1  TRP  55           1HE      TRP  55  -9.578   6.680   6.320
  477    HE3  TRP  55           3HE      TRP  55 -10.407   8.809   1.425
  478    HZ2  TRP  55           2HZ      TRP  55 -11.362   5.229   4.787
  479    HZ3  TRP  55           3HZ      TRP  55 -11.945   7.024   0.887
  480    HH2  TRP  55           HH       TRP  55 -12.458   5.238   2.494
  481    H    ARG  56           H        ARG  56  -7.030  10.134   0.243
  482    HA   ARG  56           HA       ARG  56  -6.437  13.073   0.360
  483    HB2  ARG  56           1HB      ARG  56  -4.453  11.883  -0.265
  484    HB3  ARG  56           2HB      ARG  56  -5.330  11.124  -1.613
  485    HG2  ARG  56           1HG      ARG  56  -5.617  13.247  -2.707
  486    HG3  ARG  56           2HG      ARG  56  -4.958  14.116  -1.301
  487    HD2  ARG  56           1HD      ARG  56  -3.352  14.054  -3.054
  488    HD3  ARG  56           2HD      ARG  56  -2.800  13.048  -1.693
  489    HE   ARG  56           HE       ARG  56  -3.053  11.070  -3.199
  490   HH11  ARG  56          1HH1      ARG  56  -4.073  14.014  -4.764
  491   HH12  ARG  56          2HH1      ARG  56  -3.989  13.221  -6.325
  492   HH21  ARG  56          1HH2      ARG  56  -2.962  10.145  -4.979
  493   HH22  ARG  56          2HH2      ARG  56  -3.356  11.014  -6.448
  494    H    HIS  57           H        HIS  57  -7.756  14.357  -0.661
  495    HA   HIS  57           HA       HIS  57  -9.971  13.199  -2.221
  496    HB2  HIS  57           1HB      HIS  57 -10.272  15.129  -0.591
  497    HB3  HIS  57           2HB      HIS  57  -9.346  16.139  -1.725
  498    HD1  HIS  57           1HD      HIS  57 -10.444  16.112  -4.281
  499    HD2  HIS  57           2HD      HIS  57 -13.036  15.205  -1.085
  500    HE1  HIS  57           1HE      HIS  57 -12.703  16.565  -5.096
  501    H    PHE  58           H        PHE  58  -9.696  12.613  -4.223
  502    HA   PHE  58           HA       PHE  58  -8.924  14.695  -6.146
  503    HB2  PHE  58           1HB      PHE  58  -7.216  13.322  -7.282
  504    HB3  PHE  58           2HB      PHE  58  -6.715  13.674  -5.614
  505    HD1  PHE  58           2HD      PHE  58  -6.711  11.938  -3.921
  506    HD2  PHE  58           1HD      PHE  58  -7.706  11.110  -7.992
  507    HE1  PHE  58           2HE      PHE  58  -6.362   9.524  -3.513
  508    HE2  PHE  58           1HE      PHE  58  -7.363   8.695  -7.587
  509    HZ   PHE  58           HZ       PHE  58  -6.690   7.902  -5.348
  510    H    SER  59           H        SER  59  -9.458  14.203  -8.309
  511    HA   SER  59           HA       SER  59 -10.975  13.332  -9.934
  512    HB2  SER  59           1HB      SER  59 -10.794  10.875  -8.296
  513    HB3  SER  59           2HB      SER  59 -11.495  11.061  -9.920
  514    HG   SER  59           HG       SER  59  -9.329  10.321  -9.967
  515    H    GLY  60           H        GLY  60 -11.811  14.545  -7.165
  516    HA2  GLY  60           1HA      GLY  60 -13.955  15.450  -6.756
  517    HA3  GLY  60           2HA      GLY  60 -14.678  14.182  -7.773
  518    H    ARG  61           H        ARG  61 -12.515  12.620  -5.853
  519    HA   ARG  61           HA       ARG  61 -14.438  12.181  -3.616
  520    HB2  ARG  61           1HB      ARG  61 -13.492  10.010  -5.434
  521    HB3  ARG  61           2HB      ARG  61 -14.310   9.789  -3.869
  522    HG2  ARG  61           1HG      ARG  61 -15.520  11.283  -6.210
  523    HG3  ARG  61           2HG      ARG  61 -15.787   9.551  -5.900
  524    HD2  ARG  61           1HD      ARG  61 -16.712  10.153  -3.701
  525    HD3  ARG  61           2HD      ARG  61 -16.571  11.866  -4.162
  526    HE   ARG  61           HE       ARG  61 -18.678  10.028  -5.199
  527   HH11  ARG  61          1HH1      ARG  61 -17.083  13.111  -5.523
  528   HH12  ARG  61          2HH1      ARG  61 -18.433  13.718  -6.463
  529   HH21  ARG  61          1HH2      ARG  61 -20.235  10.710  -6.268
  530   HH22  ARG  61          2HH2      ARG  61 -20.231  12.349  -6.890
  531    H    LYS  62           H        LYS  62 -13.595  11.156  -1.797
  532    HA   LYS  62           HA       LYS  62 -10.650  11.424  -1.536
  533    HB2  LYS  62           1HB      LYS  62 -12.856  10.816   0.435
  534    HB3  LYS  62           2HB      LYS  62 -11.125  10.869   0.846
  535    HG2  LYS  62           1HG      LYS  62 -11.037  13.237   0.180
  536    HG3  LYS  62           2HG      LYS  62 -12.767  13.186  -0.232
  537    HD2  LYS  62           1HD      LYS  62 -13.312  12.639   2.106
  538    HD3  LYS  62           2HD      LYS  62 -11.582  12.685   2.519
  539    HE2  LYS  62           1HE      LYS  62 -11.480  15.048   1.864
  540    HE3  LYS  62           2HE      LYS  62 -13.205  15.007   1.432
  541    HZ1  LYS  62           3HZ      LYS  62 -12.104  14.560   4.132
  542    HZ2  LYS  62           1HZ      LYS  62 -12.859  15.934   3.620
  543    HZ3  LYS  62           2HZ      LYS  62 -13.704  14.521   3.730
  544    H    TYR  63           H        TYR  63  -9.263   9.852  -1.645
  545    HA   TYR  63           HA       TYR  63 -10.277   7.047  -1.305
  546    HB2  TYR  63           1HB      TYR  63  -8.110   8.076  -3.147
  547    HB3  TYR  63           2HB      TYR  63  -8.514   6.364  -2.872
  548    HD1  TYR  63           2HD      TYR  63 -10.560   5.406  -3.801
  549    HD2  TYR  63           1HD      TYR  63  -9.574   9.498  -4.482
  550    HE1  TYR  63           2HE      TYR  63 -12.263   5.508  -5.591
  551    HE2  TYR  63           1HE      TYR  63 -11.276   9.617  -6.279
  552    HH   TYR  63           HH       TYR  63 -13.275   6.801  -7.169
  553    H    ARG  64           H        ARG  64  -9.137   5.642  -0.117
  554    HA   ARG  64           HA       ARG  64  -7.063   6.809   1.644
  555    HB2  ARG  64           1HB      ARG  64  -8.974   5.364   2.411
  556    HB3  ARG  64           2HB      ARG  64  -8.042   4.006   1.735
  557    HG2  ARG  64           1HG      ARG  64  -6.171   4.523   3.215
  558    HG3  ARG  64           2HG      ARG  64  -7.048   5.932   3.859
  559    HD2  ARG  64           1HD      ARG  64  -7.101   4.081   5.387
  560    HD3  ARG  64           2HD      ARG  64  -8.729   4.468   4.784
  561    HE   ARG  64           HE       ARG  64  -7.302   2.047   3.666
  562   HH11  ARG  64          1HH1      ARG  64 -10.039   3.458   5.301
  563   HH12  ARG  64          2HH1      ARG  64 -10.926   1.957   5.125
  564   HH21  ARG  64          1HH2      ARG  64  -8.301   0.318   3.465
  565   HH22  ARG  64          2HH2      ARG  64  -9.936   0.165   4.080
  566    H    GLU  65           H        GLU  65  -5.177   7.062   0.670
  567    HA   GLU  65           HA       GLU  65  -4.159   4.928  -1.122
  568    HB2  GLU  65           1HB      GLU  65  -3.029   7.617  -0.328
  569    HB3  GLU  65           2HB      GLU  65  -2.314   6.498  -1.514
  570    HG2  GLU  65           1HG      GLU  65  -4.473   6.774  -2.909
  571    HG3  GLU  65           2HG      GLU  65  -4.920   7.950  -1.651
  572    H    TYR  66           H        TYR  66  -2.228   3.857  -0.881
  573    HA   TYR  66           HA       TYR  66  -1.223   3.771   1.949
  574    HB2  TYR  66           1HB      TYR  66  -1.410   1.586  -0.133
  575    HB3  TYR  66           2HB      TYR  66  -0.580   1.436   1.435
  576    HD1  TYR  66           1HD      TYR  66  -3.887   1.832  -0.197
  577    HD2  TYR  66           2HD      TYR  66  -1.822   1.073   3.456
  578    HE1  TYR  66           1HE      TYR  66  -6.024   1.165   0.863
  579    HE2  TYR  66           2HE      TYR  66  -3.945   0.402   4.530
  580    HH   TYR  66           HH       TYR  66  -6.171  -0.219   4.094
  581    H    CYS  67           H        CYS  67   0.846   4.028   2.356
  582    HA   CYS  67           HA       CYS  67   2.772   4.233   0.024
  583    HB2  CYS  67           1HB      CYS  67   1.745   6.414   0.594
  584    HB3  CYS  67           2HB      CYS  67   2.214   6.190   2.297
  585    HG   CYS  67           HG       CYS  67   3.617   8.010   1.219
  586    H    LEU  68           H        LEU  68   4.730   3.395   0.443
  587    HA   LEU  68           HA       LEU  68   5.209   1.814   2.779
  588    HB2  LEU  68           1HB      LEU  68   6.155   1.497   0.655
  589    HB3  LEU  68           2HB      LEU  68   7.212   2.925   0.736
  590    HG   LEU  68           HG       LEU  68   8.316   1.921   2.745
  591   HD11  LEU  68          1HD1      LEU  68   7.963  -0.528   3.163
  592   HD12  LEU  68          2HD1      LEU  68   6.462   0.393   3.411
  593   HD13  LEU  68          3HD1      LEU  68   6.696  -0.542   1.915
  594   HD21  LEU  68          3HD2      LEU  68   9.338   1.739   0.555
  595   HD22  LEU  68          1HD2      LEU  68   9.642   0.255   1.490
  596   HD23  LEU  68          2HD2      LEU  68   8.406   0.263   0.209
  597    H    LYS  69           H        LYS  69   5.732   2.306   4.753
  598    HA   LYS  69           HA       LYS  69   6.115   5.163   5.360
  599    HB2  LYS  69           1HB      LYS  69   4.532   3.697   6.595
  600    HB3  LYS  69           2HB      LYS  69   5.929   2.779   7.206
  601    HG2  LYS  69           1HG      LYS  69   6.761   4.760   8.366
  602    HG3  LYS  69           2HG      LYS  69   5.428   5.734   7.699
  603    HD2  LYS  69           1HD      LYS  69   3.802   4.291   8.878
  604    HD3  LYS  69           2HD      LYS  69   5.149   3.359   9.571
  605    HE2  LYS  69           1HE      LYS  69   5.983   5.394  10.677
  606    HE3  LYS  69           2HE      LYS  69   4.627   6.318   9.991
  607    HZ1  LYS  69           3HZ      LYS  69   4.385   4.054  11.867
  608    HZ2  LYS  69           1HZ      LYS  69   4.192   5.645  12.256
  609    HZ3  LYS  69           2HZ      LYS  69   3.126   4.911  11.232
  610    H    HIS  70           H        HIS  70   7.930   6.152   5.693
  611    HA   HIS  70           HA       HIS  70  10.276   4.531   6.618
  612    HB2  HIS  70           1HB      HIS  70  10.286   6.834   4.613
  613    HB3  HIS  70           2HB      HIS  70  11.729   6.021   5.265
  614    HD1  HIS  70           1HD      HIS  70  11.829   3.346   4.704
  615    HD2  HIS  70           2HD      HIS  70   9.298   5.655   2.248
  616    HE1  HIS  70           1HE      HIS  70  11.516   2.054   2.655
  617    H    ARG  71           H        ARG  71  12.005   5.874   7.604
  618    HA   ARG  71           HA       ARG  71  10.955   7.692   9.605
  619    HB2  ARG  71           1HB      ARG  71  12.892   6.318   9.988
  620    HB3  ARG  71           2HB      ARG  71  13.784   7.246   8.759
  621    HG2  ARG  71           1HG      ARG  71  13.570   9.274  10.106
  622    HG3  ARG  71           2HG      ARG  71  12.617   8.385  11.319
  623    HD2  ARG  71           1HD      ARG  71  14.515   7.028  11.856
  624    HD3  ARG  71           2HD      ARG  71  15.474   7.827  10.587
  625    HE   ARG  71           HE       ARG  71  14.700   9.855  12.499
  626   HH11  ARG  71          1HH1      ARG  71  16.691   6.994  12.409
  627   HH12  ARG  71          2HH1      ARG  71  17.747   7.684  13.626
  628   HH21  ARG  71          1HH2      ARG  71  15.895  10.656  13.898
  629   HH22  ARG  71          2HH2      ARG  71  17.293   9.772  14.477
  630    H    ASP  72           H        ASP  72  11.137   9.869   9.834
  631    HA   ASP  72           HA       ASP  72  10.584  11.440   7.563
  632    HB2  ASP  72           1HB      ASP  72  11.746  12.315  10.276
  633    HB3  ASP  72           2HB      ASP  72  11.254  13.314   8.885
  634    H    GLU  73           H        GLU  73  13.713  10.864   9.145
  635    HA   GLU  73           HA       GLU  73  15.206  12.618   7.407
  636    HB2  GLU  73           1HB      GLU  73  15.988  10.213   9.056
  637    HB3  GLU  73           2HB      GLU  73  17.146  11.222   8.154
  638    HG2  GLU  73           1HG      GLU  73  16.496  13.205   9.587
  639    HG3  GLU  73           2HG      GLU  73  15.297  12.119  10.325
  640    H    LEU  74           H        LEU  74  14.423   9.158   7.257
  641    HA   LEU  74           HA       LEU  74  16.019   8.634   4.916
  642    HB2  LEU  74           1HB      LEU  74  13.625   7.417   6.115
  643    HB3  LEU  74           2HB      LEU  74  14.400   6.599   4.740
  644    HG   LEU  74           HG       LEU  74  15.661   7.141   7.456
  645   HD11  LEU  74          1HD1      LEU  74  15.599   4.645   7.698
  646   HD12  LEU  74          2HD1      LEU  74  13.963   5.317   7.502
  647   HD13  LEU  74          3HD1      LEU  74  14.773   4.529   6.127
  648   HD21  LEU  74          3HD2      LEU  74  17.297   7.261   5.671
  649   HD22  LEU  74          1HD2      LEU  74  17.546   5.779   6.624
  650   HD23  LEU  74          2HD2      LEU  74  16.755   5.691   5.030
  651    H    ALA  75           H        ALA  75  12.697   9.739   5.374
  652    HA   ALA  75           HA       ALA  75  11.961   9.542   2.600
  653    HB1  ALA  75           1HB      ALA  75  10.110  11.047   3.217
  654    HB2  ALA  75           2HB      ALA  75  10.290   9.718   4.386
  655    HB3  ALA  75           3HB      ALA  75  10.882  11.347   4.791
  656    H    ASP  76           H        ASP  76  13.446  12.100   4.552
  657    HA   ASP  76           HA       ASP  76  13.474  14.082   2.448
  658    HB2  ASP  76           1HB      ASP  76  15.233  13.774   4.956
  659    HB3  ASP  76           2HB      ASP  76  15.287  15.028   3.691
  660    H    LEU  77           H        LEU  77  15.660  11.462   3.352
  661    HA   LEU  77           HA       LEU  77  17.746  12.209   1.489
  662    HB2  LEU  77           1HB      LEU  77  16.891   9.723   2.802
  663    HB3  LEU  77           2HB      LEU  77  18.367   9.688   1.811
  664    HG   LEU  77           HG       LEU  77  17.925  11.393   4.292
  665   HD11  LEU  77          1HD1      LEU  77  19.640   9.888   5.335
  666   HD12  LEU  77          2HD1      LEU  77  18.204   8.973   4.821
  667   HD13  LEU  77          3HD1      LEU  77  19.687   8.929   3.837
  668   HD21  LEU  77          3HD2      LEU  77  19.373  12.479   2.679
  669   HD22  LEU  77          1HD2      LEU  77  20.325  11.934   4.079
  670   HD23  LEU  77          2HD2      LEU  77  20.379  11.017   2.554
  671    H    GLU  78           H        GLU  78  14.879  10.145   1.262
  672    HA   GLU  78           HA       GLU  78  15.431   9.290  -1.459
  673    HB2  GLU  78           1HB      GLU  78  12.924   9.412   0.218
  674    HB3  GLU  78           2HB      GLU  78  12.963   8.788  -1.450
  675    HG2  GLU  78           1HG      GLU  78  14.578   6.980  -0.698
  676    HG3  GLU  78           2HG      GLU  78  14.506   7.764   0.897
  677    H    HIS  79           H        HIS  79  13.754  12.037  -0.017
  678    HA   HIS  79           HA       HIS  79  12.572  13.006  -2.453
  679    HB2  HIS  79           1HB      HIS  79  11.993  13.754  -0.077
  680    HB3  HIS  79           2HB      HIS  79  13.495  14.710  -0.105
  681    HD2  HIS  79           2HD      HIS  79   9.768  15.034  -1.293
  682    HE1  HIS  79           1HE      HIS  79  12.045  18.234  -2.912
  683    HE2  HIS  79           2HE      HIS  79   9.654  17.228  -2.491
  Start of MODEL    7
    1    H    LYS   3           H        LYS   3   4.685 -13.501  -9.878
    2    HA   LYS   3           HA       LYS   3   5.359 -11.330  -8.185
    3    HB2  LYS   3           1HB      LYS   3   2.884 -10.924  -9.868
    4    HB3  LYS   3           2HB      LYS   3   3.240 -10.040  -8.366
    5    HG2  LYS   3           1HG      LYS   3   5.267  -9.099  -9.389
    6    HG3  LYS   3           2HG      LYS   3   4.927  -9.994 -10.891
    7    HD2  LYS   3           1HD      LYS   3   2.771  -8.773 -11.094
    8    HD3  LYS   3           2HD      LYS   3   3.195  -7.834  -9.643
    9    HE2  LYS   3           1HE      LYS   3   5.109  -6.873 -10.745
   10    HE3  LYS   3           2HE      LYS   3   4.888  -7.936 -12.153
   11    HZ1  LYS   3           3HZ      LYS   3   3.011  -5.833 -11.283
   12    HZ2  LYS   3           1HZ      LYS   3   4.042  -5.728 -12.566
   13    HZ3  LYS   3           2HZ      LYS   3   2.807  -6.820 -12.589
   14    H    ALA   4           H        ALA   4   2.993 -13.685  -9.266
   15    HA   ALA   4           HA       ALA   4   1.437 -13.703  -6.853
   16    HB1  ALA   4           1HB      ALA   4   0.586 -15.863  -7.680
   17    HB2  ALA   4           2HB      ALA   4   0.601 -14.631  -8.964
   18    HB3  ALA   4           3HB      ALA   4   1.859 -15.888  -8.922
   19    H    LYS   5           H        LYS   5   4.509 -15.079  -7.694
   20    HA   LYS   5           HA       LYS   5   4.630 -17.072  -5.610
   21    HB2  LYS   5           1HB      LYS   5   6.755 -15.491  -7.057
   22    HB3  LYS   5           2HB      LYS   5   7.101 -16.784  -5.884
   23    HG2  LYS   5           1HG      LYS   5   5.923 -18.403  -7.313
   24    HG3  LYS   5           2HG      LYS   5   5.564 -17.112  -8.484
   25    HD2  LYS   5           1HD      LYS   5   7.975 -16.763  -8.844
   26    HD3  LYS   5           2HD      LYS   5   8.336 -18.053  -7.672
   27    HE2  LYS   5           1HE      LYS   5   7.174 -19.682  -9.084
   28    HE3  LYS   5           2HE      LYS   5   6.777 -18.398 -10.251
   29    HZ1  LYS   5           3HZ      LYS   5   9.498 -19.293  -9.547
   30    HZ2  LYS   5           1HZ      LYS   5   8.698 -19.664 -10.940
   31    HZ3  LYS   5           2HZ      LYS   5   9.131 -18.102 -10.628
   32    H    LEU   6           H        LEU   6   5.027 -13.605  -5.637
   33    HA   LEU   6           HA       LEU   6   6.136 -13.612  -2.893
   34    HB2  LEU   6           1HB      LEU   6   5.207 -11.486  -4.711
   35    HB3  LEU   6           2HB      LEU   6   6.059 -11.089  -3.201
   36    HG   LEU   6           HG       LEU   6   7.207 -12.534  -5.622
   37   HD11  LEU   6          1HD1      LEU   6   8.694 -10.519  -5.771
   38   HD12  LEU   6          2HD1      LEU   6   6.979 -10.068  -5.912
   39   HD13  LEU   6          3HD1      LEU   6   7.846  -9.808  -4.379
   40   HD21  LEU   6          3HD2      LEU   6   8.105 -13.456  -3.567
   41   HD22  LEU   6          1HD2      LEU   6   9.352 -12.495  -4.397
   42   HD23  LEU   6          2HD2      LEU   6   8.510 -11.827  -2.979
   43    H    SER   7           H        SER   7   5.171 -12.550  -1.132
   44    HA   SER   7           HA       SER   7   2.347 -13.225  -0.750
   45    HB2  SER   7           1HB      SER   7   2.570 -12.537   1.374
   46    HB3  SER   7           2HB      SER   7   4.083 -13.363   0.936
   47    HG   SER   7           HG       SER   7   4.500 -11.453   2.069
   48    H    LEU   8           H        LEU   8   0.744 -11.674  -0.030
   49    HA   LEU   8           HA       LEU   8   0.385  -9.445  -1.788
   50    HB2  LEU   8           1HB      LEU   8  -1.377 -10.514  -0.847
   51    HB3  LEU   8           2HB      LEU   8  -0.953 -10.219   0.856
   52    HG   LEU   8           HG       LEU   8  -1.299  -7.789   0.496
   53   HD11  LEU   8          1HD1      LEU   8  -2.460  -7.041  -1.599
   54   HD12  LEU   8          2HD1      LEU   8  -0.866  -7.747  -1.959
   55   HD13  LEU   8          3HD1      LEU   8  -2.343  -8.699  -2.235
   56   HD21  LEU   8          3HD2      LEU   8  -3.098  -9.134   1.408
   57   HD22  LEU   8          1HD2      LEU   8  -3.765  -7.856   0.365
   58   HD23  LEU   8          2HD2      LEU   8  -3.670  -9.532  -0.230
   59    H    THR   9           H        THR   9   1.514  -9.601   1.584
   60    HA   THR   9           HA       THR   9   1.853  -6.787   1.944
   61    HB   THR   9           HB       THR   9   3.445  -9.092   3.142
   62    HG1  THR   9           1HG      THR   9   1.971  -8.727   4.904
   63   HG21  THR   9          3HG2      THR   9   3.151  -6.195   4.028
   64   HG22  THR   9          1HG2      THR   9   4.012  -7.472   4.917
   65   HG23  THR   9          2HG2      THR   9   4.619  -6.927   3.335
   66    H    GLN  10           H        GLN  10   4.100  -9.251   0.696
   67    HA   GLN  10           HA       GLN  10   6.323  -7.468   0.391
   68    HB2  GLN  10           1HB      GLN  10   5.516 -10.042  -0.960
   69    HB3  GLN  10           2HB      GLN  10   7.012  -9.172  -1.376
   70    HG2  GLN  10           1HG      GLN  10   7.837  -9.599   1.120
   71    HG3  GLN  10           2HG      GLN  10   6.136 -10.109   1.215
   72   HE21  GLN  10          2HE2      GLN  10   8.680 -11.538   1.837
   73   HE22  GLN  10          1HE2      GLN  10   8.635 -12.986   0.888
   74    H    LEU  11           H        LEU  11   3.721  -8.397  -1.846
   75    HA   LEU  11           HA       LEU  11   4.772  -6.935  -4.089
   76    HB2  LEU  11           1HB      LEU  11   2.108  -7.835  -3.238
   77    HB3  LEU  11           2HB      LEU  11   2.262  -7.072  -4.838
   78    HG   LEU  11           HG       LEU  11   3.639  -9.631  -3.930
   79   HD11  LEU  11          1HD1      LEU  11   2.141 -10.736  -5.611
   80   HD12  LEU  11          2HD1      LEU  11   1.198  -9.926  -4.338
   81   HD13  LEU  11          3HD1      LEU  11   1.374  -9.164  -5.938
   82   HD21  LEU  11          3HD2      LEU  11   5.007  -8.369  -5.485
   83   HD22  LEU  11          1HD2      LEU  11   4.363  -9.823  -6.285
   84   HD23  LEU  11          2HD2      LEU  11   3.642  -8.230  -6.619
   85    H    ILE  12           H        ILE  12   2.510  -6.048  -1.503
   86    HA   ILE  12           HA       ILE  12   1.933  -3.402  -2.479
   87    HB   ILE  12           HB       ILE  12   1.997  -4.573   0.337
   88   HG12  ILE  12          1HG1      ILE  12  -0.352  -3.768  -1.352
   89   HG13  ILE  12          2HG1      ILE  12   0.338  -5.408  -1.331
   90   HG21  ILE  12          1HG2      ILE  12   0.782  -2.537   1.034
   91   HG22  ILE  12          2HG2      ILE  12   2.401  -2.135   0.420
   92   HG23  ILE  12          3HG2      ILE  12   0.971  -1.862  -0.603
   93   HD11  ILE  12          3HD1      ILE  12  -0.819  -3.935   1.062
   94   HD12  ILE  12          1HD1      ILE  12  -1.615  -5.246   0.161
   95   HD13  ILE  12          2HD1      ILE  12  -0.129  -5.575   1.083
   96    H    LEU  13           H        LEU  13   4.503  -4.582  -0.334
   97    HA   LEU  13           HA       LEU  13   5.596  -1.969   0.163
   98    HB2  LEU  13           1HB      LEU  13   6.692  -4.699   0.163
   99    HB3  LEU  13           2HB      LEU  13   7.695  -3.370   0.787
  100    HG   LEU  13           HG       LEU  13   5.028  -4.294   1.925
  101   HD11  LEU  13          1HD1      LEU  13   6.408  -5.033   3.886
  102   HD12  LEU  13          2HD1      LEU  13   6.896  -5.875   2.398
  103   HD13  LEU  13          3HD1      LEU  13   7.878  -4.529   3.022
  104   HD21  LEU  13          3HD2      LEU  13   5.341  -1.904   2.184
  105   HD22  LEU  13          1HD2      LEU  13   5.503  -2.711   3.761
  106   HD23  LEU  13          2HD2      LEU  13   6.955  -2.161   2.888
  107    H    ILE  14           H        ILE  14   6.200  -4.385  -2.345
  108    HA   ILE  14           HA       ILE  14   8.497  -3.046  -3.493
  109    HB   ILE  14           HB       ILE  14   6.462  -5.001  -4.649
  110   HG12  ILE  14          1HG1      ILE  14   9.356  -5.417  -3.968
  111   HG13  ILE  14          2HG1      ILE  14   8.017  -5.737  -2.843
  112   HG21  ILE  14          1HG2      ILE  14   8.015  -5.237  -6.555
  113   HG22  ILE  14          2HG2      ILE  14   7.386  -3.577  -6.444
  114   HG23  ILE  14          3HG2      ILE  14   9.035  -3.942  -5.886
  115   HD11  ILE  14          3HD1      ILE  14   8.422  -7.059  -5.549
  116   HD12  ILE  14          1HD1      ILE  14   8.748  -7.804  -3.968
  117   HD13  ILE  14          2HD1      ILE  14   7.081  -7.380  -4.426
  118    H    ARG  15           H        ARG  15   5.035  -2.906  -4.282
  119    HA   ARG  15           HA       ARG  15   5.406  -1.086  -6.490
  120    HB2  ARG  15           1HB      ARG  15   3.472  -2.442  -6.344
  121    HB3  ARG  15           2HB      ARG  15   2.988  -1.640  -4.830
  122    HG2  ARG  15           1HG      ARG  15   1.679  -0.780  -6.696
  123    HG3  ARG  15           2HG      ARG  15   2.745   0.489  -6.043
  124    HD2  ARG  15           1HD      ARG  15   4.307   0.063  -7.873
  125    HD3  ARG  15           2HD      ARG  15   3.158  -1.118  -8.544
  126    HE   ARG  15           HE       ARG  15   1.790   1.422  -8.418
  127   HH11  ARG  15          1HH1      ARG  15   4.530   0.048 -10.083
  128   HH12  ARG  15          2HH1      ARG  15   4.243   1.115 -11.444
  129   HH21  ARG  15          1HH2      ARG  15   1.455   2.654  -9.965
  130   HH22  ARG  15          2HH2      ARG  15   2.491   2.601 -11.379
  131    H    LEU  16           H        LEU  16   4.803  -0.607  -3.035
  132    HA   LEU  16           HA       LEU  16   4.464   2.282  -3.351
  133    HB2  LEU  16           1HB      LEU  16   4.881   0.436  -1.098
  134    HB3  LEU  16           2HB      LEU  16   4.637   2.163  -0.751
  135    HG   LEU  16           HG       LEU  16   2.650   0.266  -2.060
  136   HD11  LEU  16          1HD1      LEU  16   1.283   0.725  -0.006
  137   HD12  LEU  16          2HD1      LEU  16   2.852  -0.006   0.411
  138   HD13  LEU  16          3HD1      LEU  16   2.598   1.744   0.623
  139   HD21  LEU  16          3HD2      LEU  16   2.508   2.476  -3.050
  140   HD22  LEU  16          1HD2      LEU  16   1.084   2.178  -2.025
  141   HD23  LEU  16          2HD2      LEU  16   2.401   3.223  -1.439
  142    H    SER  17           H        SER  17   7.129   0.131  -3.027
  143    HA   SER  17           HA       SER  17   9.053   2.244  -2.168
  144    HB2  SER  17           1HB      SER  17  10.663   0.646  -2.217
  145    HB3  SER  17           2HB      SER  17   9.233  -0.008  -1.387
  146    HG   SER  17           HG       SER  17  10.171  -1.499  -2.850
  147    H    ASN  18           H        ASN  18   7.724   0.827  -5.089
  148    HA   ASN  18           HA       ASN  18   9.912   1.879  -6.786
  149    HB2  ASN  18           1HB      ASN  18   7.350   0.353  -7.682
  150    HB3  ASN  18           2HB      ASN  18   8.657   1.235  -8.509
  151   HD21  ASN  18          2HD2      ASN  18   7.803  -1.637  -8.442
  152   HD22  ASN  18          1HD2      ASN  18   9.248  -2.516  -8.065
  153    H    ARG  19           H        ARG  19   7.057   3.044  -5.392
  154    HA   ARG  19           HA       ARG  19   7.209   5.424  -7.193
  155    HB2  ARG  19           1HB      ARG  19   4.675   4.077  -6.371
  156    HB3  ARG  19           2HB      ARG  19   4.815   5.676  -7.136
  157    HG2  ARG  19           1HG      ARG  19   5.818   3.111  -8.397
  158    HG3  ARG  19           2HG      ARG  19   4.200   3.790  -8.692
  159    HD2  ARG  19           1HD      ARG  19   5.269   5.832  -9.533
  160    HD3  ARG  19           2HD      ARG  19   6.850   5.037  -9.344
  161    HE   ARG  19           HE       ARG  19   4.917   4.405 -11.535
  162   HH11  ARG  19          1HH1      ARG  19   7.879   3.566  -9.901
  163   HH12  ARG  19          2HH1      ARG  19   8.363   2.583 -11.270
  164   HH21  ARG  19          1HH2      ARG  19   5.460   3.292 -13.115
  165   HH22  ARG  19          2HH2      ARG  19   6.984   2.428 -13.104
  166    H    GLY  20           H        GLY  20   5.801   7.237  -6.230
  167    HA2  GLY  20           1HA      GLY  20   6.855   7.730  -3.553
  168    HA3  GLY  20           2HA      GLY  20   5.870   8.837  -4.534
  169    H    CYS  21           H        CYS  21   3.660   7.163  -5.022
  170    HA   CYS  21           HA       CYS  21   2.458   6.342  -2.439
  171    HB2  CYS  21           1HB      CYS  21   2.693   8.825  -2.295
  172    HB3  CYS  21           2HB      CYS  21   1.750   8.978  -3.799
  173    HG   CYS  21           HG       CYS  21   0.376   9.740  -1.803
  174    H    GLN  22           H        GLN  22   0.823   4.991  -2.860
  175    HA   GLN  22           HA       GLN  22  -0.579   5.211  -5.496
  176    HB2  GLN  22           1HB      GLN  22   0.493   2.738  -4.129
  177    HB3  GLN  22           2HB      GLN  22  -0.705   2.703  -5.443
  178    HG2  GLN  22           1HG      GLN  22   2.223   3.775  -5.873
  179    HG3  GLN  22           2HG      GLN  22   1.421   2.198  -6.060
  180   HE21  GLN  22          2HE2      GLN  22   0.832   5.646  -6.897
  181   HE22  GLN  22          1HE2      GLN  22   0.313   5.336  -8.520
  182    H    THR  23           H        THR  23  -2.658   4.167  -5.583
  183    HA   THR  23           HA       THR  23  -4.082   4.618  -3.004
  184    HB   THR  23           HB       THR  23  -6.107   4.759  -4.324
  185    HG1  THR  23           1HG      THR  23  -5.714   4.568  -6.744
  186   HG21  THR  23          3HG2      THR  23  -3.842   6.219  -5.741
  187   HG22  THR  23          1HG2      THR  23  -5.568   6.644  -5.826
  188   HG23  THR  23          2HG2      THR  23  -4.691   6.786  -4.283
  189    H    LEU  24           H        LEU  24  -6.037   3.230  -2.633
  190    HA   LEU  24           HA       LEU  24  -5.371   0.483  -2.352
  191    HB2  LEU  24           1HB      LEU  24  -7.002   1.553  -1.133
  192    HB3  LEU  24           2HB      LEU  24  -8.107   1.861  -2.494
  193    HG   LEU  24           HG       LEU  24  -8.250  -0.651  -2.800
  194   HD11  LEU  24          1HD1      LEU  24  -7.646  -2.045  -0.804
  195   HD12  LEU  24          2HD1      LEU  24  -6.214  -1.241  -1.489
  196   HD13  LEU  24          3HD1      LEU  24  -6.978  -0.599  -0.015
  197   HD21  LEU  24          3HD2      LEU  24 -10.047   0.619  -1.784
  198   HD22  LEU  24          1HD2      LEU  24  -9.884  -0.957  -0.972
  199   HD23  LEU  24          2HD2      LEU  24  -9.259   0.517  -0.191
  200    H    GLU  25           H        GLU  25  -7.070   2.169  -4.971
  201    HA   GLU  25           HA       GLU  25  -7.790  -0.288  -6.345
  202    HB2  GLU  25           1HB      GLU  25  -7.665   2.600  -7.213
  203    HB3  GLU  25           2HB      GLU  25  -8.241   1.272  -8.247
  204    HG2  GLU  25           1HG      GLU  25 -10.119   0.841  -6.607
  205    HG3  GLU  25           2HG      GLU  25  -9.371   2.110  -5.611
  206    H    GLU  26           H        GLU  26  -5.131   2.035  -6.636
  207    HA   GLU  26           HA       GLU  26  -3.938   0.794  -8.955
  208    HB2  GLU  26           1HB      GLU  26  -2.845   2.525  -6.738
  209    HB3  GLU  26           2HB      GLU  26  -1.862   1.944  -8.104
  210    HG2  GLU  26           1HG      GLU  26  -3.361   3.208  -9.698
  211    HG3  GLU  26           2HG      GLU  26  -4.340   3.608  -8.266
  212    H    LEU  27           H        LEU  27  -3.540   0.300  -5.466
  213    HA   LEU  27           HA       LEU  27  -1.465  -1.710  -5.786
  214    HB2  LEU  27           1HB      LEU  27  -3.379  -0.981  -3.676
  215    HB3  LEU  27           2HB      LEU  27  -2.177  -2.246  -3.334
  216    HG   LEU  27           HG       LEU  27  -1.581   0.658  -4.024
  217   HD11  LEU  27          1HD1      LEU  27  -0.769   0.792  -1.653
  218   HD12  LEU  27          2HD1      LEU  27  -2.494   0.365  -1.722
  219   HD13  LEU  27          3HD1      LEU  27  -1.279  -0.894  -1.401
  220   HD21  LEU  27          3HD2      LEU  27   0.124  -0.842  -4.874
  221   HD22  LEU  27          1HD2      LEU  27   0.762   0.081  -3.492
  222   HD23  LEU  27          2HD2      LEU  27   0.278  -1.619  -3.280
  223    H    GLU  28           H        GLU  28  -4.974  -1.750  -5.746
  224    HA   GLU  28           HA       GLU  28  -5.273  -4.615  -5.625
  225    HB2  GLU  28           1HB      GLU  28  -7.100  -3.015  -5.266
  226    HB3  GLU  28           2HB      GLU  28  -6.991  -2.528  -6.975
  227    HG2  GLU  28           1HG      GLU  28  -7.601  -4.964  -7.592
  228    HG3  GLU  28           2HG      GLU  28  -7.761  -5.178  -5.834
  229    H    GLU  29           H        GLU  29  -4.918  -2.353  -8.352
  230    HA   GLU  29           HA       GLU  29  -5.176  -4.446 -10.350
  231    HB2  GLU  29           1HB      GLU  29  -4.104  -1.627 -10.434
  232    HB3  GLU  29           2HB      GLU  29  -4.215  -2.689 -11.857
  233    HG2  GLU  29           1HG      GLU  29  -6.728  -2.760 -11.582
  234    HG3  GLU  29           2HG      GLU  29  -6.470  -1.806 -10.104
  235    H    PHE  30           H        PHE  30  -2.602  -3.350  -8.344
  236    HA   PHE  30           HA       PHE  30  -0.498  -4.504 -10.060
  237    HB2  PHE  30           1HB      PHE  30  -0.017  -2.539  -8.612
  238    HB3  PHE  30           2HB      PHE  30  -0.384  -3.520  -7.176
  239    HD1  PHE  30           1HD      PHE  30   1.933  -3.131 -10.030
  240    HD2  PHE  30           2HD      PHE  30   1.202  -4.946  -6.233
  241    HE1  PHE  30           1HE      PHE  30   4.292  -3.862  -9.928
  242    HE2  PHE  30           2HE      PHE  30   3.562  -5.676  -6.125
  243    HZ   PHE  30           HZ       PHE  30   5.107  -5.136  -7.975
  244    H    THR  31           H        THR  31  -1.880  -5.285  -6.847
  245    HA   THR  31           HA       THR  31  -0.198  -7.668  -6.676
  246    HB   THR  31           HB       THR  31  -1.304  -8.065  -4.542
  247    HG1  THR  31           1HG      THR  31  -3.028  -6.518  -3.955
  248   HG21  THR  31          3HG2      THR  31  -0.834  -5.089  -4.978
  249   HG22  THR  31          1HG2      THR  31  -0.849  -5.920  -3.405
  250   HG23  THR  31          2HG2      THR  31   0.419  -6.294  -4.598
  251    H    GLN  32           H        GLN  32  -3.304  -6.971  -7.973
  252    HA   GLN  32           HA       GLN  32  -4.925  -8.350  -8.904
  253    HB2  GLN  32           1HB      GLN  32  -3.129 -10.699  -8.331
  254    HB3  GLN  32           2HB      GLN  32  -4.392 -10.542  -9.574
  255    HG2  GLN  32           1HG      GLN  32  -1.535  -9.264  -9.775
  256    HG3  GLN  32           2HG      GLN  32  -2.485 -10.541 -10.571
  257   HE21  GLN  32          2HE2      GLN  32  -1.558  -7.287 -10.622
  258   HE22  GLN  32          1HE2      GLN  32  -2.696  -6.711 -11.793
  259    H    ALA  33           H        ALA  33  -4.227  -8.083  -5.853
  260    HA   ALA  33           HA       ALA  33  -5.616 -10.444  -4.789
  261    HB1  ALA  33           1HB      ALA  33  -5.222  -9.386  -2.598
  262    HB2  ALA  33           2HB      ALA  33  -3.724  -9.485  -3.554
  263    HB3  ALA  33           3HB      ALA  33  -4.589  -7.937  -3.414
  264    H    LYS  34           H        LYS  34  -7.546 -10.454  -3.644
  265    HA   LYS  34           HA       LYS  34  -9.649  -8.777  -4.643
  266    HB2  LYS  34           1HB      LYS  34  -9.904 -11.054  -3.669
  267    HB3  LYS  34           2HB      LYS  34  -9.568 -10.354  -2.068
  268    HG2  LYS  34           1HG      LYS  34 -11.566  -8.972  -2.205
  269    HG3  LYS  34           2HG      LYS  34 -11.882  -9.547  -3.861
  270    HD2  LYS  34           1HD      LYS  34 -12.118 -11.858  -2.986
  271    HD3  LYS  34           2HD      LYS  34 -11.875 -11.237  -1.335
  272    HE2  LYS  34           1HE      LYS  34 -13.868  -9.808  -1.591
  273    HE3  LYS  34           2HE      LYS  34 -14.117 -10.460  -3.227
  274    HZ1  LYS  34           3HZ      LYS  34 -14.181 -12.026  -0.729
  275    HZ2  LYS  34           1HZ      LYS  34 -15.499 -11.570  -1.607
  276    HZ3  LYS  34           2HZ      LYS  34 -14.411 -12.633  -2.246
  277    H    ARG  35           H        ARG  35 -10.527  -6.939  -4.036
  278    HA   ARG  35           HA       ARG  35  -9.004  -5.055  -2.581
  279    HB2  ARG  35           1HB      ARG  35 -10.729  -4.500  -4.184
  280    HB3  ARG  35           2HB      ARG  35 -11.958  -5.001  -3.001
  281    HG2  ARG  35           1HG      ARG  35 -11.297  -3.242  -1.484
  282    HG3  ARG  35           2HG      ARG  35  -9.927  -2.800  -2.532
  283    HD2  ARG  35           1HD      ARG  35 -12.848  -2.514  -3.158
  284    HD3  ARG  35           2HD      ARG  35 -11.704  -1.217  -2.740
  285    HE   ARG  35           HE       ARG  35 -10.671  -2.294  -5.146
  286   HH11  ARG  35          1HH1      ARG  35 -13.800  -1.066  -4.222
  287   HH12  ARG  35          2HH1      ARG  35 -14.076  -0.516  -5.863
  288   HH21  ARG  35          1HH2      ARG  35 -10.975  -1.680  -7.032
  289   HH22  ARG  35          2HH2      ARG  35 -12.465  -0.867  -7.467
  290    H    GLU  36           H        GLU  36 -11.547  -7.239  -1.457
  291    HA   GLU  36           HA       GLU  36 -12.003  -6.106   1.095
  292    HB2  GLU  36           1HB      GLU  36 -13.322  -7.921   0.124
  293    HB3  GLU  36           2HB      GLU  36 -11.931  -9.020   0.294
  294    HG2  GLU  36           1HG      GLU  36 -12.090  -8.754   2.821
  295    HG3  GLU  36           2HG      GLU  36 -13.429  -7.634   2.479
  296    H    VAL  37           H        VAL  37  -9.543  -8.506   0.135
  297    HA   VAL  37           HA       VAL  37  -8.457  -8.511   2.909
  298    HB   VAL  37           HB       VAL  37  -6.999 -10.287   2.120
  299   HG11  VAL  37          1HG1      VAL  37  -8.671 -11.961   1.402
  300   HG12  VAL  37          2HG1      VAL  37  -9.313 -10.931   2.703
  301   HG13  VAL  37          3HG1      VAL  37  -9.815 -10.653   1.018
  302   HG21  VAL  37          3HG2      VAL  37  -6.454  -9.385  -0.062
  303   HG22  VAL  37          1HG2      VAL  37  -7.018 -11.067  -0.195
  304   HG23  VAL  37          2HG2      VAL  37  -8.103  -9.727  -0.636
  305    H    LEU  38           H        LEU  38  -7.809  -7.040  -0.155
  306    HA   LEU  38           HA       LEU  38  -5.067  -6.329   0.352
  307    HB2  LEU  38           1HB      LEU  38  -5.943  -6.217  -1.733
  308    HB3  LEU  38           2HB      LEU  38  -7.252  -5.067  -1.382
  309    HG   LEU  38           HG       LEU  38  -5.470  -3.368  -0.805
  310   HD11  LEU  38          1HD1      LEU  38  -3.176  -3.796  -1.728
  311   HD12  LEU  38          2HD1      LEU  38  -3.598  -4.979  -0.468
  312   HD13  LEU  38          3HD1      LEU  38  -3.683  -5.438  -2.185
  313   HD21  LEU  38          3HD2      LEU  38  -6.666  -3.290  -2.913
  314   HD22  LEU  38          1HD2      LEU  38  -4.968  -2.812  -3.159
  315   HD23  LEU  38          2HD2      LEU  38  -5.516  -4.437  -3.641
  316    H    LEU  39           H        LEU  39  -8.119  -4.603   1.004
  317    HA   LEU  39           HA       LEU  39  -6.836  -2.307   2.171
  318    HB2  LEU  39           1HB      LEU  39  -8.992  -2.342   1.290
  319    HB3  LEU  39           2HB      LEU  39  -9.679  -3.400   2.544
  320    HG   LEU  39           HG       LEU  39  -9.101  -1.665   4.250
  321   HD11  LEU  39          1HD1      LEU  39  -8.579   0.647   3.429
  322   HD12  LEU  39          2HD1      LEU  39  -7.315  -0.509   2.952
  323   HD13  LEU  39          3HD1      LEU  39  -8.525   0.027   1.762
  324   HD21  LEU  39          3HD2      LEU  39 -11.355  -1.828   3.372
  325   HD22  LEU  39          1HD2      LEU  39 -10.942  -0.123   3.669
  326   HD23  LEU  39          2HD2      LEU  39 -10.933  -0.765   2.009
  327    H    VAL  40           H        VAL  40  -7.949  -5.375   3.513
  328    HA   VAL  40           HA       VAL  40  -7.552  -4.684   6.299
  329    HB   VAL  40           HB       VAL  40  -7.455  -7.352   4.833
  330   HG11  VAL  40          1HG1      VAL  40  -7.622  -8.371   7.081
  331   HG12  VAL  40          2HG1      VAL  40  -6.118  -7.433   6.912
  332   HG13  VAL  40          3HG1      VAL  40  -7.491  -6.758   7.821
  333   HG21  VAL  40          3HG2      VAL  40  -9.629  -6.286   4.774
  334   HG22  VAL  40          1HG2      VAL  40  -9.650  -7.708   5.845
  335   HG23  VAL  40          2HG2      VAL  40  -9.594  -6.070   6.542
  336    H    THR  41           H        THR  41  -5.388  -6.164   3.897
  337    HA   THR  41           HA       THR  41  -3.169  -6.440   5.701
  338    HB   THR  41           HB       THR  41  -3.196  -6.063   2.676
  339    HG1  THR  41           1HG      THR  41  -3.047  -8.408   4.310
  340   HG21  THR  41          3HG2      THR  41  -1.018  -7.091   4.539
  341   HG22  THR  41          1HG2      THR  41  -0.939  -7.063   2.761
  342   HG23  THR  41          2HG2      THR  41  -0.998  -5.536   3.674
  343    H    LEU  42           H        LEU  42  -4.167  -3.798   3.547
  344    HA   LEU  42           HA       LEU  42  -1.876  -2.138   4.090
  345    HB2  LEU  42           1HB      LEU  42  -4.658  -1.645   3.273
  346    HB3  LEU  42           2HB      LEU  42  -3.521  -0.277   3.289
  347    HG   LEU  42           HG       LEU  42  -3.274  -2.787   1.583
  348   HD11  LEU  42          1HD1      LEU  42  -3.741  -1.235  -0.333
  349   HD12  LEU  42          2HD1      LEU  42  -5.099  -1.271   0.816
  350   HD13  LEU  42          3HD1      LEU  42  -3.964   0.099   0.822
  351   HD21  LEU  42          3HD2      LEU  42  -1.112  -1.891   2.215
  352   HD22  LEU  42          1HD2      LEU  42  -1.411  -1.592   0.486
  353   HD23  LEU  42          2HD2      LEU  42  -1.589  -0.268   1.663
  354    H    THR  43           H        THR  43  -5.032  -2.477   5.660
  355    HA   THR  43           HA       THR  43  -4.646  -0.334   7.549
  356    HB   THR  43           HB       THR  43  -6.299  -2.884   7.778
  357    HG1  THR  43           1HG      THR  43  -7.998  -1.408   7.190
  358   HG21  THR  43          3HG2      THR  43  -6.398  -0.292   9.373
  359   HG22  THR  43          1HG2      THR  43  -7.533  -1.654   9.529
  360   HG23  THR  43          2HG2      THR  43  -5.826  -1.864   9.980
  361    H    ARG  44           H        ARG  44  -3.829  -3.786   7.628
  362    HA   ARG  44           HA       ARG  44  -2.863  -3.774  10.343
  363    HB2  ARG  44           1HB      ARG  44  -2.342  -5.589   8.039
  364    HB3  ARG  44           2HB      ARG  44  -1.601  -5.788   9.644
  365    HG2  ARG  44           1HG      ARG  44  -3.798  -6.042  10.661
  366    HG3  ARG  44           2HG      ARG  44  -4.585  -5.744   9.092
  367    HD2  ARG  44           1HD      ARG  44  -3.642  -7.776   8.218
  368    HD3  ARG  44           2HD      ARG  44  -2.803  -8.066   9.761
  369    HE   ARG  44           HE       ARG  44  -5.640  -8.022  10.317
  370   HH11  ARG  44          1HH1      ARG  44  -3.389  -9.976   8.509
  371   HH12  ARG  44          2HH1      ARG  44  -4.385 -11.391   8.785
  372   HH21  ARG  44          1HH2      ARG  44  -6.795  -9.631  10.637
  373   HH22  ARG  44          2HH2      ARG  44  -6.328 -11.196   9.998
  374    H    LEU  45           H        LEU  45  -1.283  -3.186   7.220
  375    HA   LEU  45           HA       LEU  45   1.356  -2.821   8.310
  376    HB2  LEU  45           1HB      LEU  45  -0.092  -1.839   5.949
  377    HB3  LEU  45           2HB      LEU  45   1.632  -1.430   6.105
  378    HG   LEU  45           HG       LEU  45   0.469  -4.234   5.903
  379   HD11  LEU  45          1HD1      LEU  45   1.616  -4.278   3.672
  380   HD12  LEU  45          2HD1      LEU  45   0.395  -2.987   3.746
  381   HD13  LEU  45          3HD1      LEU  45   2.121  -2.590   3.915
  382   HD21  LEU  45          3HD2      LEU  45   2.454  -4.174   7.294
  383   HD22  LEU  45          1HD2      LEU  45   2.823  -4.969   5.745
  384   HD23  LEU  45          2HD2      LEU  45   3.347  -3.291   6.033
  385    H    HIS  46           H        HIS  46  -1.369  -0.618   7.818
  386    HA   HIS  46           HA       HIS  46   0.037   1.774   8.570
  387    HB2  HIS  46           1HB      HIS  46  -2.168   1.812   7.418
  388    HB3  HIS  46           2HB      HIS  46  -2.926   1.109   8.867
  389    HD1  HIS  46           1HD      HIS  46  -0.696   4.144   8.175
  390    HD2  HIS  46           2HD      HIS  46  -4.196   3.146  10.298
  391    HE1  HIS  46           1HE      HIS  46  -1.396   6.187   9.319
  392    H    GLN  47           H        GLN  47  -1.803  -0.606  10.463
  393    HA   GLN  47           HA       GLN  47  -1.457   0.749  12.984
  394    HB2  GLN  47           1HB      GLN  47  -1.929  -2.143  12.242
  395    HB3  GLN  47           2HB      GLN  47  -1.858  -1.555  13.921
  396    HG2  GLN  47           1HG      GLN  47  -4.012  -0.044  13.317
  397    HG3  GLN  47           2HG      GLN  47  -3.608  -0.786  11.751
  398   HE21  GLN  47          2HE2      GLN  47  -6.149  -0.940  12.979
  399   HE22  GLN  47          1HE2      GLN  47  -6.454  -2.594  13.394
  400    H    ARG  48           H        ARG  48   0.559  -1.454  11.135
  401    HA   ARG  48           HA       ARG  48   2.491  -1.873  13.271
  402    HB2  ARG  48           1HB      ARG  48   2.622  -2.293  10.325
  403    HB3  ARG  48           2HB      ARG  48   3.982  -2.582  11.434
  404    HG2  ARG  48           1HG      ARG  48   2.730  -4.280  12.615
  405    HG3  ARG  48           2HG      ARG  48   1.269  -3.919  11.661
  406    HD2  ARG  48           1HD      ARG  48   2.400  -4.698   9.661
  407    HD3  ARG  48           2HD      ARG  48   3.840  -5.080  10.632
  408    HE   ARG  48           HE       ARG  48   1.733  -6.672  11.729
  409   HH11  ARG  48          1HH1      ARG  48   3.222  -6.339   8.594
  410   HH12  ARG  48          2HH1      ARG  48   2.895  -8.026   8.253
  411   HH21  ARG  48          1HH2      ARG  48   1.345  -8.604  11.350
  412   HH22  ARG  48          2HH2      ARG  48   1.824  -9.319   9.823
  413    H    GLY  49           H        GLY  49   1.892   0.656  10.970
  414    HA2  GLY  49           1HA      GLY  49   2.877   2.821  11.138
  415    HA3  GLY  49           2HA      GLY  49   4.242   2.120  12.040
  416    H    VAL  50           H        VAL  50   3.168   0.420   9.231
  417    HA   VAL  50           HA       VAL  50   5.769   0.944   7.900
  418    HB   VAL  50           HB       VAL  50   3.419  -0.838   7.133
  419   HG11  VAL  50          1HG1      VAL  50   5.007  -1.833   5.520
  420   HG12  VAL  50          2HG1      VAL  50   4.743  -0.107   5.178
  421   HG13  VAL  50          3HG1      VAL  50   6.236  -0.636   5.992
  422   HG21  VAL  50          3HG2      VAL  50   4.490  -1.580   9.175
  423   HG22  VAL  50          1HG2      VAL  50   4.861  -2.685   7.831
  424   HG23  VAL  50          2HG2      VAL  50   6.085  -1.517   8.385
  425    H    ILE  51           H        ILE  51   2.320   1.374   7.119
  426    HA   ILE  51           HA       ILE  51   3.192   3.534   5.218
  427    HB   ILE  51           HB       ILE  51   1.248   2.962   3.801
  428   HG12  ILE  51          1HG1      ILE  51   0.886   0.582   5.602
  429   HG13  ILE  51          2HG1      ILE  51  -0.105   2.058   5.641
  430   HG21  ILE  51          1HG2      ILE  51   2.074   0.826   2.874
  431   HG22  ILE  51          2HG2      ILE  51   3.424   1.911   3.277
  432   HG23  ILE  51          3HG2      ILE  51   3.027   0.552   4.353
  433   HD11  ILE  51          3HD1      ILE  51   0.169   0.162   3.282
  434   HD12  ILE  51          1HD1      ILE  51  -1.228   0.266   4.377
  435   HD13  ILE  51          2HD1      ILE  51  -0.822   1.640   3.322
  436    H    TYR  52           H        TYR  52   1.665   5.189   4.800
  437    HA   TYR  52           HA       TYR  52  -0.303   5.561   7.029
  438    HB2  TYR  52           1HB      TYR  52   1.668   7.570   5.924
  439    HB3  TYR  52           2HB      TYR  52   0.286   7.976   6.971
  440    HD1  TYR  52           1HD      TYR  52   3.546   6.213   6.838
  441    HD2  TYR  52           2HD      TYR  52   0.379   7.591   9.338
  442    HE1  TYR  52           1HE      TYR  52   4.934   5.748   8.837
  443    HE2  TYR  52           2HE      TYR  52   1.749   7.133  11.344
  444    HH   TYR  52           HH       TYR  52   3.743   6.375  12.140
  445    H    ARG  53           H        ARG  53  -2.201   6.479   6.552
  446    HA   ARG  53           HA       ARG  53  -2.763   6.727   3.628
  447    HB2  ARG  53           1HB      ARG  53  -4.017   5.065   4.843
  448    HB3  ARG  53           2HB      ARG  53  -4.670   6.345   5.893
  449    HG2  ARG  53           1HG      ARG  53  -5.823   7.365   4.039
  450    HG3  ARG  53           2HG      ARG  53  -5.041   6.257   2.886
  451    HD2  ARG  53           1HD      ARG  53  -7.308   5.624   3.235
  452    HD3  ARG  53           2HD      ARG  53  -6.221   4.394   3.921
  453    HE   ARG  53           HE       ARG  53  -7.185   6.160   6.048
  454   HH11  ARG  53          1HH1      ARG  53  -8.255   3.560   3.985
  455   HH12  ARG  53          2HH1      ARG  53  -9.400   3.051   5.210
  456   HH21  ARG  53          1HH2      ARG  53  -8.499   5.594   7.457
  457   HH22  ARG  53          2HH2      ARG  53  -9.542   4.212   7.190
  458    H    LYS  54           H        LYS  54  -3.194   8.560   2.694
  459    HA   LYS  54           HA       LYS  54  -4.116  10.838   4.419
  460    HB2  LYS  54           1HB      LYS  54  -2.282  10.885   2.019
  461    HB3  LYS  54           2HB      LYS  54  -2.992  12.322   2.788
  462    HG2  LYS  54           1HG      LYS  54  -1.819  11.735   4.898
  463    HG3  LYS  54           2HG      LYS  54  -1.055  10.361   4.063
  464    HD2  LYS  54           1HD      LYS  54   0.016  11.900   2.479
  465    HD3  LYS  54           2HD      LYS  54  -0.767  13.283   3.282
  466    HE2  LYS  54           1HE      LYS  54   0.410  12.709   5.379
  467    HE3  LYS  54           2HE      LYS  54   1.225  11.370   4.539
  468    HZ1  LYS  54           3HZ      LYS  54   1.478  14.230   3.857
  469    HZ2  LYS  54           1HZ      LYS  54   2.611  13.329   4.647
  470    HZ3  LYS  54           2HZ      LYS  54   2.234  12.988   3.077
  471    H    TRP  55           H        TRP  55  -5.401  12.445   3.361
  472    HA   TRP  55           HA       TRP  55  -7.133  11.174   1.264
  473    HB2  TRP  55           1HB      TRP  55  -7.810  12.966   3.626
  474    HB3  TRP  55           2HB      TRP  55  -8.924  12.717   2.261
  475    HD1  TRP  55           HD       TRP  55 -10.201  10.623   2.171
  476    HE1  TRP  55           1HE      TRP  55 -10.582   8.526   3.832
  477    HE3  TRP  55           3HE      TRP  55  -6.388  11.547   5.401
  478    HZ2  TRP  55           2HZ      TRP  55  -9.345   7.573   6.112
  479    HZ3  TRP  55           3HZ      TRP  55  -6.003  10.073   7.279
  480    HH2  TRP  55           HH       TRP  55  -7.417   8.104   7.680
  481    H    ARG  56           H        ARG  56  -7.183  12.069  -0.631
  482    HA   ARG  56           HA       ARG  56  -6.548  14.993  -0.837
  483    HB2  ARG  56           1HB      ARG  56  -5.009  13.628  -2.035
  484    HB3  ARG  56           2HB      ARG  56  -6.350  12.869  -2.927
  485    HG2  ARG  56           1HG      ARG  56  -6.907  15.017  -3.953
  486    HG3  ARG  56           2HG      ARG  56  -5.608  15.809  -3.029
  487    HD2  ARG  56           1HD      ARG  56  -3.964  14.481  -4.197
  488    HD3  ARG  56           2HD      ARG  56  -5.261  13.682  -5.117
  489    HE   ARG  56           HE       ARG  56  -5.329  16.553  -5.653
  490   HH11  ARG  56          1HH1      ARG  56  -3.405  13.731  -6.360
  491   HH12  ARG  56          2HH1      ARG  56  -2.903  14.447  -7.878
  492   HH21  ARG  56          1HH2      ARG  56  -4.758  17.390  -7.385
  493   HH22  ARG  56          2HH2      ARG  56  -3.673  16.535  -8.463
  494    H    HIS  57           H        HIS  57  -8.065  16.363  -1.301
  495    HA   HIS  57           HA       HIS  57 -10.746  15.304  -2.015
  496    HB2  HIS  57           1HB      HIS  57  -9.828  18.097  -1.193
  497    HB3  HIS  57           2HB      HIS  57 -11.513  17.617  -1.508
  498    HD1  HIS  57           1HD      HIS  57 -11.644  18.599   1.045
  499    HD2  HIS  57           2HD      HIS  57  -9.914  14.784   0.570
  500    HE1  HIS  57           1HE      HIS  57 -11.640  17.579   3.265
  501    H    PHE  58           H        PHE  58 -11.679  15.445  -3.900
  502    HA   PHE  58           HA       PHE  58 -10.851  17.457  -5.879
  503    HB2  PHE  58           1HB      PHE  58  -9.114  15.726  -6.224
  504    HB3  PHE  58           2HB      PHE  58 -10.379  14.491  -6.412
  505    HD1  PHE  58           1HD      PHE  58  -9.115  17.667  -7.876
  506    HD2  PHE  58           2HD      PHE  58 -11.270  14.027  -8.478
  507    HE1  PHE  58           1HE      PHE  58  -9.193  18.117 -10.305
  508    HE2  PHE  58           2HE      PHE  58 -11.346  14.474 -10.910
  509    HZ   PHE  58           HZ       PHE  58 -10.308  16.520 -11.821
  510    H    SER  59           H        SER  59 -12.539  18.130  -6.918
  511    HA   SER  59           HA       SER  59 -14.757  18.188  -7.793
  512    HB2  SER  59           1HB      SER  59 -14.219  15.310  -8.206
  513    HB3  SER  59           2HB      SER  59 -15.554  16.272  -8.879
  514    HG   SER  59           HG       SER  59 -13.777  16.094 -10.313
  515    H    GLY  60           H        GLY  60 -14.305  17.744  -4.857
  516    HA2  GLY  60           1HA      GLY  60 -15.796  17.619  -3.079
  517    HA3  GLY  60           2HA      GLY  60 -17.090  17.226  -4.236
  518    H    ARG  61           H        ARG  61 -14.158  15.354  -4.261
  519    HA   ARG  61           HA       ARG  61 -15.526  13.147  -2.762
  520    HB2  ARG  61           1HB      ARG  61 -14.098  12.881  -5.369
  521    HB3  ARG  61           2HB      ARG  61 -14.616  11.544  -4.317
  522    HG2  ARG  61           1HG      ARG  61 -16.953  12.191  -4.607
  523    HG3  ARG  61           2HG      ARG  61 -16.461  13.581  -5.605
  524    HD2  ARG  61           1HD      ARG  61 -15.574  12.066  -7.269
  525    HD3  ARG  61           2HD      ARG  61 -16.075  10.680  -6.273
  526    HE   ARG  61           HE       ARG  61 -18.462  12.169  -6.903
  527   HH11  ARG  61          1HH1      ARG  61 -16.018  10.383  -8.633
  528   HH12  ARG  61          2HH1      ARG  61 -17.195   9.949  -9.858
  529   HH21  ARG  61          1HH2      ARG  61 -19.819  11.687  -8.301
  530   HH22  ARG  61          2HH2      ARG  61 -19.362  10.693  -9.669
  531    H    LYS  62           H        LYS  62 -14.269  11.753  -1.617
  532    HA   LYS  62           HA       LYS  62 -11.560  12.865  -1.003
  533    HB2  LYS  62           1HB      LYS  62 -13.422  11.094   0.588
  534    HB3  LYS  62           2HB      LYS  62 -11.790  11.588   1.099
  535    HG2  LYS  62           1HG      LYS  62 -12.514  13.950   1.085
  536    HG3  LYS  62           2HG      LYS  62 -14.150  13.438   0.609
  537    HD2  LYS  62           1HD      LYS  62 -14.378  12.163   2.687
  538    HD3  LYS  62           2HD      LYS  62 -12.723  12.615   3.160
  539    HE2  LYS  62           1HE      LYS  62 -13.391  14.997   3.142
  540    HE3  LYS  62           2HE      LYS  62 -15.052  14.511   2.735
  541    HZ1  LYS  62           3HZ      LYS  62 -13.602  13.769   5.195
  542    HZ2  LYS  62           1HZ      LYS  62 -14.793  14.908   5.090
  543    HZ3  LYS  62           2HZ      LYS  62 -15.144  13.318   4.820
  544    H    TYR  63           H        TYR  63  -9.996  11.931  -2.057
  545    HA   TYR  63           HA       TYR  63 -10.180   9.012  -2.643
  546    HB2  TYR  63           1HB      TYR  63  -8.313  11.184  -3.610
  547    HB3  TYR  63           2HB      TYR  63  -8.178   9.463  -4.042
  548    HD1  TYR  63           1HD      TYR  63 -10.189  12.533  -4.472
  549    HD2  TYR  63           2HD      TYR  63  -9.695   8.462  -5.638
  550    HE1  TYR  63           1HE      TYR  63 -11.776  12.885  -6.342
  551    HE2  TYR  63           2HE      TYR  63 -11.274   8.795  -7.509
  552    HH   TYR  63           HH       TYR  63 -12.633  10.260  -8.602
  553    H    ARG  64           H        ARG  64  -8.847   7.506  -1.885
  554    HA   ARG  64           HA       ARG  64  -7.197   8.363   0.455
  555    HB2  ARG  64           1HB      ARG  64  -8.359   5.703  -0.235
  556    HB3  ARG  64           2HB      ARG  64  -7.276   6.042   1.135
  557    HG2  ARG  64           1HG      ARG  64  -8.906   7.479   2.159
  558    HG3  ARG  64           2HG      ARG  64  -9.953   7.400   0.721
  559    HD2  ARG  64           1HD      ARG  64 -10.299   5.024   1.137
  560    HD3  ARG  64           2HD      ARG  64  -9.311   5.160   2.611
  561    HE   ARG  64           HE       ARG  64 -11.548   6.973   2.895
  562   HH11  ARG  64          1HH1      ARG  64 -11.007   3.536   2.656
  563   HH12  ARG  64          2HH1      ARG  64 -12.426   3.238   3.643
  564   HH21  ARG  64          1HH2      ARG  64 -13.179   6.648   4.019
  565   HH22  ARG  64          2HH2      ARG  64 -13.665   5.013   4.419
  566    H    GLU  65           H        GLU  65  -5.104   8.377   0.390
  567    HA   GLU  65           HA       GLU  65  -3.740   6.704  -1.694
  568    HB2  GLU  65           1HB      GLU  65  -3.043   9.497  -0.773
  569    HB3  GLU  65           2HB      GLU  65  -2.079   8.494  -1.885
  570    HG2  GLU  65           1HG      GLU  65  -4.060   8.551  -3.519
  571    HG3  GLU  65           2HG      GLU  65  -4.835   9.578  -2.292
  572    H    TYR  66           H        TYR  66  -2.027   5.558  -1.131
  573    HA   TYR  66           HA       TYR  66  -1.329   5.625   1.786
  574    HB2  TYR  66           1HB      TYR  66  -1.181   3.383  -0.239
  575    HB3  TYR  66           2HB      TYR  66  -0.634   3.289   1.452
  576    HD1  TYR  66           1HD      TYR  66  -3.577   3.461  -0.766
  577    HD2  TYR  66           2HD      TYR  66  -2.237   3.115   3.267
  578    HE1  TYR  66           1HE      TYR  66  -5.864   2.802  -0.071
  579    HE2  TYR  66           2HE      TYR  66  -4.510   2.456   3.978
  580    HH   TYR  66           HH       TYR  66  -6.656   2.056   3.325
  581    H    CYS  67           H        CYS  67   0.623   6.075   2.431
  582    HA   CYS  67           HA       CYS  67   2.843   6.230   0.367
  583    HB2  CYS  67           1HB      CYS  67   2.275   7.724   2.968
  584    HB3  CYS  67           2HB      CYS  67   3.617   8.040   1.841
  585    HG   CYS  67           HG       CYS  67   1.932   9.934   1.760
  586    H    LEU  68           H        LEU  68   4.800   5.335   0.865
  587    HA   LEU  68           HA       LEU  68   4.803   3.474   3.207
  588    HB2  LEU  68           1HB      LEU  68   4.950   2.492   1.131
  589    HB3  LEU  68           2HB      LEU  68   6.363   3.414   0.567
  590    HG   LEU  68           HG       LEU  68   7.621   2.403   2.553
  591   HD11  LEU  68          1HD1      LEU  68   6.706   0.226   3.399
  592   HD12  LEU  68          2HD1      LEU  68   5.616   1.579   3.784
  593   HD13  LEU  68          3HD1      LEU  68   5.235   0.486   2.431
  594   HD21  LEU  68          3HD2      LEU  68   8.028   1.723   0.261
  595   HD22  LEU  68          1HD2      LEU  68   8.111   0.309   1.338
  596   HD23  LEU  68          2HD2      LEU  68   6.668   0.578   0.328
  597    H    LYS  69           H        LYS  69   6.045   3.788   4.866
  598    HA   LYS  69           HA       LYS  69   8.289   5.759   4.585
  599    HB2  LYS  69           1HB      LYS  69   6.756   4.922   7.051
  600    HB3  LYS  69           2HB      LYS  69   8.066   6.125   6.973
  601    HG2  LYS  69           1HG      LYS  69   5.359   6.355   5.611
  602    HG3  LYS  69           2HG      LYS  69   5.839   7.187   7.109
  603    HD2  LYS  69           1HD      LYS  69   7.653   8.330   5.885
  604    HD3  LYS  69           2HD      LYS  69   7.148   7.511   4.388
  605    HE2  LYS  69           1HE      LYS  69   4.896   8.573   4.643
  606    HE3  LYS  69           2HE      LYS  69   5.537   9.488   6.027
  607    HZ1  LYS  69           3HZ      LYS  69   6.555   9.628   3.261
  608    HZ2  LYS  69           1HZ      LYS  69   5.620  10.770   3.997
  609    HZ3  LYS  69           2HZ      LYS  69   7.148  10.478   4.545
  610    H    HIS  70           H        HIS  70   7.701   2.524   4.689
  611    HA   HIS  70           HA       HIS  70   9.645   1.538   6.525
  612    HB2  HIS  70           1HB      HIS  70   8.015   0.056   5.400
  613    HB3  HIS  70           2HB      HIS  70   8.789   0.386   3.832
  614    HD1  HIS  70           1HD      HIS  70   9.735  -1.073   7.231
  615    HD2  HIS  70           2HD      HIS  70  10.681  -1.571   3.155
  616    HE1  HIS  70           1HE      HIS  70  11.342  -2.911   7.132
  617    H    ARG  71           H        ARG  71  11.742   1.572   6.634
  618    HA   ARG  71           HA       ARG  71  13.273   2.797   4.425
  619    HB2  ARG  71           1HB      ARG  71  14.124   1.881   7.135
  620    HB3  ARG  71           2HB      ARG  71  15.172   2.631   5.908
  621    HG2  ARG  71           1HG      ARG  71  13.843   4.680   5.993
  622    HG3  ARG  71           2HG      ARG  71  12.738   3.931   7.172
  623    HD2  ARG  71           1HD      ARG  71  14.526   3.797   8.779
  624    HD3  ARG  71           2HD      ARG  71  15.653   4.509   7.600
  625    HE   ARG  71           HE       ARG  71  13.571   6.452   8.045
  626   HH11  ARG  71          1HH1      ARG  71  16.064   4.892   9.917
  627   HH12  ARG  71          2HH1      ARG  71  16.199   6.313  10.934
  628   HH21  ARG  71          1HH2      ARG  71  13.705   8.083   9.206
  629   HH22  ARG  71          2HH2      ARG  71  14.852   8.134  10.530
  630    H    ASP  72           H        ASP  72  13.805   1.627   2.760
  631    HA   ASP  72           HA       ASP  72  14.135  -1.255   2.879
  632    HB2  ASP  72           1HB      ASP  72  14.860   0.783   0.687
  633    HB3  ASP  72           2HB      ASP  72  15.107  -0.981   0.709
  634    H    GLU  73           H        GLU  73  16.353   1.498   2.967
  635    HA   GLU  73           HA       GLU  73  18.783  -0.021   2.820
  636    HB2  GLU  73           1HB      GLU  73  18.648   2.412   2.552
  637    HB3  GLU  73           2HB      GLU  73  18.194   2.567   4.266
  638    HG2  GLU  73           1HG      GLU  73  20.471   1.625   4.904
  639    HG3  GLU  73           2HG      GLU  73  20.750   1.487   3.153
  640    H    LEU  74           H        LEU  74  16.892   1.090   5.637
  641    HA   LEU  74           HA       LEU  74  18.589  -0.130   7.596
  642    HB2  LEU  74           1HB      LEU  74  17.061   1.533   8.061
  643    HB3  LEU  74           2HB      LEU  74  15.606   0.581   7.683
  644    HG   LEU  74           HG       LEU  74  16.244  -0.992   9.534
  645   HD11  LEU  74          1HD1      LEU  74  17.894  -0.160  11.231
  646   HD12  LEU  74          2HD1      LEU  74  18.663  -0.400   9.645
  647   HD13  LEU  74          3HD1      LEU  74  18.237   1.241  10.188
  648   HD21  LEU  74          3HD2      LEU  74  14.543   0.702   9.868
  649   HD22  LEU  74          1HD2      LEU  74  15.488   0.489  11.361
  650   HD23  LEU  74          2HD2      LEU  74  15.781   1.899  10.314
  651    H    ALA  75           H        ALA  75  15.742  -1.354   5.859
  652    HA   ALA  75           HA       ALA  75  15.557  -3.851   7.184
  653    HB1  ALA  75           1HB      ALA  75  14.420  -4.634   5.142
  654    HB2  ALA  75           2HB      ALA  75  13.841  -3.025   5.637
  655    HB3  ALA  75           3HB      ALA  75  14.979  -3.184   4.278
  656    H    ASP  76           H        ASP  76  17.506  -2.897   4.360
  657    HA   ASP  76           HA       ASP  76  18.646  -5.520   3.950
  658    HB2  ASP  76           1HB      ASP  76  19.624  -2.735   3.079
  659    HB3  ASP  76           2HB      ASP  76  20.369  -4.327   2.792
  660    H    LEU  77           H        LEU  77  19.584  -2.745   5.920
  661    HA   LEU  77           HA       LEU  77  22.135  -3.827   6.731
  662    HB2  LEU  77           1HB      LEU  77  20.195  -1.944   7.886
  663    HB3  LEU  77           2HB      LEU  77  21.747  -2.175   8.723
  664    HG   LEU  77           HG       LEU  77  21.385  -1.123   5.889
  665   HD11  LEU  77          1HD1      LEU  77  22.190   1.050   6.854
  666   HD12  LEU  77          2HD1      LEU  77  20.678   0.519   7.628
  667   HD13  LEU  77          3HD1      LEU  77  22.232   0.300   8.467
  668   HD21  LEU  77          3HD2      LEU  77  23.442  -2.380   6.145
  669   HD22  LEU  77          1HD2      LEU  77  23.806  -0.644   5.993
  670   HD23  LEU  77          2HD2      LEU  77  23.877  -1.433   7.588
  671    H    GLU  78           H        GLU  78  18.842  -4.204   7.938
  672    HA   GLU  78           HA       GLU  78  19.655  -5.744  10.278
  673    HB2  GLU  78           1HB      GLU  78  17.036  -5.424   8.810
  674    HB3  GLU  78           2HB      GLU  78  17.240  -6.411  10.278
  675    HG2  GLU  78           1HG      GLU  78  17.879  -4.334  11.566
  676    HG3  GLU  78           2HG      GLU  78  17.782  -3.484  10.006
  677    H    HIS  79           H        HIS  79  18.888  -6.477   6.933
  678    HA   HIS  79           HA       HIS  79  18.675  -9.341   7.309
  679    HB2  HIS  79           1HB      HIS  79  19.326  -7.662   4.844
  680    HB3  HIS  79           2HB      HIS  79  19.032  -9.418   4.825
  681    HD2  HIS  79           2HD      HIS  79  16.252  -8.829   7.052
  682    HE1  HIS  79           1HE      HIS  79  14.874  -7.212   3.373
  683    HE2  HIS  79           2HE      HIS  79  14.239  -8.072   5.773
  Start of MODEL    8
    1    H    LYS   3           H        LYS   3   4.937 -14.029 -10.364
    2    HA   LYS   3           HA       LYS   3   4.948 -11.853  -8.549
    3    HB2  LYS   3           1HB      LYS   3   2.467 -12.101 -10.253
    4    HB3  LYS   3           2HB      LYS   3   2.523 -11.269  -8.680
    5    HG2  LYS   3           1HG      LYS   3   4.177  -9.682  -9.574
    6    HG3  LYS   3           2HG      LYS   3   4.128 -10.515 -11.146
    7    HD2  LYS   3           1HD      LYS   3   1.767  -9.949 -11.405
    8    HD3  LYS   3           2HD      LYS   3   1.754  -9.184  -9.798
    9    HE2  LYS   3           1HE      LYS   3   3.351  -7.508 -10.543
   10    HE3  LYS   3           2HE      LYS   3   3.485  -8.303 -12.128
   11    HZ1  LYS   3           3HZ      LYS   3   1.041  -7.062 -11.035
   12    HZ2  LYS   3           1HZ      LYS   3   2.006  -6.412 -12.204
   13    HZ3  LYS   3           2HZ      LYS   3   1.167  -7.799 -12.505
   14    H    ALA   4           H        ALA   4   3.561 -14.809  -9.749
   15    HA   ALA   4           HA       ALA   4   1.949 -15.414  -7.455
   16    HB1  ALA   4           1HB      ALA   4   1.963 -17.719  -8.326
   17    HB2  ALA   4           2HB      ALA   4   1.639 -16.535  -9.615
   18    HB3  ALA   4           3HB      ALA   4   3.250 -17.275  -9.472
   19    H    LYS   5           H        LYS   5   5.357 -15.838  -8.171
   20    HA   LYS   5           HA       LYS   5   5.920 -17.652  -5.987
   21    HB2  LYS   5           1HB      LYS   5   7.632 -15.712  -7.544
   22    HB3  LYS   5           2HB      LYS   5   8.261 -16.816  -6.297
   23    HG2  LYS   5           1HG      LYS   5   7.494 -18.748  -7.616
   24    HG3  LYS   5           2HG      LYS   5   6.858 -17.646  -8.860
   25    HD2  LYS   5           1HD      LYS   5   9.129 -16.777  -9.254
   26    HD3  LYS   5           2HD      LYS   5   9.765 -17.878  -8.010
   27    HE2  LYS   5           1HE      LYS   5   9.016 -19.810  -9.318
   28    HE3  LYS   5           2HE      LYS   5   8.346 -18.723 -10.554
   29    HZ1  LYS   5           3HZ      LYS   5  11.195 -18.930  -9.816
   30    HZ2  LYS   5           1HZ      LYS   5  10.511 -19.555 -11.180
   31    HZ3  LYS   5           2HZ      LYS   5  10.573 -17.920 -10.963
   32    H    LEU   6           H        LEU   6   5.561 -14.181  -6.232
   33    HA   LEU   6           HA       LEU   6   6.643 -13.780  -3.507
   34    HB2  LEU   6           1HB      LEU   6   5.339 -12.041  -5.498
   35    HB3  LEU   6           2HB      LEU   6   5.987 -11.346  -3.995
   36    HG   LEU   6           HG       LEU   6   7.593 -12.702  -6.196
   37   HD11  LEU   6          1HD1      LEU   6   8.560 -10.413  -6.542
   38   HD12  LEU   6          2HD1      LEU   6   6.801 -10.418  -6.804
   39   HD13  LEU   6          3HD1      LEU   6   7.471  -9.780  -5.284
   40   HD21  LEU   6          3HD2      LEU   6   8.543 -13.137  -4.007
   41   HD22  LEU   6          1HD2      LEU   6   9.577 -11.998  -4.904
   42   HD23  LEU   6          2HD2      LEU   6   8.505 -11.401  -3.614
   43    H    SER   7           H        SER   7   5.527 -13.128  -1.729
   44    HA   SER   7           HA       SER   7   2.707 -13.920  -1.466
   45    HB2  SER   7           1HB      SER   7   2.854 -13.352   0.703
   46    HB3  SER   7           2HB      SER   7   4.384 -14.145   0.261
   47    HG   SER   7           HG       SER   7   4.882 -12.360   1.459
   48    H    LEU   8           H        LEU   8   1.107 -12.394  -0.570
   49    HA   LEU   8           HA       LEU   8   0.703 -10.058  -2.170
   50    HB2  LEU   8           1HB      LEU   8  -1.029 -11.158  -1.211
   51    HB3  LEU   8           2HB      LEU   8  -0.521 -10.972   0.484
   52    HG   LEU   8           HG       LEU   8  -0.844  -8.521   0.287
   53   HD11  LEU   8          1HD1      LEU   8  -2.092  -7.633  -1.701
   54   HD12  LEU   8          2HD1      LEU   8  -0.529  -8.336  -2.180
   55   HD13  LEU   8          3HD1      LEU   8  -2.033  -9.250  -2.440
   56   HD21  LEU   8          3HD2      LEU   8  -2.618  -9.894   1.205
   57   HD22  LEU   8          1HD2      LEU   8  -3.314  -8.547   0.274
   58   HD23  LEU   8          2HD2      LEU   8  -3.275 -10.185  -0.423
   59    H    THR   9           H        THR   9   1.968 -10.424   1.139
   60    HA   THR   9           HA       THR   9   2.378  -7.633   1.623
   61    HB   THR   9           HB       THR   9   3.932 -10.036   2.674
   62    HG1  THR   9           1HG      THR   9   2.519  -9.702   4.492
   63   HG21  THR   9          3HG2      THR   9   3.757  -7.173   3.692
   64   HG22  THR   9          1HG2      THR   9   4.601  -8.515   4.501
   65   HG23  THR   9          2HG2      THR   9   5.180  -7.918   2.927
   66    H    GLN  10           H        GLN  10   4.513 -10.091   0.189
   67    HA   GLN  10           HA       GLN  10   6.758  -8.314  -0.118
   68    HB2  GLN  10           1HB      GLN  10   5.918 -10.868  -1.490
   69    HB3  GLN  10           2HB      GLN  10   7.416 -10.002  -1.899
   70    HG2  GLN  10           1HG      GLN  10   8.245 -10.471   0.593
   71    HG3  GLN  10           2HG      GLN  10   6.545 -10.991   0.674
   72   HE21  GLN  10          2HE2      GLN  10   9.124 -12.409   1.241
   73   HE22  GLN  10          1HE2      GLN  10   9.076 -13.839   0.264
   74    H    LEU  11           H        LEU  11   4.123  -9.247  -2.319
   75    HA   LEU  11           HA       LEU  11   5.046  -7.755  -4.572
   76    HB2  LEU  11           1HB      LEU  11   2.430  -8.590  -3.540
   77    HB3  LEU  11           2HB      LEU  11   2.458  -7.746  -5.107
   78    HG   LEU  11           HG       LEU  11   3.876 -10.365  -4.480
   79   HD11  LEU  11          1HD1      LEU  11   2.160 -11.389  -5.997
   80   HD12  LEU  11          2HD1      LEU  11   1.398 -10.629  -4.579
   81   HD13  LEU  11          3HD1      LEU  11   1.374  -9.800  -6.153
   82   HD21  LEU  11          3HD2      LEU  11   5.043  -9.045  -6.144
   83   HD22  LEU  11          1HD2      LEU  11   4.286 -10.458  -6.913
   84   HD23  LEU  11          2HD2      LEU  11   3.545  -8.850  -7.083
   85    H    ILE  12           H        ILE  12   2.937  -6.812  -1.869
   86    HA   ILE  12           HA       ILE  12   2.370  -4.166  -2.876
   87    HB   ILE  12           HB       ILE  12   2.378  -5.332  -0.059
   88   HG12  ILE  12          1HG1      ILE  12   0.066  -4.505  -1.785
   89   HG13  ILE  12          2HG1      ILE  12   0.739  -6.150  -1.755
   90   HG21  ILE  12          1HG2      ILE  12   1.170  -3.284   0.617
   91   HG22  ILE  12          2HG2      ILE  12   2.805  -2.899   0.030
   92   HG23  ILE  12          3HG2      ILE  12   1.395  -2.613  -1.016
   93   HD11  ILE  12          3HD1      ILE  12  -0.443  -4.670   0.619
   94   HD12  ILE  12          1HD1      ILE  12  -1.236  -5.972  -0.295
   95   HD13  ILE  12          2HD1      ILE  12   0.232  -6.317   0.651
   96    H    LEU  13           H        LEU  13   4.881  -5.330  -0.638
   97    HA   LEU  13           HA       LEU  13   5.792  -2.607  -0.137
   98    HB2  LEU  13           1HB      LEU  13   6.856  -5.302   0.385
   99    HB3  LEU  13           2HB      LEU  13   7.716  -3.891   1.044
  100    HG   LEU  13           HG       LEU  13   4.901  -4.808   1.745
  101   HD11  LEU  13          1HD1      LEU  13   5.882  -5.150   4.028
  102   HD12  LEU  13          2HD1      LEU  13   6.716  -6.145   2.812
  103   HD13  LEU  13          3HD1      LEU  13   7.470  -4.646   3.404
  104   HD21  LEU  13          3HD2      LEU  13   5.020  -2.387   1.692
  105   HD22  LEU  13          1HD2      LEU  13   4.896  -2.952   3.375
  106   HD23  LEU  13          2HD2      LEU  13   6.465  -2.406   2.731
  107    H    ILE  14           H        ILE  14   6.801  -5.255  -2.236
  108    HA   ILE  14           HA       ILE  14   9.238  -3.960  -3.150
  109    HB   ILE  14           HB       ILE  14   7.462  -6.128  -4.349
  110   HG12  ILE  14          1HG1      ILE  14  10.243  -6.302  -3.225
  111   HG13  ILE  14          2HG1      ILE  14   8.761  -6.593  -2.283
  112   HG21  ILE  14          1HG2      ILE  14   9.276  -6.488  -5.989
  113   HG22  ILE  14          2HG2      ILE  14   8.575  -4.863  -6.157
  114   HG23  ILE  14          3HG2      ILE  14  10.142  -5.076  -5.341
  115   HD11  ILE  14          3HD1      ILE  14   9.639  -8.147  -4.743
  116   HD12  ILE  14          1HD1      ILE  14   9.753  -8.711  -3.060
  117   HD13  ILE  14          2HD1      ILE  14   8.159  -8.439  -3.801
  118    H    ARG  15           H        ARG  15   5.898  -3.957  -4.326
  119    HA   ARG  15           HA       ARG  15   6.437  -2.281  -6.608
  120    HB2  ARG  15           1HB      ARG  15   4.463  -3.544  -6.534
  121    HB3  ARG  15           2HB      ARG  15   3.932  -2.721  -5.047
  122    HG2  ARG  15           1HG      ARG  15   2.720  -1.858  -6.980
  123    HG3  ARG  15           2HG      ARG  15   3.770  -0.600  -6.282
  124    HD2  ARG  15           1HD      ARG  15   5.421  -1.099  -8.039
  125    HD3  ARG  15           2HD      ARG  15   4.238  -2.211  -8.769
  126    HE   ARG  15           HE       ARG  15   3.034   0.427  -8.644
  127   HH11  ARG  15          1HH1      ARG  15   5.633  -1.197 -10.307
  128   HH12  ARG  15          2HH1      ARG  15   5.425  -0.133 -11.683
  129   HH21  ARG  15          1HH2      ARG  15   2.789   1.659 -10.208
  130   HH22  ARG  15          2HH2      ARG  15   3.804   1.498 -11.629
  131    H    LEU  16           H        LEU  16   5.573  -1.559  -3.242
  132    HA   LEU  16           HA       LEU  16   5.341   1.295  -3.698
  133    HB2  LEU  16           1HB      LEU  16   5.760  -0.443  -1.365
  134    HB3  LEU  16           2HB      LEU  16   5.576   1.305  -1.090
  135    HG   LEU  16           HG       LEU  16   3.505  -0.552  -2.323
  136   HD11  LEU  16          1HD1      LEU  16   2.200  -0.064  -0.237
  137   HD12  LEU  16          2HD1      LEU  16   3.753  -0.843   0.140
  138   HD13  LEU  16          3HD1      LEU  16   3.560   0.910   0.368
  139   HD21  LEU  16          3HD2      LEU  16   3.411   1.665  -3.300
  140   HD22  LEU  16          1HD2      LEU  16   2.002   1.407  -2.244
  141   HD23  LEU  16          2HD2      LEU  16   3.364   2.407  -1.683
  142    H    SER  17           H        SER  17   7.990  -0.862  -2.924
  143    HA   SER  17           HA       SER  17   9.907   1.206  -2.118
  144    HB2  SER  17           1HB      SER  17  11.493  -0.412  -2.145
  145    HB3  SER  17           2HB      SER  17  10.014  -1.083  -1.422
  146    HG   SER  17           HG       SER  17  11.015  -2.521  -2.896
  147    H    ASN  18           H        ASN  18   8.661  -0.024  -5.145
  148    HA   ASN  18           HA       ASN  18  10.996   0.787  -6.733
  149    HB2  ASN  18           1HB      ASN  18   8.220  -0.175  -7.762
  150    HB3  ASN  18           2HB      ASN  18   9.698   0.473  -8.509
  151   HD21  ASN  18          2HD2      ASN  18   8.323  -2.171  -8.645
  152   HD22  ASN  18          1HD2      ASN  18   9.552  -3.332  -8.269
  153    H    ARG  19           H        ARG  19   7.694   2.029  -6.206
  154    HA   ARG  19           HA       ARG  19   8.512   4.484  -7.726
  155    HB2  ARG  19           1HB      ARG  19   5.809   3.254  -7.432
  156    HB3  ARG  19           2HB      ARG  19   6.155   4.844  -8.151
  157    HG2  ARG  19           1HG      ARG  19   7.316   2.242  -9.179
  158    HG3  ARG  19           2HG      ARG  19   5.814   2.966  -9.801
  159    HD2  ARG  19           1HD      ARG  19   7.102   4.977 -10.391
  160    HD3  ARG  19           2HD      ARG  19   8.582   4.118  -9.902
  161    HE   ARG  19           HE       ARG  19   7.329   2.559 -11.989
  162   HH11  ARG  19          1HH1      ARG  19   8.807   5.697 -11.637
  163   HH12  ARG  19          2HH1      ARG  19   9.329   5.645 -13.310
  164   HH21  ARG  19          1HH2      ARG  19   7.912   2.488 -13.908
  165   HH22  ARG  19          2HH2      ARG  19   8.818   3.816 -14.606
  166    H    GLY  20           H        GLY  20   8.081   3.370  -4.657
  167    HA2  GLY  20           1HA      GLY  20   8.507   4.747  -2.792
  168    HA3  GLY  20           2HA      GLY  20   8.061   6.177  -3.753
  169    H    CYS  21           H        CYS  21   5.575   5.645  -4.651
  170    HA   CYS  21           HA       CYS  21   3.847   4.822  -2.327
  171    HB2  CYS  21           1HB      CYS  21   4.503   7.181  -2.002
  172    HB3  CYS  21           2HB      CYS  21   3.975   7.563  -3.659
  173    HG   CYS  21           HG       CYS  21   2.391   8.590  -1.958
  174    H    GLN  22           H        GLN  22   1.938   3.998  -2.986
  175    HA   GLN  22           HA       GLN  22   1.017   4.500  -5.773
  176    HB2  GLN  22           1HB      GLN  22   1.449   1.785  -4.510
  177    HB3  GLN  22           2HB      GLN  22   0.522   2.073  -6.002
  178    HG2  GLN  22           1HG      GLN  22   3.602   2.698  -5.858
  179    HG3  GLN  22           2HG      GLN  22   2.671   1.224  -6.211
  180   HE21  GLN  22          2HE2      GLN  22   3.155   4.625  -7.170
  181   HE22  GLN  22          1HE2      GLN  22   2.698   4.411  -8.826
  182    H    THR  23           H        THR  23  -1.157   4.188  -6.153
  183    HA   THR  23           HA       THR  23  -2.815   4.636  -3.775
  184    HB   THR  23           HB       THR  23  -4.671   4.854  -5.385
  185    HG1  THR  23           1HG      THR  23  -2.778   4.359  -7.456
  186   HG21  THR  23          3HG2      THR  23  -2.142   6.271  -6.315
  187   HG22  THR  23          1HG2      THR  23  -3.809   6.779  -6.672
  188   HG23  THR  23          2HG2      THR  23  -3.208   6.807  -4.996
  189    H    LEU  24           H        LEU  24  -4.822   3.491  -3.396
  190    HA   LEU  24           HA       LEU  24  -4.446   0.694  -3.032
  191    HB2  LEU  24           1HB      LEU  24  -5.899   1.940  -1.781
  192    HB3  LEU  24           2HB      LEU  24  -6.999   2.389  -3.105
  193    HG   LEU  24           HG       LEU  24  -7.537  -0.045  -3.395
  194   HD11  LEU  24          1HD1      LEU  24  -6.962  -1.584  -1.498
  195   HD12  LEU  24          2HD1      LEU  24  -5.496  -0.962  -2.293
  196   HD13  LEU  24          3HD1      LEU  24  -6.027  -0.274  -0.738
  197   HD21  LEU  24          3HD2      LEU  24  -9.037   1.425  -2.184
  198   HD22  LEU  24          1HD2      LEU  24  -9.029  -0.187  -1.431
  199   HD23  LEU  24          2HD2      LEU  24  -8.133   1.154  -0.675
  200    H    GLU  25           H        GLU  25  -6.013   2.489  -5.655
  201    HA   GLU  25           HA       GLU  25  -6.999   0.160  -7.041
  202    HB2  GLU  25           1HB      GLU  25  -7.791   2.453  -7.434
  203    HB3  GLU  25           2HB      GLU  25  -6.197   2.874  -8.107
  204    HG2  GLU  25           1HG      GLU  25  -6.594   1.204  -9.983
  205    HG3  GLU  25           2HG      GLU  25  -8.125   0.844  -9.154
  206    H    GLU  26           H        GLU  26  -3.996   2.052  -7.387
  207    HA   GLU  26           HA       GLU  26  -2.904   0.481  -9.520
  208    HB2  GLU  26           1HB      GLU  26  -1.709   2.193  -7.355
  209    HB3  GLU  26           2HB      GLU  26  -0.697   1.303  -8.518
  210    HG2  GLU  26           1HG      GLU  26  -1.683   2.609 -10.406
  211    HG3  GLU  26           2HG      GLU  26  -2.844   3.255  -9.223
  212    H    LEU  27           H        LEU  27  -2.718   0.120  -5.995
  213    HA   LEU  27           HA       LEU  27  -0.889  -2.128  -6.115
  214    HB2  LEU  27           1HB      LEU  27  -2.789  -1.068  -4.137
  215    HB3  LEU  27           2HB      LEU  27  -1.757  -2.440  -3.671
  216    HG   LEU  27           HG       LEU  27  -0.773   0.314  -4.513
  217   HD11  LEU  27          1HD1      LEU  27  -0.103   0.551  -2.108
  218   HD12  LEU  27          2HD1      LEU  27  -1.862   0.337  -2.271
  219   HD13  LEU  27          3HD1      LEU  27  -0.841  -1.030  -1.762
  220   HD21  LEU  27          3HD2      LEU  27   0.775  -1.452  -5.116
  221   HD22  LEU  27          1HD2      LEU  27   1.437  -0.499  -3.767
  222   HD23  LEU  27          2HD2      LEU  27   0.725  -2.101  -3.460
  223    H    GLU  28           H        GLU  28  -4.405  -1.802  -6.064
  224    HA   GLU  28           HA       GLU  28  -5.026  -4.590  -5.852
  225    HB2  GLU  28           1HB      GLU  28  -6.685  -2.825  -5.639
  226    HB3  GLU  28           2HB      GLU  28  -6.433  -2.367  -7.341
  227    HG2  GLU  28           1HG      GLU  28  -7.300  -4.702  -7.997
  228    HG3  GLU  28           2HG      GLU  28  -7.543  -4.917  -6.249
  229    H    GLU  29           H        GLU  29  -4.347  -2.561  -8.700
  230    HA   GLU  29           HA       GLU  29  -4.815  -4.703 -10.590
  231    HB2  GLU  29           1HB      GLU  29  -3.314  -2.089 -10.763
  232    HB3  GLU  29           2HB      GLU  29  -3.530  -3.200 -12.136
  233    HG2  GLU  29           1HG      GLU  29  -6.032  -2.873 -11.981
  234    HG3  GLU  29           2HG      GLU  29  -5.689  -1.886 -10.541
  235    H    PHE  30           H        PHE  30  -1.951  -3.518  -8.891
  236    HA   PHE  30           HA       PHE  30  -0.047  -5.029 -10.441
  237    HB2  PHE  30           1HB      PHE  30   0.608  -3.105  -9.015
  238    HB3  PHE  30           2HB      PHE  30   0.144  -4.026  -7.568
  239    HD1  PHE  30           1HD      PHE  30   2.521  -3.853 -10.386
  240    HD2  PHE  30           2HD      PHE  30   1.576  -5.608  -6.607
  241    HE1  PHE  30           1HE      PHE  30   4.807  -4.787 -10.249
  242    HE2  PHE  30           2HE      PHE  30   3.861  -6.542  -6.466
  243    HZ   PHE  30           HZ       PHE  30   5.476  -6.131  -8.290
  244    H    THR  31           H        THR  31  -1.587  -5.698  -7.287
  245    HA   THR  31           HA       THR  31  -0.235  -8.305  -7.145
  246    HB   THR  31           HB       THR  31  -1.353  -8.566  -5.009
  247    HG1  THR  31           1HG      THR  31  -2.783  -6.160  -5.580
  248   HG21  THR  31          3HG2      THR  31  -0.495  -5.670  -5.396
  249   HG22  THR  31          1HG2      THR  31  -0.608  -6.523  -3.839
  250   HG23  THR  31          2HG2      THR  31   0.588  -7.038  -5.050
  251    H    GLN  32           H        GLN  32  -3.329  -7.075  -8.183
  252    HA   GLN  32           HA       GLN  32  -5.335  -8.129  -8.694
  253    HB2  GLN  32           1HB      GLN  32  -3.444 -10.381  -9.406
  254    HB3  GLN  32           2HB      GLN  32  -5.153 -10.265  -9.885
  255    HG2  GLN  32           1HG      GLN  32  -4.384  -8.031 -11.264
  256    HG3  GLN  32           2HG      GLN  32  -2.873  -8.621 -10.533
  257   HE21  GLN  32          2HE2      GLN  32  -2.907  -8.259 -13.206
  258   HE22  GLN  32          1HE2      GLN  32  -2.951  -9.779 -14.036
  259    H    ALA  33           H        ALA  33  -4.310  -8.362  -5.973
  260    HA   ALA  33           HA       ALA  33  -5.035 -11.053  -5.087
  261    HB1  ALA  33           1HB      ALA  33  -4.678 -10.141  -2.825
  262    HB2  ALA  33           2HB      ALA  33  -3.309  -9.775  -3.901
  263    HB3  ALA  33           3HB      ALA  33  -4.499  -8.510  -3.514
  264    H    LYS  34           H        LYS  34  -6.749 -11.601  -3.697
  265    HA   LYS  34           HA       LYS  34  -9.306 -10.511  -4.371
  266    HB2  LYS  34           1HB      LYS  34  -8.833 -12.781  -3.442
  267    HB3  LYS  34           2HB      LYS  34  -8.536 -12.011  -1.865
  268    HG2  LYS  34           1HG      LYS  34 -10.841 -11.195  -1.802
  269    HG3  LYS  34           2HG      LYS  34 -11.148 -11.895  -3.409
  270    HD2  LYS  34           1HD      LYS  34 -10.625 -14.148  -2.479
  271    HD3  LYS  34           2HD      LYS  34 -10.456 -13.410  -0.870
  272    HE2  LYS  34           1HE      LYS  34 -12.794 -12.597  -1.032
  273    HE3  LYS  34           2HE      LYS  34 -12.950 -13.425  -2.599
  274    HZ1  LYS  34           3HZ      LYS  34 -12.389 -14.737  -0.016
  275    HZ2  LYS  34           1HZ      LYS  34 -13.840 -14.747  -0.802
  276    HZ3  LYS  34           2HZ      LYS  34 -12.534 -15.504  -1.469
  277    H    ARG  35           H        ARG  35 -10.561  -8.976  -3.591
  278    HA   ARG  35           HA       ARG  35  -9.299  -6.789  -2.245
  279    HB2  ARG  35           1HB      ARG  35 -12.176  -7.357  -2.785
  280    HB3  ARG  35           2HB      ARG  35 -11.563  -5.870  -2.024
  281    HG2  ARG  35           1HG      ARG  35 -10.369  -5.250  -3.998
  282    HG3  ARG  35           2HG      ARG  35 -10.656  -6.841  -4.745
  283    HD2  ARG  35           1HD      ARG  35 -13.029  -6.337  -4.866
  284    HD3  ARG  35           2HD      ARG  35 -12.713  -4.736  -4.158
  285    HE   ARG  35           HE       ARG  35 -11.197  -4.748  -6.553
  286   HH11  ARG  35          1HH1      ARG  35 -14.551  -5.367  -5.825
  287   HH12  ARG  35          2HH1      ARG  35 -15.012  -4.753  -7.400
  288   HH21  ARG  35          1HH2      ARG  35 -11.708  -4.047  -8.362
  289   HH22  ARG  35          2HH2      ARG  35 -13.392  -4.000  -8.847
  290    H    GLU  36           H        GLU  36 -11.120  -9.528  -1.047
  291    HA   GLU  36           HA       GLU  36 -11.783  -8.558   1.539
  292    HB2  GLU  36           1HB      GLU  36 -12.576 -10.674   0.598
  293    HB3  GLU  36           2HB      GLU  36 -10.925 -11.332   0.699
  294    HG2  GLU  36           1HG      GLU  36 -11.045 -11.114   3.235
  295    HG3  GLU  36           2HG      GLU  36 -12.664 -10.428   2.957
  296    H    VAL  37           H        VAL  37  -8.733  -9.862   0.301
  297    HA   VAL  37           HA       VAL  37  -7.555  -9.598   3.061
  298    HB   VAL  37           HB       VAL  37  -5.826 -11.139   2.294
  299   HG11  VAL  37          1HG1      VAL  37  -7.190 -13.173   1.954
  300   HG12  VAL  37          2HG1      VAL  37  -7.897 -12.128   3.209
  301   HG13  VAL  37          3HG1      VAL  37  -8.604 -12.161   1.576
  302   HG21  VAL  37          3HG2      VAL  37  -5.684 -10.428  -0.018
  303   HG22  VAL  37          1HG2      VAL  37  -5.909 -12.190   0.089
  304   HG23  VAL  37          2HG2      VAL  37  -7.279 -11.143  -0.358
  305    H    LEU  38           H        LEU  38  -7.526  -8.270  -0.098
  306    HA   LEU  38           HA       LEU  38  -4.835  -7.295  -0.160
  307    HB2  LEU  38           1HB      LEU  38  -6.121  -7.373  -2.026
  308    HB3  LEU  38           2HB      LEU  38  -7.417  -6.293  -1.466
  309    HG   LEU  38           HG       LEU  38  -5.688  -4.451  -1.341
  310   HD11  LEU  38          1HD1      LEU  38  -3.606  -4.779  -2.699
  311   HD12  LEU  38          2HD1      LEU  38  -3.670  -5.913  -1.332
  312   HD13  LEU  38          3HD1      LEU  38  -4.070  -6.475  -2.972
  313   HD21  LEU  38          3HD2      LEU  38  -7.291  -4.569  -3.156
  314   HD22  LEU  38          1HD2      LEU  38  -5.722  -3.998  -3.769
  315   HD23  LEU  38          2HD2      LEU  38  -6.231  -5.680  -4.057
  316    H    LEU  39           H        LEU  39  -7.826  -5.561   0.770
  317    HA   LEU  39           HA       LEU  39  -6.391  -3.238   1.687
  318    HB2  LEU  39           1HB      LEU  39  -8.629  -3.309   0.957
  319    HB3  LEU  39           2HB      LEU  39  -9.224  -4.188   2.385
  320    HG   LEU  39           HG       LEU  39  -8.418  -2.287   3.808
  321   HD11  LEU  39          1HD1      LEU  39  -7.953  -0.105   2.659
  322   HD12  LEU  39          2HD1      LEU  39  -6.769  -1.347   2.191
  323   HD13  LEU  39          3HD1      LEU  39  -8.096  -0.921   1.085
  324   HD21  LEU  39          3HD2      LEU  39 -10.759  -2.485   3.207
  325   HD22  LEU  39          1HD2      LEU  39 -10.286  -0.770   3.246
  326   HD23  LEU  39          2HD2      LEU  39 -10.473  -1.606   1.687
  327    H    VAL  40           H        VAL  40  -7.419  -6.208   3.266
  328    HA   VAL  40           HA       VAL  40  -6.969  -5.321   5.988
  329    HB   VAL  40           HB       VAL  40  -6.903  -8.089   4.721
  330   HG11  VAL  40          1HG1      VAL  40  -7.046  -8.937   7.038
  331   HG12  VAL  40          2HG1      VAL  40  -5.542  -8.020   6.782
  332   HG13  VAL  40          3HG1      VAL  40  -6.902  -7.275   7.655
  333   HG21  VAL  40          3HG2      VAL  40  -9.076  -7.022   4.607
  334   HG22  VAL  40          1HG2      VAL  40  -9.088  -8.360   5.780
  335   HG23  VAL  40          2HG2      VAL  40  -9.018  -6.677   6.353
  336    H    THR  41           H        THR  41  -4.860  -6.990   3.660
  337    HA   THR  41           HA       THR  41  -2.601  -7.106   5.440
  338    HB   THR  41           HB       THR  41  -2.705  -7.035   2.395
  339    HG1  THR  41           1HG      THR  41  -2.497  -9.200   4.254
  340   HG21  THR  41          3HG2      THR  41  -0.471  -7.861   4.292
  341   HG22  THR  41          1HG2      THR  41  -0.439  -8.014   2.520
  342   HG23  THR  41          2HG2      THR  41  -0.483  -6.402   3.274
  343    H    LEU  42           H        LEU  42  -3.662  -4.684   3.074
  344    HA   LEU  42           HA       LEU  42  -1.386  -2.956   3.387
  345    HB2  LEU  42           1HB      LEU  42  -4.206  -2.610   2.646
  346    HB3  LEU  42           2HB      LEU  42  -3.152  -1.178   2.575
  347    HG   LEU  42           HG       LEU  42  -2.710  -3.743   1.002
  348   HD11  LEU  42          1HD1      LEU  42  -3.448  -2.404  -0.987
  349   HD12  LEU  42          2HD1      LEU  42  -4.746  -2.537   0.220
  350   HD13  LEU  42          3HD1      LEU  42  -3.805  -1.033   0.088
  351   HD21  LEU  42          3HD2      LEU  42  -0.666  -2.532   1.478
  352   HD22  LEU  42          1HD2      LEU  42  -1.063  -2.395  -0.251
  353   HD23  LEU  42          2HD2      LEU  42  -1.375  -1.028   0.845
  354    H    THR  43           H        THR  43  -4.480  -3.162   5.112
  355    HA   THR  43           HA       THR  43  -3.982  -0.910   6.843
  356    HB   THR  43           HB       THR  43  -5.669  -3.407   7.301
  357    HG1  THR  43           1HG      THR  43  -7.364  -1.937   6.686
  358   HG21  THR  43          3HG2      THR  43  -5.658  -0.719   8.728
  359   HG22  THR  43          1HG2      THR  43  -6.809  -2.044   9.015
  360   HG23  THR  43          2HG2      THR  43  -5.088  -2.260   9.411
  361    H    ARG  44           H        ARG  44  -3.192  -4.356   7.083
  362    HA   ARG  44           HA       ARG  44  -2.160  -4.208   9.775
  363    HB2  ARG  44           1HB      ARG  44  -1.738  -6.162   7.568
  364    HB3  ARG  44           2HB      ARG  44  -0.953  -6.282   9.161
  365    HG2  ARG  44           1HG      ARG  44  -3.102  -6.465  10.260
  366    HG3  ARG  44           2HG      ARG  44  -3.952  -6.186   8.721
  367    HD2  ARG  44           1HD      ARG  44  -3.087  -8.271   7.863
  368    HD3  ARG  44           2HD      ARG  44  -2.229  -8.549   9.396
  369    HE   ARG  44           HE       ARG  44  -5.028  -8.393  10.043
  370   HH11  ARG  44          1HH1      ARG  44  -2.972 -10.440   8.106
  371   HH12  ARG  44          2HH1      ARG  44  -4.033 -11.802   8.410
  372   HH21  ARG  44          1HH2      ARG  44  -6.256  -9.941  10.393
  373   HH22  ARG  44          2HH2      ARG  44  -5.905 -11.519   9.713
  374    H    LEU  45           H        LEU  45  -0.709  -3.711   6.591
  375    HA   LEU  45           HA       LEU  45   1.994  -3.434   7.611
  376    HB2  LEU  45           1HB      LEU  45   0.556  -2.586   5.192
  377    HB3  LEU  45           2HB      LEU  45   2.300  -2.255   5.295
  378    HG   LEU  45           HG       LEU  45   0.993  -5.003   5.344
  379   HD11  LEU  45          1HD1      LEU  45   2.090  -5.291   3.105
  380   HD12  LEU  45          2HD1      LEU  45   0.935  -3.939   3.090
  381   HD13  LEU  45          3HD1      LEU  45   2.683  -3.616   3.198
  382   HD21  LEU  45          3HD2      LEU  45   3.007  -4.928   6.691
  383   HD22  LEU  45          1HD2      LEU  45   3.304  -5.866   5.208
  384   HD23  LEU  45          2HD2      LEU  45   3.916  -4.199   5.346
  385    H    HIS  46           H        HIS  46  -0.723  -1.250   7.190
  386    HA   HIS  46           HA       HIS  46   0.803   1.148   7.814
  387    HB2  HIS  46           1HB      HIS  46  -1.347   1.328   6.633
  388    HB3  HIS  46           2HB      HIS  46  -2.186   0.564   8.004
  389    HD2  HIS  46           2HD      HIS  46  -3.169   2.417   9.891
  390    HE1  HIS  46           1HE      HIS  46  -0.847   5.682   8.479
  391    HE2  HIS  46           2HE      HIS  46  -2.723   4.867  10.130
  392    H    GLN  47           H        GLN  47  -1.188  -1.105   9.716
  393    HA   GLN  47           HA       GLN  47  -1.001   0.457  12.141
  394    HB2  GLN  47           1HB      GLN  47  -1.637  -2.453  11.617
  395    HB3  GLN  47           2HB      GLN  47  -1.729  -1.683  13.219
  396    HG2  GLN  47           1HG      GLN  47  -3.651  -0.980  10.832
  397    HG3  GLN  47           2HG      GLN  47  -3.733  -1.915  12.344
  398   HE21  GLN  47          2HE2      GLN  47  -4.530   0.958  10.952
  399   HE22  GLN  47          1HE2      GLN  47  -4.574   1.974  12.354
  400    H    ARG  48           H        ARG  48   0.963  -2.096  10.727
  401    HA   ARG  48           HA       ARG  48   2.527  -2.460  13.189
  402    HB2  ARG  48           1HB      ARG  48   2.887  -3.536  10.430
  403    HB3  ARG  48           2HB      ARG  48   3.953  -3.873  11.812
  404    HG2  ARG  48           1HG      ARG  48   0.986  -4.478  11.798
  405    HG3  ARG  48           2HG      ARG  48   2.229  -5.651  11.302
  406    HD2  ARG  48           1HD      ARG  48   3.215  -5.536  13.506
  407    HD3  ARG  48           2HD      ARG  48   1.973  -4.361  14.000
  408    HE   ARG  48           HE       ARG  48   0.587  -6.772  13.244
  409   HH11  ARG  48          1HH1      ARG  48   2.896  -5.802  15.668
  410   HH12  ARG  48          2HH1      ARG  48   2.244  -6.994  16.776
  411   HH21  ARG  48          1HH2      ARG  48  -0.166  -8.148  14.497
  412   HH22  ARG  48          2HH2      ARG  48   0.499  -8.332  16.109
  413    H    GLY  49           H        GLY  49   2.493  -0.204  10.668
  414    HA2  GLY  49           1HA      GLY  49   3.771   1.766  10.672
  415    HA3  GLY  49           2HA      GLY  49   4.888   1.029  11.844
  416    H    VAL  50           H        VAL  50   3.924  -0.602   8.888
  417    HA   VAL  50           HA       VAL  50   6.723  -0.420   7.853
  418    HB   VAL  50           HB       VAL  50   4.318  -2.019   6.878
  419   HG11  VAL  50          1HG1      VAL  50   5.986  -3.202   5.487
  420   HG12  VAL  50          2HG1      VAL  50   5.925  -1.470   5.080
  421   HG13  VAL  50          3HG1      VAL  50   7.257  -2.105   6.076
  422   HG21  VAL  50          3HG2      VAL  50   5.071  -2.790   9.049
  423   HG22  VAL  50          1HG2      VAL  50   5.491  -3.964   7.780
  424   HG23  VAL  50          2HG2      VAL  50   6.745  -2.893   8.453
  425    H    ILE  51           H        ILE  51   3.404   0.321   6.812
  426    HA   ILE  51           HA       ILE  51   4.621   2.330   4.934
  427    HB   ILE  51           HB       ILE  51   2.728   1.933   3.400
  428   HG12  ILE  51          1HG1      ILE  51   1.979  -0.314   5.254
  429   HG13  ILE  51          2HG1      ILE  51   1.140   1.249   5.120
  430   HG21  ILE  51          1HG2      ILE  51   3.366  -0.306   2.574
  431   HG22  ILE  51          2HG2      ILE  51   4.800   0.633   3.046
  432   HG23  ILE  51          3HG2      ILE  51   4.182  -0.645   4.119
  433   HD11  ILE  51          3HD1      ILE  51   1.425  -0.810   2.905
  434   HD12  ILE  51          1HD1      ILE  51  -0.043  -0.506   3.859
  435   HD13  ILE  51          2HD1      ILE  51   0.588   0.753   2.771
  436    H    TYR  52           H        TYR  52   3.188   4.068   4.311
  437    HA   TYR  52           HA       TYR  52   1.491   4.865   6.657
  438    HB2  TYR  52           1HB      TYR  52   3.494   6.237   6.353
  439    HB3  TYR  52           2HB      TYR  52   3.008   6.569   4.672
  440    HD1  TYR  52           1HD      TYR  52   1.934   7.035   8.218
  441    HD2  TYR  52           2HD      TYR  52   1.571   8.375   4.187
  442    HE1  TYR  52           1HE      TYR  52   0.614   8.982   8.994
  443    HE2  TYR  52           2HE      TYR  52   0.252  10.324   4.943
  444    HH   TYR  52           HH       TYR  52  -0.503  10.867   8.393
  445    H    ARG  53           H        ARG  53  -0.567   4.643   6.291
  446    HA   ARG  53           HA       ARG  53  -1.721   4.947   3.612
  447    HB2  ARG  53           1HB      ARG  53  -2.618   3.393   5.244
  448    HB3  ARG  53           2HB      ARG  53  -3.111   4.777   6.247
  449    HG2  ARG  53           1HG      ARG  53  -4.590   5.565   4.466
  450    HG3  ARG  53           2HG      ARG  53  -4.072   4.217   3.425
  451    HD2  ARG  53           1HD      ARG  53  -6.135   3.595   4.245
  452    HD3  ARG  53           2HD      ARG  53  -4.958   2.699   5.235
  453    HE   ARG  53           HE       ARG  53  -5.748   5.042   6.734
  454   HH11  ARG  53          1HH1      ARG  53  -7.214   2.115   5.535
  455   HH12  ARG  53          2HH1      ARG  53  -8.335   2.117   6.880
  456   HH21  ARG  53          1HH2      ARG  53  -7.030   5.063   8.279
  457   HH22  ARG  53          2HH2      ARG  53  -8.233   3.798   8.447
  458    H    LYS  54           H        LYS  54  -2.486   6.662   2.653
  459    HA   LYS  54           HA       LYS  54  -3.147   9.057   4.314
  460    HB2  LYS  54           1HB      LYS  54  -0.869   9.289   3.351
  461    HB3  LYS  54           2HB      LYS  54  -1.582   9.107   1.730
  462    HG2  LYS  54           1HG      LYS  54  -2.864  11.154   2.018
  463    HG3  LYS  54           2HG      LYS  54  -2.286  11.313   3.695
  464    HD2  LYS  54           1HD      LYS  54   0.020  11.562   2.889
  465    HD3  LYS  54           2HD      LYS  54  -0.540  11.371   1.209
  466    HE2  LYS  54           1HE      LYS  54  -1.888  13.396   1.403
  467    HE3  LYS  54           2HE      LYS  54  -1.407  13.575   3.106
  468    HZ1  LYS  54           3HZ      LYS  54   0.416  13.693   0.789
  469    HZ2  LYS  54           1HZ      LYS  54  -0.109  14.989   1.664
  470    HZ3  LYS  54           2HZ      LYS  54   0.862  13.858   2.369
  471    H    TRP  55           H        TRP  55  -4.982   9.998   3.857
  472    HA   TRP  55           HA       TRP  55  -6.631   8.886   1.684
  473    HB2  TRP  55           1HB      TRP  55  -7.116  10.896   3.911
  474    HB3  TRP  55           2HB      TRP  55  -8.307  10.603   2.621
  475    HD1  TRP  55           HD       TRP  55  -7.067   9.352   5.781
  476    HE1  TRP  55           1HE      TRP  55  -8.405   7.120   6.516
  477    HE3  TRP  55           3HE      TRP  55  -9.439   8.437   1.380
  478    HZ2  TRP  55           2HZ      TRP  55 -10.158   5.382   5.276
  479    HZ3  TRP  55           3HZ      TRP  55 -10.910   6.529   1.167
  480    HH2  TRP  55           HH       TRP  55 -11.306   4.994   3.043
  481    H    ARG  56           H        ARG  56  -6.843   9.625  -0.267
  482    HA   ARG  56           HA       ARG  56  -5.970  12.445  -0.809
  483    HB2  ARG  56           1HB      ARG  56  -5.941  10.123  -2.683
  484    HB3  ARG  56           2HB      ARG  56  -5.503  11.807  -3.053
  485    HG2  ARG  56           1HG      ARG  56  -4.086  10.078  -1.005
  486    HG3  ARG  56           2HG      ARG  56  -3.547  10.282  -2.690
  487    HD2  ARG  56           1HD      ARG  56  -3.729  12.376  -0.552
  488    HD3  ARG  56           2HD      ARG  56  -2.263  11.683  -1.285
  489    HE   ARG  56           HE       ARG  56  -3.881  13.849  -2.527
  490   HH11  ARG  56          1HH1      ARG  56  -1.447  11.406  -3.039
  491   HH12  ARG  56          2HH1      ARG  56  -0.917  12.228  -4.492
  492   HH21  ARG  56          1HH2      ARG  56  -3.281  14.807  -4.186
  493   HH22  ARG  56          2HH2      ARG  56  -1.964  14.169  -5.147
  494    H    HIS  57           H        HIS  57  -7.104  13.681  -2.312
  495    HA   HIS  57           HA       HIS  57  -9.981  12.853  -2.521
  496    HB2  HIS  57           1HB      HIS  57  -8.799  15.658  -2.298
  497    HB3  HIS  57           2HB      HIS  57 -10.526  15.261  -2.451
  498    HD2  HIS  57           2HD      HIS  57  -7.908  15.813   0.376
  499    HE1  HIS  57           1HE      HIS  57 -11.315  13.891   2.033
  500    HE2  HIS  57           2HE      HIS  57  -9.056  15.151   2.498
  501    H    PHE  58           H        PHE  58 -10.266  12.047  -4.466
  502    HA   PHE  58           HA       PHE  58  -9.278  13.673  -6.787
  503    HB2  PHE  58           1HB      PHE  58 -10.031  10.723  -6.606
  504    HB3  PHE  58           2HB      PHE  58  -9.612  11.575  -8.110
  505    HD1  PHE  58           2HD      PHE  58  -7.337  12.352  -8.502
  506    HD2  PHE  58           1HD      PHE  58  -8.376  10.058  -5.051
  507    HE1  PHE  58           2HE      PHE  58  -4.949  11.840  -8.127
  508    HE2  PHE  58           1HE      PHE  58  -5.987   9.545  -4.671
  509    HZ   PHE  58           HZ       PHE  58  -4.273  10.437  -6.209
  510    H    SER  59           H        SER  59 -10.715  15.006  -7.537
  511    HA   SER  59           HA       SER  59 -12.808  15.820  -8.351
  512    HB2  SER  59           1HB      SER  59 -13.513  12.948  -8.449
  513    HB3  SER  59           2HB      SER  59 -14.379  14.321  -9.179
  514    HG   SER  59           HG       SER  59 -12.971  13.272 -10.651
  515    H    GLY  60           H        GLY  60 -12.209  15.183  -5.376
  516    HA2  GLY  60           1HA      GLY  60 -13.490  15.962  -3.540
  517    HA3  GLY  60           2HA      GLY  60 -14.977  15.735  -4.491
  518    H    ARG  61           H        ARG  61 -13.342  13.006  -5.092
  519    HA   ARG  61           HA       ARG  61 -14.818  11.536  -2.959
  520    HB2  ARG  61           1HB      ARG  61 -13.681  10.604  -5.555
  521    HB3  ARG  61           2HB      ARG  61 -14.423   9.563  -4.317
  522    HG2  ARG  61           1HG      ARG  61 -16.541  10.811  -4.564
  523    HG3  ARG  61           2HG      ARG  61 -15.791  11.806  -5.837
  524    HD2  ARG  61           1HD      ARG  61 -15.446   9.748  -7.146
  525    HD3  ARG  61           2HD      ARG  61 -16.371   8.865  -5.909
  526    HE   ARG  61           HE       ARG  61 -18.079  10.957  -6.947
  527   HH11  ARG  61          1HH1      ARG  61 -16.555   8.038  -8.094
  528   HH12  ARG  61          2HH1      ARG  61 -17.866   7.793  -9.230
  529   HH21  ARG  61          1HH2      ARG  61 -19.584  10.693  -8.249
  530   HH22  ARG  61          2HH2      ARG  61 -19.593   9.307  -9.320
  531    H    LYS  62           H        LYS  62 -13.922  10.003  -1.661
  532    HA   LYS  62           HA       LYS  62 -11.062  10.535  -1.076
  533    HB2  LYS  62           1HB      LYS  62 -13.222   9.018   0.395
  534    HB3  LYS  62           2HB      LYS  62 -11.539   9.179   0.952
  535    HG2  LYS  62           1HG      LYS  62 -11.810  11.615   1.101
  536    HG3  LYS  62           2HG      LYS  62 -13.485  11.471   0.516
  537    HD2  LYS  62           1HD      LYS  62 -14.055  10.108   2.487
  538    HD3  LYS  62           2HD      LYS  62 -12.380  10.258   3.072
  539    HE2  LYS  62           1HE      LYS  62 -12.641  12.693   3.217
  540    HE3  LYS  62           2HE      LYS  62 -14.307  12.556   2.611
  541    HZ1  LYS  62           3HZ      LYS  62 -13.300  11.401   5.133
  542    HZ2  LYS  62           1HZ      LYS  62 -14.245  12.748   5.004
  543    HZ3  LYS  62           2HZ      LYS  62 -14.846  11.274   4.571
  544    H    TYR  63           H        TYR  63  -9.477   9.323  -1.708
  545    HA   TYR  63           HA       TYR  63  -9.980   6.385  -2.016
  546    HB2  TYR  63           1HB      TYR  63  -8.349   8.189  -3.814
  547    HB3  TYR  63           2HB      TYR  63  -8.327   6.409  -3.861
  548    HD1  TYR  63           2HD      TYR  63 -10.256   5.165  -4.720
  549    HD2  TYR  63           1HD      TYR  63 -10.251   9.429  -4.685
  550    HE1  TYR  63           2HE      TYR  63 -12.192   5.169  -6.256
  551    HE2  TYR  63           1HE      TYR  63 -12.191   9.451  -6.224
  552    HH   TYR  63           HH       TYR  63 -13.677   6.439  -7.428
  553    H    ARG  64           H        ARG  64  -8.402   5.012  -1.387
  554    HA   ARG  64           HA       ARG  64  -6.505   6.116   0.567
  555    HB2  ARG  64           1HB      ARG  64  -7.029   3.307  -0.295
  556    HB3  ARG  64           2HB      ARG  64  -5.878   3.815   0.964
  557    HG2  ARG  64           1HG      ARG  64  -7.714   4.752   2.286
  558    HG3  ARG  64           2HG      ARG  64  -8.874   4.291   1.017
  559    HD2  ARG  64           1HD      ARG  64  -8.303   1.946   1.398
  560    HD3  ARG  64           2HD      ARG  64  -7.234   2.452   2.728
  561    HE   ARG  64           HE       ARG  64  -9.289   2.867   4.075
  562   HH11  ARG  64          1HH1      ARG  64 -10.093   1.985   0.798
  563   HH12  ARG  64          2HH1      ARG  64 -11.747   1.670   1.283
  564   HH21  ARG  64          1HH2      ARG  64 -11.181   2.517   4.644
  565   HH22  ARG  64          2HH2      ARG  64 -12.371   1.973   3.476
  566    H    GLU  65           H        GLU  65  -4.469   6.596   0.312
  567    HA   GLU  65           HA       GLU  65  -2.982   5.244  -1.914
  568    HB2  GLU  65           1HB      GLU  65  -3.456   7.620  -2.430
  569    HB3  GLU  65           2HB      GLU  65  -2.600   8.078  -0.936
  570    HG2  GLU  65           1HG      GLU  65  -0.469   7.089  -1.898
  571    HG3  GLU  65           2HG      GLU  65  -1.472   6.620  -3.291
  572    H    TYR  66           H        TYR  66  -1.146   4.291  -1.423
  573    HA   TYR  66           HA       TYR  66  -0.317   4.469   1.457
  574    HB2  TYR  66           1HB      TYR  66  -0.248   2.133  -0.465
  575    HB3  TYR  66           2HB      TYR  66   0.433   2.135   1.179
  576    HD1  TYR  66           1HD      TYR  66  -2.668   2.074  -0.807
  577    HD2  TYR  66           2HD      TYR  66  -1.030   2.060   3.131
  578    HE1  TYR  66           1HE      TYR  66  -4.870   1.391   0.099
  579    HE2  TYR  66           2HE      TYR  66  -3.220   1.378   4.051
  580    HH   TYR  66           HH       TYR  66  -5.389   0.857   3.588
  581    H    CYS  67           H        CYS  67   1.595   5.208   1.875
  582    HA   CYS  67           HA       CYS  67   3.659   5.300  -0.345
  583    HB2  CYS  67           1HB      CYS  67   2.613   7.419   0.453
  584    HB3  CYS  67           2HB      CYS  67   3.136   7.032   2.112
  585    HG   CYS  67           HG       CYS  67   4.510   8.948   1.156
  586    H    LEU  68           H        LEU  68   5.437   4.123  -0.037
  587    HA   LEU  68           HA       LEU  68   6.066   3.120   2.700
  588    HB2  LEU  68           1HB      LEU  68   5.934   1.550   1.056
  589    HB3  LEU  68           2HB      LEU  68   7.065   2.317  -0.083
  590    HG   LEU  68           HG       LEU  68   8.879   2.013   1.628
  591   HD11  LEU  68          1HD1      LEU  68   8.463   0.346   3.457
  592   HD12  LEU  68          2HD1      LEU  68   7.405   1.766   3.623
  593   HD13  LEU  68          3HD1      LEU  68   6.758   0.247   2.957
  594   HD21  LEU  68          3HD2      LEU  68   8.672   0.500  -0.254
  595   HD22  LEU  68          1HD2      LEU  68   9.200  -0.397   1.190
  596   HD23  LEU  68          2HD2      LEU  68   7.509  -0.503   0.643
  597    H    LYS  69           H        LYS  69   7.398   5.094   0.088
  598    HA   LYS  69           HA       LYS  69  10.000   5.516   1.072
  599    HB2  LYS  69           1HB      LYS  69   9.156   6.354  -1.067
  600    HB3  LYS  69           2HB      LYS  69   8.128   7.520  -0.199
  601    HG2  LYS  69           1HG      LYS  69  10.103   8.654   0.681
  602    HG3  LYS  69           2HG      LYS  69  11.163   7.455  -0.099
  603    HD2  LYS  69           1HD      LYS  69  10.351   8.161  -2.308
  604    HD3  LYS  69           2HD      LYS  69   9.265   9.343  -1.538
  605    HE2  LYS  69           1HE      LYS  69  11.208  10.505  -0.579
  606    HE3  LYS  69           2HE      LYS  69  12.294   9.326  -1.351
  607    HZ1  LYS  69           3HZ      LYS  69  10.484  11.174  -2.770
  608    HZ2  LYS  69           1HZ      LYS  69  12.119  11.348  -2.635
  609    HZ3  LYS  69           2HZ      LYS  69  11.491  10.081  -3.485
  610    H    HIS  70           H        HIS  70   6.963   6.994   2.129
  611    HA   HIS  70           HA       HIS  70   8.098   8.962   3.856
  612    HB2  HIS  70           1HB      HIS  70   5.642   8.746   3.158
  613    HB3  HIS  70           2HB      HIS  70   5.506   7.457   4.378
  614    HD2  HIS  70           2HD      HIS  70   7.691  10.388   5.753
  615    HE1  HIS  70           1HE      HIS  70   3.683  10.925   7.055
  616    HE2  HIS  70           2HE      HIS  70   6.193  11.670   7.292
  617    H    ARG  71           H        ARG  71   7.243   5.563   4.460
  618    HA   ARG  71           HA       ARG  71   8.113   5.820   7.275
  619    HB2  ARG  71           1HB      ARG  71   6.808   3.667   5.705
  620    HB3  ARG  71           2HB      ARG  71   7.582   3.350   7.277
  621    HG2  ARG  71           1HG      ARG  71   5.429   5.441   6.851
  622    HG3  ARG  71           2HG      ARG  71   5.092   3.767   7.355
  623    HD2  ARG  71           1HD      ARG  71   6.770   5.763   8.842
  624    HD3  ARG  71           2HD      ARG  71   5.091   5.308   9.214
  625    HE   ARG  71           HE       ARG  71   6.458   2.883   9.520
  626   HH11  ARG  71          1HH1      ARG  71   7.154   6.080  10.726
  627   HH12  ARG  71          2HH1      ARG  71   7.907   5.385  12.148
  628   HH21  ARG  71          1HH2      ARG  71   7.327   2.073  11.137
  629   HH22  ARG  71          2HH2      ARG  71   8.008   3.101  12.384
  630    H    ASP  72           H        ASP  72   9.551   5.129   4.284
  631    HA   ASP  72           HA       ASP  72  11.792   3.606   5.398
  632    HB2  ASP  72           1HB      ASP  72  11.481   5.163   2.761
  633    HB3  ASP  72           2HB      ASP  72  12.919   4.341   3.413
  634    H    GLU  73           H        GLU  73  11.115   7.023   4.707
  635    HA   GLU  73           HA       GLU  73  13.701   7.926   5.700
  636    HB2  GLU  73           1HB      GLU  73  11.066   9.330   5.245
  637    HB3  GLU  73           2HB      GLU  73  12.561  10.142   5.770
  638    HG2  GLU  73           1HG      GLU  73  13.663   9.483   3.595
  639    HG3  GLU  73           2HG      GLU  73  12.166   8.587   3.247
  640    H    LEU  74           H        LEU  74  10.465   7.558   7.102
  641    HA   LEU  74           HA       LEU  74  11.178   8.685   9.666
  642    HB2  LEU  74           1HB      LEU  74   9.138   6.815   8.677
  643    HB3  LEU  74           2HB      LEU  74   9.077   7.287  10.390
  644    HG   LEU  74           HG       LEU  74   8.821   9.161   8.006
  645   HD11  LEU  74          1HD1      LEU  74   6.451   9.422   8.782
  646   HD12  LEU  74          2HD1      LEU  74   6.805   7.734   8.346
  647   HD13  LEU  74          3HD1      LEU  74   6.751   8.220  10.059
  648   HD21  LEU  74          3HD2      LEU  74   9.907  10.233   9.889
  649   HD22  LEU  74          1HD2      LEU  74   8.261  10.880   9.688
  650   HD23  LEU  74          2HD2      LEU  74   8.604   9.703  10.980
  651    H    ALA  75           H        ALA  75  11.356   5.438   8.292
  652    HA   ALA  75           HA       ALA  75  12.093   4.089  10.698
  653    HB1  ALA  75           1HB      ALA  75  13.062   2.389   9.198
  654    HB2  ALA  75           2HB      ALA  75  11.447   2.899   8.651
  655    HB3  ALA  75           3HB      ALA  75  12.901   3.510   7.826
  656    H    ASP  76           H        ASP  76  14.039   5.800   8.262
  657    HA   ASP  76           HA       ASP  76  16.592   5.266   9.464
  658    HB2  ASP  76           1HB      ASP  76  15.664   7.614   7.702
  659    HB3  ASP  76           2HB      ASP  76  17.276   7.289   8.389
  660    H    LEU  77           H        LEU  77  14.130   7.713  10.099
  661    HA   LEU  77           HA       LEU  77  15.781   9.157  12.020
  662    HB2  LEU  77           1HB      LEU  77  12.899   8.972  11.457
  663    HB3  LEU  77           2HB      LEU  77  13.468  10.148  12.664
  664    HG   LEU  77           HG       LEU  77  14.165  10.125   9.701
  665   HD11  LEU  77          1HD1      LEU  77  12.842  12.256   9.638
  666   HD12  LEU  77          2HD1      LEU  77  11.837  10.886  10.165
  667   HD13  LEU  77          3HD1      LEU  77  12.456  12.049  11.361
  668   HD21  LEU  77          3HD2      LEU  77  16.016  10.924  11.047
  669   HD22  LEU  77          1HD2      LEU  77  15.283  12.280  10.158
  670   HD23  LEU  77          2HD2      LEU  77  14.946  12.068  11.893
  671    H    GLU  78           H        GLU  78  13.518   6.470  12.166
  672    HA   GLU  78           HA       GLU  78  13.446   6.342  15.065
  673    HB2  GLU  78           1HB      GLU  78  12.899   4.348  12.871
  674    HB3  GLU  78           2HB      GLU  78  12.759   3.956  14.601
  675    HG2  GLU  78           1HG      GLU  78  10.925   5.639  14.848
  676    HG3  GLU  78           2HG      GLU  78  11.301   6.144  13.186
  677    H    HIS  79           H        HIS  79  15.655   5.185  12.607
  678    HA   HIS  79           HA       HIS  79  17.090   3.416  14.448
  679    HB2  HIS  79           1HB      HIS  79  17.836   4.504  11.695
  680    HB3  HIS  79           2HB      HIS  79  18.742   3.261  12.589
  681    HD2  HIS  79           2HD      HIS  79  15.402   1.883  13.291
  682    HE1  HIS  79           1HE      HIS  79  16.151   0.812   9.249
  683    HE2  HIS  79           2HE      HIS  79  14.700   0.401  11.403
  Start of MODEL    9
    1    H    LYS   3           H        LYS   3   4.699 -12.741  -9.126
    2    HA   LYS   3           HA       LYS   3   4.686 -10.500  -7.390
    3    HB2  LYS   3           1HB      LYS   3   2.341 -10.648  -9.289
    4    HB3  LYS   3           2HB      LYS   3   2.392  -9.683  -7.794
    5    HG2  LYS   3           1HG      LYS   3   4.266  -8.368  -8.713
    6    HG3  LYS   3           2HG      LYS   3   4.195  -9.323 -10.213
    7    HD2  LYS   3           1HD      LYS   3   1.876  -8.550 -10.581
    8    HD3  LYS   3           2HD      LYS   3   1.978  -7.570  -9.099
    9    HE2  LYS   3           1HE      LYS   3   3.777  -6.244 -10.054
   10    HE3  LYS   3           2HE      LYS   3   3.797  -7.269 -11.508
   11    HZ1  LYS   3           3HZ      LYS   3   1.547  -5.571 -10.639
   12    HZ2  LYS   3           1HZ      LYS   3   2.584  -5.229 -11.875
   13    HZ3  LYS   3           2HZ      LYS   3   1.565  -6.521 -11.987
   14    H    ALA   4           H        ALA   4   3.201 -13.387  -8.645
   15    HA   ALA   4           HA       ALA   4   1.475 -13.801  -6.342
   16    HB1  ALA   4           1HB      ALA   4   1.143 -16.050  -7.299
   17    HB2  ALA   4           2HB      ALA   4   0.939 -14.780  -8.529
   18    HB3  ALA   4           3HB      ALA   4   2.438 -15.737  -8.478
   19    H    LYS   5           H        LYS   5   4.794 -14.500  -7.128
   20    HA   LYS   5           HA       LYS   5   5.218 -16.491  -5.062
   21    HB2  LYS   5           1HB      LYS   5   7.070 -14.604  -6.519
   22    HB3  LYS   5           2HB      LYS   5   7.615 -15.819  -5.339
   23    HG2  LYS   5           1HG      LYS   5   6.702 -17.611  -6.756
   24    HG3  LYS   5           2HG      LYS   5   6.150 -16.398  -7.935
   25    HD2  LYS   5           1HD      LYS   5   8.479 -15.683  -8.293
   26    HD3  LYS   5           2HD      LYS   5   9.031 -16.897  -7.115
   27    HE2  LYS   5           1HE      LYS   5   8.134 -18.691  -8.524
   28    HE3  LYS   5           2HE      LYS   5   7.547 -17.487  -9.695
   29    HZ1  LYS   5           3HZ      LYS   5  10.373 -17.952  -8.985
   30    HZ2  LYS   5           1HZ      LYS   5   9.640 -18.445 -10.379
   31    HZ3  LYS   5           2HZ      LYS   5   9.829 -16.835 -10.071
   32    H    LEU   6           H        LEU   6   5.185 -12.983  -5.121
   33    HA   LEU   6           HA       LEU   6   6.205 -12.796  -2.366
   34    HB2  LEU   6           1HB      LEU   6   4.884 -10.911  -4.206
   35    HB3  LEU   6           2HB      LEU   6   5.577 -10.333  -2.672
   36    HG   LEU   6           HG       LEU   6   7.117 -11.546  -5.001
   37   HD11  LEU   6          1HD1      LEU   6   8.092  -9.244  -5.220
   38   HD12  LEU   6          2HD1      LEU   6   6.326  -9.222  -5.440
   39   HD13  LEU   6          3HD1      LEU   6   7.037  -8.689  -3.898
   40   HD21  LEU   6          3HD2      LEU   6   8.116 -12.127  -2.869
   41   HD22  LEU   6          1HD2      LEU   6   9.136 -10.938  -3.714
   42   HD23  LEU   6          2HD2      LEU   6   8.098 -10.421  -2.364
   43    H    SER   7           H        SER   7   5.092 -12.243  -0.540
   44    HA   SER   7           HA       SER   7   2.273 -12.956  -0.265
   45    HB2  SER   7           1HB      SER   7   2.425 -12.384   1.880
   46    HB3  SER   7           2HB      SER   7   4.000 -13.092   1.456
   47    HG   SER   7           HG       SER   7   4.180 -11.178   2.710
   48    H    LEU   8           H        LEU   8   0.744 -11.335   0.718
   49    HA   LEU   8           HA       LEU   8   0.325  -9.064  -1.001
   50    HB2  LEU   8           1HB      LEU   8  -0.661  -9.897   1.639
   51    HB3  LEU   8           2HB      LEU   8  -1.366  -8.441   0.897
   52    HG   LEU   8           HG       LEU   8  -1.473 -11.270  -0.226
   53   HD11  LEU   8          1HD1      LEU   8  -3.932 -11.081   0.233
   54   HD12  LEU   8          2HD1      LEU   8  -2.982 -10.923   1.728
   55   HD13  LEU   8          3HD1      LEU   8  -3.662  -9.475   0.947
   56   HD21  LEU   8          3HD2      LEU   8  -1.336  -9.610  -1.989
   57   HD22  LEU   8          1HD2      LEU   8  -2.973 -10.310  -1.939
   58   HD23  LEU   8          2HD2      LEU   8  -2.677  -8.688  -1.265
   59    H    THR   9           H        THR   9   1.979  -9.478   2.067
   60    HA   THR   9           HA       THR   9   2.266  -6.577   2.471
   61    HB   THR   9           HB       THR   9   3.714  -7.225   4.373
   62    HG1  THR   9           1HG      THR   9   3.952  -9.492   4.797
   63   HG21  THR   9          3HG2      THR   9   1.140  -8.843   4.213
   64   HG22  THR   9          1HG2      THR   9   2.004  -8.408   5.706
   65   HG23  THR   9          2HG2      THR   9   1.267  -7.137   4.699
   66    H    GLN  10           H        GLN  10   4.229  -9.249   1.252
   67    HA   GLN  10           HA       GLN  10   6.635  -7.646   0.971
   68    HB2  GLN  10           1HB      GLN  10   5.698 -10.234  -0.273
   69    HB3  GLN  10           2HB      GLN  10   7.282  -9.499  -0.612
   70    HG2  GLN  10           1HG      GLN  10   7.928  -9.901   1.923
   71    HG3  GLN  10           2HG      GLN  10   6.173 -10.193   1.964
   72   HE21  GLN  10          2HE2      GLN  10   8.457 -11.881   2.828
   73   HE22  GLN  10          1HE2      GLN  10   8.286 -13.373   1.964
   74    H    LEU  11           H        LEU  11   3.993  -8.557  -1.224
   75    HA   LEU  11           HA       LEU  11   5.190  -7.368  -3.559
   76    HB2  LEU  11           1HB      LEU  11   3.574  -9.003  -3.653
   77    HB3  LEU  11           2HB      LEU  11   2.276  -8.052  -2.894
   78    HG   LEU  11           HG       LEU  11   2.390  -6.453  -4.807
   79   HD11  LEU  11          1HD1      LEU  11   3.599  -7.184  -6.880
   80   HD12  LEU  11          2HD1      LEU  11   4.724  -6.955  -5.520
   81   HD13  LEU  11          3HD1      LEU  11   4.225  -8.595  -5.997
   82   HD21  LEU  11          3HD2      LEU  11   0.707  -8.199  -4.771
   83   HD22  LEU  11          1HD2      LEU  11   1.254  -7.915  -6.441
   84   HD23  LEU  11          2HD2      LEU  11   1.834  -9.340  -5.544
   85    H    ILE  12           H        ILE  12   2.771  -6.154  -1.240
   86    HA   ILE  12           HA       ILE  12   2.504  -3.559  -2.488
   87    HB   ILE  12           HB       ILE  12   2.030  -4.529   0.365
   88   HG12  ILE  12          1HG1      ILE  12   0.071  -3.735  -1.771
   89   HG13  ILE  12          2HG1      ILE  12   0.606  -5.403  -1.465
   90   HG21  ILE  12          1HG2      ILE  12   0.858  -2.382   0.725
   91   HG22  ILE  12          2HG2      ILE  12   2.581  -2.118   0.368
   92   HG23  ILE  12          3HG2      ILE  12   1.358  -1.837  -0.894
   93   HD11  ILE  12          3HD1      ILE  12  -0.829  -3.605   0.519
   94   HD12  ILE  12          1HD1      ILE  12  -1.560  -4.953  -0.382
   95   HD13  ILE  12          2HD1      ILE  12  -0.293  -5.274   0.825
   96    H    LEU  13           H        LEU  13   4.624  -4.730   0.105
   97    HA   LEU  13           HA       LEU  13   5.753  -2.178   0.716
   98    HB2  LEU  13           1HB      LEU  13   5.917  -3.986   2.108
   99    HB3  LEU  13           2HB      LEU  13   6.874  -5.015   1.018
  100    HG   LEU  13           HG       LEU  13   8.703  -3.284   1.131
  101   HD11  LEU  13          1HD1      LEU  13   8.625  -1.675   3.054
  102   HD12  LEU  13          2HD1      LEU  13   7.295  -1.380   1.910
  103   HD13  LEU  13          3HD1      LEU  13   6.981  -2.238   3.438
  104   HD21  LEU  13          3HD2      LEU  13   8.828  -5.334   2.419
  105   HD22  LEU  13          1HD2      LEU  13   9.517  -3.986   3.356
  106   HD23  LEU  13          2HD2      LEU  13   7.889  -4.597   3.738
  107    H    ILE  14           H        ILE  14   6.836  -4.704  -1.552
  108    HA   ILE  14           HA       ILE  14   9.236  -3.229  -2.303
  109    HB   ILE  14           HB       ILE  14   7.759  -5.570  -3.583
  110   HG12  ILE  14          1HG1      ILE  14  10.411  -5.502  -2.178
  111   HG13  ILE  14          2HG1      ILE  14   8.866  -5.878  -1.378
  112   HG21  ILE  14          1HG2      ILE  14   9.757  -5.828  -5.014
  113   HG22  ILE  14          2HG2      ILE  14   8.959  -4.266  -5.307
  114   HG23  ILE  14          3HG2      ILE  14  10.442  -4.336  -4.328
  115   HD11  ILE  14          3HD1      ILE  14  10.101  -7.428  -3.683
  116   HD12  ILE  14          1HD1      ILE  14  10.082  -7.935  -1.979
  117   HD13  ILE  14          2HD1      ILE  14   8.557  -7.804  -2.884
  118    H    ARG  15           H        ARG  15   6.041  -3.614  -3.799
  119    HA   ARG  15           HA       ARG  15   6.808  -2.076  -6.147
  120    HB2  ARG  15           1HB      ARG  15   4.097  -2.832  -5.151
  121    HB3  ARG  15           2HB      ARG  15   4.483  -2.087  -6.720
  122    HG2  ARG  15           1HG      ARG  15   5.512  -4.785  -5.787
  123    HG3  ARG  15           2HG      ARG  15   4.093  -4.552  -6.839
  124    HD2  ARG  15           1HD      ARG  15   5.526  -3.496  -8.497
  125    HD3  ARG  15           2HD      ARG  15   6.933  -3.798  -7.452
  126    HE   ARG  15           HE       ARG  15   5.649  -6.339  -8.141
  127   HH11  ARG  15          1HH1      ARG  15   7.645  -3.844  -9.538
  128   HH12  ARG  15          2HH1      ARG  15   8.353  -5.016 -10.631
  129   HH21  ARG  15          1HH2      ARG  15   6.447  -7.691  -9.391
  130   HH22  ARG  15          2HH2      ARG  15   7.671  -7.210 -10.549
  131    H    LEU  16           H        LEU  16   5.247  -1.331  -3.072
  132    HA   LEU  16           HA       LEU  16   4.627   1.415  -3.773
  133    HB2  LEU  16           1HB      LEU  16   3.533   0.254  -2.104
  134    HB3  LEU  16           2HB      LEU  16   4.951   0.027  -1.057
  135    HG   LEU  16           HG       LEU  16   5.117   2.518  -0.842
  136   HD11  LEU  16          1HD1      LEU  16   3.105   3.872  -1.483
  137   HD12  LEU  16          2HD1      LEU  16   3.850   3.109  -2.907
  138   HD13  LEU  16          3HD1      LEU  16   2.372   2.417  -2.198
  139   HD21  LEU  16          3HD2      LEU  16   4.081   1.191   0.903
  140   HD22  LEU  16          1HD2      LEU  16   3.235   2.749   0.741
  141   HD23  LEU  16          2HD2      LEU  16   2.511   1.268   0.069
  142    H    SER  17           H        SER  17   7.403  -0.192  -2.275
  143    HA   SER  17           HA       SER  17   8.895   2.134  -1.468
  144    HB2  SER  17           1HB      SER  17   9.384  -0.005  -0.678
  145    HB3  SER  17           2HB      SER  17   9.852  -0.536  -2.309
  146    HG   SER  17           HG       SER  17  11.053   1.563  -0.823
  147    H    ASN  18           H        ASN  18   8.723   0.316  -4.548
  148    HA   ASN  18           HA       ASN  18  10.851   1.728  -5.861
  149    HB2  ASN  18           1HB      ASN  18   8.516   0.173  -7.208
  150    HB3  ASN  18           2HB      ASN  18   9.905   1.123  -7.786
  151   HD21  ASN  18          2HD2      ASN  18   9.190  -1.751  -8.017
  152   HD22  ASN  18          1HD2      ASN  18  10.572  -2.610  -7.424
  153    H    ARG  19           H        ARG  19   7.380   2.359  -5.597
  154    HA   ARG  19           HA       ARG  19   7.679   4.738  -7.363
  155    HB2  ARG  19           1HB      ARG  19   5.238   3.513  -6.159
  156    HB3  ARG  19           2HB      ARG  19   5.293   4.945  -7.211
  157    HG2  ARG  19           1HG      ARG  19   6.327   2.231  -8.061
  158    HG3  ARG  19           2HG      ARG  19   4.646   2.754  -8.326
  159    HD2  ARG  19           1HD      ARG  19   5.482   4.649  -9.623
  160    HD3  ARG  19           2HD      ARG  19   7.135   4.024  -9.418
  161    HE   ARG  19           HE       ARG  19   5.645   1.956 -10.747
  162   HH11  ARG  19          1HH1      ARG  19   6.565   5.252 -11.415
  163   HH12  ARG  19          2HH1      ARG  19   6.601   4.900 -13.132
  164   HH21  ARG  19          1HH2      ARG  19   5.673   1.541 -12.710
  165   HH22  ARG  19          2HH2      ARG  19   6.092   2.785 -13.873
  166    H    GLY  20           H        GLY  20   7.705   3.914  -4.052
  167    HA2  GLY  20           1HA      GLY  20   8.069   5.366  -2.242
  168    HA3  GLY  20           2HA      GLY  20   7.749   6.756  -3.306
  169    H    CYS  21           H        CYS  21   5.379   6.778  -4.152
  170    HA   CYS  21           HA       CYS  21   3.469   6.070  -1.903
  171    HB2  CYS  21           1HB      CYS  21   3.765   8.612  -3.565
  172    HB3  CYS  21           2HB      CYS  21   2.552   8.323  -2.294
  173    HG   CYS  21           HG       CYS  21   4.262  10.032  -1.520
  174    H    GLN  22           H        GLN  22   1.586   5.196  -2.551
  175    HA   GLN  22           HA       GLN  22   0.703   5.507  -5.368
  176    HB2  GLN  22           1HB      GLN  22   1.182   2.871  -3.966
  177    HB3  GLN  22           2HB      GLN  22   0.200   3.057  -5.438
  178    HG2  GLN  22           1HG      GLN  22   3.276   3.718  -5.434
  179    HG3  GLN  22           2HG      GLN  22   2.340   2.227  -5.692
  180   HE21  GLN  22          2HE2      GLN  22   2.840   5.564  -6.825
  181   HE22  GLN  22          1HE2      GLN  22   2.303   5.288  -8.448
  182    H    THR  23           H        THR  23  -1.469   5.153  -5.742
  183    HA   THR  23           HA       THR  23  -3.112   5.669  -3.339
  184    HB   THR  23           HB       THR  23  -4.932   6.088  -4.926
  185    HG1  THR  23           1HG      THR  23  -3.137   5.567  -7.065
  186   HG21  THR  23          3HG2      THR  23  -2.315   7.337  -5.855
  187   HG22  THR  23          1HG2      THR  23  -3.945   7.976  -6.175
  188   HG23  THR  23          2HG2      THR  23  -3.322   7.916  -4.508
  189    H    LEU  24           H        LEU  24  -5.317   4.639  -3.275
  190    HA   LEU  24           HA       LEU  24  -4.943   1.919  -2.581
  191    HB2  LEU  24           1HB      LEU  24  -6.586   3.266  -1.704
  192    HB3  LEU  24           2HB      LEU  24  -7.515   3.467  -3.208
  193    HG   LEU  24           HG       LEU  24  -7.899   0.980  -3.211
  194   HD11  LEU  24          1HD1      LEU  24  -7.554  -0.229  -1.039
  195   HD12  LEU  24          2HD1      LEU  24  -6.011   0.361  -1.702
  196   HD13  LEU  24          3HD1      LEU  24  -6.798   1.233  -0.364
  197   HD21  LEU  24          3HD2      LEU  24  -9.621   2.515  -2.466
  198   HD22  LEU  24          1HD2      LEU  24  -9.662   1.032  -1.481
  199   HD23  LEU  24          2HD2      LEU  24  -8.945   2.522  -0.820
  200    H    GLU  25           H        GLU  25  -6.387   3.305  -5.528
  201    HA   GLU  25           HA       GLU  25  -7.056   0.759  -6.694
  202    HB2  GLU  25           1HB      GLU  25  -8.014   2.931  -7.370
  203    HB3  GLU  25           2HB      GLU  25  -6.432   3.390  -8.043
  204    HG2  GLU  25           1HG      GLU  25  -6.628   1.491  -9.713
  205    HG3  GLU  25           2HG      GLU  25  -8.149   1.089  -8.882
  206    H    GLU  26           H        GLU  26  -4.167   2.802  -6.894
  207    HA   GLU  26           HA       GLU  26  -2.853   1.214  -8.915
  208    HB2  GLU  26           1HB      GLU  26  -1.875   3.133  -6.806
  209    HB3  GLU  26           2HB      GLU  26  -0.782   2.302  -7.939
  210    HG2  GLU  26           1HG      GLU  26  -1.912   3.447  -9.869
  211    HG3  GLU  26           2HG      GLU  26  -3.081   4.064  -8.677
  212    H    LEU  27           H        LEU  27  -2.983   1.023  -5.392
  213    HA   LEU  27           HA       LEU  27  -1.048  -1.157  -5.254
  214    HB2  LEU  27           1HB      LEU  27  -3.150  -0.109  -3.480
  215    HB3  LEU  27           2HB      LEU  27  -2.071  -1.392  -2.882
  216    HG   LEU  27           HG       LEU  27  -1.237   1.409  -3.733
  217   HD11  LEU  27          1HD1      LEU  27  -0.697   1.712  -1.302
  218   HD12  LEU  27          2HD1      LEU  27  -2.425   1.359  -1.541
  219   HD13  LEU  27          3HD1      LEU  27  -1.324   0.079  -0.975
  220   HD21  LEU  27          3HD2      LEU  27   0.471  -0.233  -4.249
  221   HD22  LEU  27          1HD2      LEU  27   0.993   0.778  -2.881
  222   HD23  LEU  27          2HD2      LEU  27   0.396  -0.874  -2.591
  223    H    GLU  28           H        GLU  28  -4.536  -0.895  -5.626
  224    HA   GLU  28           HA       GLU  28  -5.096  -3.712  -5.352
  225    HB2  GLU  28           1HB      GLU  28  -6.788  -1.912  -5.304
  226    HB3  GLU  28           2HB      GLU  28  -6.488  -1.624  -7.036
  227    HG2  GLU  28           1HG      GLU  28  -7.319  -3.973  -7.531
  228    HG3  GLU  28           2HG      GLU  28  -7.495  -4.137  -5.769
  229    H    GLU  29           H        GLU  29  -4.000  -1.713  -8.050
  230    HA   GLU  29           HA       GLU  29  -4.231  -3.787 -10.051
  231    HB2  GLU  29           1HB      GLU  29  -2.540  -1.301  -9.823
  232    HB3  GLU  29           2HB      GLU  29  -2.497  -2.386 -11.232
  233    HG2  GLU  29           1HG      GLU  29  -4.937  -1.890 -11.663
  234    HG3  GLU  29           2HG      GLU  29  -4.884  -0.941 -10.160
  235    H    PHE  30           H        PHE  30  -1.768  -2.964  -7.681
  236    HA   PHE  30           HA       PHE  30   0.299  -4.655  -8.776
  237    HB2  PHE  30           1HB      PHE  30  -0.212  -3.613  -5.958
  238    HB3  PHE  30           2HB      PHE  30   1.243  -4.515  -6.438
  239    HD1  PHE  30           1HD      PHE  30   0.860  -2.959  -9.309
  240    HD2  PHE  30           2HD      PHE  30   1.486  -1.920  -5.214
  241    HE1  PHE  30           1HE      PHE  30   1.939  -0.848 -10.012
  242    HE2  PHE  30           2HE      PHE  30   2.563   0.193  -5.911
  243    HZ   PHE  30           HZ       PHE  30   2.791   0.727  -8.313
  244    H    THR  31           H        THR  31  -2.177  -5.215  -6.267
  245    HA   THR  31           HA       THR  31  -1.155  -7.972  -5.906
  246    HB   THR  31           HB       THR  31  -2.741  -8.114  -4.057
  247    HG1  THR  31           1HG      THR  31  -3.597  -5.492  -4.815
  248   HG21  THR  31          3HG2      THR  31  -1.339  -5.411  -4.093
  249   HG22  THR  31          1HG2      THR  31  -1.913  -6.265  -2.642
  250   HG23  THR  31          2HG2      THR  31  -0.600  -6.960  -3.623
  251    H    GLN  32           H        GLN  32  -3.722  -6.318  -7.556
  252    HA   GLN  32           HA       GLN  32  -5.718  -7.049  -8.491
  253    HB2  GLN  32           1HB      GLN  32  -4.110  -9.599  -8.771
  254    HB3  GLN  32           2HB      GLN  32  -5.649  -9.247  -9.595
  255    HG2  GLN  32           1HG      GLN  32  -2.984  -7.695 -10.223
  256    HG3  GLN  32           2HG      GLN  32  -3.854  -9.076 -10.931
  257   HE21  GLN  32          2HE2      GLN  32  -3.354  -5.809 -11.149
  258   HE22  GLN  32          1HE2      GLN  32  -4.807  -5.344 -11.969
  259    H    ALA  33           H        ALA  33  -5.262  -7.415  -5.589
  260    HA   ALA  33           HA       ALA  33  -6.968  -9.779  -5.046
  261    HB1  ALA  33           1HB      ALA  33  -6.501  -9.284  -2.677
  262    HB2  ALA  33           2HB      ALA  33  -5.000  -9.443  -3.619
  263    HB3  ALA  33           3HB      ALA  33  -5.596  -7.830  -3.160
  264    H    LYS  34           H        LYS  34  -8.831  -9.611  -3.664
  265    HA   LYS  34           HA       LYS  34 -10.738  -7.647  -4.363
  266    HB2  LYS  34           1HB      LYS  34 -11.221  -9.800  -3.262
  267    HB3  LYS  34           2HB      LYS  34 -10.502  -9.167  -1.761
  268    HG2  LYS  34           1HG      LYS  34 -12.236  -7.443  -1.632
  269    HG3  LYS  34           2HG      LYS  34 -12.939  -8.018  -3.163
  270    HD2  LYS  34           1HD      LYS  34 -13.396 -10.209  -2.124
  271    HD3  LYS  34           2HD      LYS  34 -12.709  -9.621  -0.592
  272    HE2  LYS  34           1HE      LYS  34 -14.434  -7.873  -0.490
  273    HE3  LYS  34           2HE      LYS  34 -15.122  -8.461  -2.022
  274    HZ1  LYS  34           3HZ      LYS  34 -14.955 -10.002   0.488
  275    HZ2  LYS  34           1HZ      LYS  34 -16.322  -9.310  -0.122
  276    HZ3  LYS  34           2HZ      LYS  34 -15.593 -10.549  -0.932
  277    H    ARG  35           H        ARG  35 -11.248  -5.673  -3.769
  278    HA   ARG  35           HA       ARG  35  -9.267  -3.992  -2.658
  279    HB2  ARG  35           1HB      ARG  35 -11.097  -3.253  -4.070
  280    HB3  ARG  35           2HB      ARG  35 -12.206  -3.469  -2.694
  281    HG2  ARG  35           1HG      ARG  35 -11.182  -1.720  -1.462
  282    HG3  ARG  35           2HG      ARG  35  -9.781  -1.667  -2.560
  283    HD2  ARG  35           1HD      ARG  35 -12.592  -0.874  -3.251
  284    HD3  ARG  35           2HD      ARG  35 -11.262   0.230  -2.832
  285    HE   ARG  35           HE       ARG  35 -10.324  -1.092  -5.142
  286   HH11  ARG  35          1HH1      ARG  35 -13.282   0.607  -4.422
  287   HH12  ARG  35          2HH1      ARG  35 -13.410   1.105  -6.097
  288   HH21  ARG  35          1HH2      ARG  35 -10.461  -0.538  -7.065
  289   HH22  ARG  35          2HH2      ARG  35 -11.804   0.452  -7.606
  290    H    GLU  36           H        GLU  36 -12.074  -5.491  -1.064
  291    HA   GLU  36           HA       GLU  36 -11.687  -4.371   1.519
  292    HB2  GLU  36           1HB      GLU  36 -13.644  -5.679   0.844
  293    HB3  GLU  36           2HB      GLU  36 -12.629  -7.141   0.754
  294    HG2  GLU  36           1HG      GLU  36 -12.218  -6.956   3.257
  295    HG3  GLU  36           2HG      GLU  36 -13.204  -5.478   3.171
  296    H    VAL  37           H        VAL  37 -10.341  -7.388   0.161
  297    HA   VAL  37           HA       VAL  37  -8.758  -8.044   2.488
  298    HB   VAL  37           HB       VAL  37  -8.400  -8.750  -0.454
  299   HG11  VAL  37          1HG1      VAL  37  -6.876 -10.517   0.367
  300   HG12  VAL  37          2HG1      VAL  37  -6.260  -8.898   0.776
  301   HG13  VAL  37          3HG1      VAL  37  -7.047  -9.894   2.025
  302   HG21  VAL  37          3HG2      VAL  37 -10.460  -9.604   0.494
  303   HG22  VAL  37          1HG2      VAL  37  -9.304 -10.924   0.204
  304   HG23  VAL  37          2HG2      VAL  37  -9.561 -10.314   1.857
  305    H    LEU  38           H        LEU  38  -8.012  -6.145  -0.414
  306    HA   LEU  38           HA       LEU  38  -5.290  -5.613   0.221
  307    HB2  LEU  38           1HB      LEU  38  -6.182  -5.158  -1.820
  308    HB3  LEU  38           2HB      LEU  38  -7.383  -3.961  -1.285
  309    HG   LEU  38           HG       LEU  38  -5.432  -2.535  -0.500
  310   HD11  LEU  38          1HD1      LEU  38  -3.218  -3.012  -1.581
  311   HD12  LEU  38          2HD1      LEU  38  -3.711  -4.340  -0.504
  312   HD13  LEU  38          3HD1      LEU  38  -3.893  -4.508  -2.266
  313   HD21  LEU  38          3HD2      LEU  38  -6.678  -2.014  -2.513
  314   HD22  LEU  38          1HD2      LEU  38  -4.952  -1.657  -2.758
  315   HD23  LEU  38          2HD2      LEU  38  -5.665  -3.127  -3.463
  316    H    LEU  39           H        LEU  39  -8.252  -3.922   1.226
  317    HA   LEU  39           HA       LEU  39  -6.865  -1.810   2.610
  318    HB2  LEU  39           1HB      LEU  39  -9.532  -3.032   2.761
  319    HB3  LEU  39           2HB      LEU  39  -9.203  -1.626   3.801
  320    HG   LEU  39           HG       LEU  39  -9.077  -1.650   0.761
  321   HD11  LEU  39          1HD1      LEU  39 -11.132  -0.217   0.899
  322   HD12  LEU  39          2HD1      LEU  39 -11.414  -1.819   1.617
  323   HD13  LEU  39          3HD1      LEU  39 -11.130  -0.411   2.666
  324   HD21  LEU  39          3HD2      LEU  39  -7.513  -0.081   1.746
  325   HD22  LEU  39          1HD2      LEU  39  -8.855   0.801   0.979
  326   HD23  LEU  39          2HD2      LEU  39  -8.804   0.621   2.749
  327    H    VAL  40           H        VAL  40  -8.007  -4.999   3.606
  328    HA   VAL  40           HA       VAL  40  -7.453  -4.693   6.430
  329    HB   VAL  40           HB       VAL  40  -7.482  -7.143   4.621
  330   HG11  VAL  40          1HG1      VAL  40  -7.552  -8.451   6.717
  331   HG12  VAL  40          2HG1      VAL  40  -6.042  -7.520   6.594
  332   HG13  VAL  40          3HG1      VAL  40  -7.352  -6.955   7.658
  333   HG21  VAL  40          3HG2      VAL  40  -9.635  -6.051   4.822
  334   HG22  VAL  40          1HG2      VAL  40  -9.629  -7.603   5.692
  335   HG23  VAL  40          2HG2      VAL  40  -9.503  -6.075   6.597
  336    H    THR  41           H        THR  41  -5.438  -5.896   3.754
  337    HA   THR  41           HA       THR  41  -3.141  -6.394   5.421
  338    HB   THR  41           HB       THR  41  -3.302  -5.752   2.445
  339    HG1  THR  41           1HG      THR  41  -3.151  -8.237   3.856
  340   HG21  THR  41          3HG2      THR  41  -1.074  -7.002   4.102
  341   HG22  THR  41          1HG2      THR  41  -1.075  -6.815   2.333
  342   HG23  THR  41          2HG2      THR  41  -1.046  -5.375   3.380
  343    H    LEU  42           H        LEU  42  -4.144  -3.570   3.505
  344    HA   LEU  42           HA       LEU  42  -1.751  -2.057   4.071
  345    HB2  LEU  42           1HB      LEU  42  -4.509  -1.390   3.299
  346    HB3  LEU  42           2HB      LEU  42  -3.302  -0.085   3.354
  347    HG   LEU  42           HG       LEU  42  -3.193  -2.538   1.556
  348   HD11  LEU  42          1HD1      LEU  42  -3.604  -0.899  -0.297
  349   HD12  LEU  42          2HD1      LEU  42  -4.953  -0.916   0.863
  350   HD13  LEU  42          3HD1      LEU  42  -3.756   0.401   0.906
  351   HD21  LEU  42          3HD2      LEU  42  -0.985  -1.766   2.196
  352   HD22  LEU  42          1HD2      LEU  42  -1.285  -1.392   0.482
  353   HD23  LEU  42          2HD2      LEU  42  -1.392  -0.104   1.708
  354    H    THR  43           H        THR  43  -4.853  -2.404   5.712
  355    HA   THR  43           HA       THR  43  -4.436  -0.306   7.638
  356    HB   THR  43           HB       THR  43  -6.026  -2.895   7.847
  357    HG1  THR  43           1HG      THR  43  -7.775  -1.434   7.399
  358   HG21  THR  43          3HG2      THR  43  -6.094  -0.384   9.565
  359   HG22  THR  43          1HG2      THR  43  -7.199  -1.771   9.707
  360   HG23  THR  43          2HG2      THR  43  -5.468  -1.970  10.069
  361    H    ARG  44           H        ARG  44  -3.635  -3.773   7.681
  362    HA   ARG  44           HA       ARG  44  -2.511  -3.723  10.340
  363    HB2  ARG  44           1HB      ARG  44  -2.214  -5.617   8.062
  364    HB3  ARG  44           2HB      ARG  44  -1.354  -5.796   9.609
  365    HG2  ARG  44           1HG      ARG  44  -3.507  -5.892  10.794
  366    HG3  ARG  44           2HG      ARG  44  -4.366  -5.719   9.244
  367    HD2  ARG  44           1HD      ARG  44  -3.494  -7.825   8.499
  368    HD3  ARG  44           2HD      ARG  44  -2.561  -7.992  10.005
  369    HE   ARG  44           HE       ARG  44  -5.354  -7.878  10.736
  370   HH11  ARG  44          1HH1      ARG  44  -3.235  -9.993   8.949
  371   HH12  ARG  44          2HH1      ARG  44  -4.217 -11.372   9.401
  372   HH21  ARG  44          1HH2      ARG  44  -6.494  -9.447  11.257
  373   HH22  ARG  44          2HH2      ARG  44  -6.077 -11.062  10.717
  374    H    LEU  45           H        LEU  45  -1.133  -3.223   7.114
  375    HA   LEU  45           HA       LEU  45   1.592  -2.950   7.987
  376    HB2  LEU  45           1HB      LEU  45  -0.012  -1.867   5.775
  377    HB3  LEU  45           2HB      LEU  45   1.734  -1.524   5.794
  378    HG   LEU  45           HG       LEU  45   0.462  -4.286   5.655
  379   HD11  LEU  45          1HD1      LEU  45   1.374  -4.324   3.318
  380   HD12  LEU  45          2HD1      LEU  45   0.205  -3.000   3.534
  381   HD13  LEU  45          3HD1      LEU  45   1.951  -2.655   3.532
  382   HD21  LEU  45          3HD2      LEU  45   2.579  -4.305   6.837
  383   HD22  LEU  45          1HD2      LEU  45   2.765  -5.083   5.247
  384   HD23  LEU  45          2HD2      LEU  45   3.365  -3.425   5.504
  385    H    HIS  46           H        HIS  46  -1.062  -0.612   7.683
  386    HA   HIS  46           HA       HIS  46   0.510   1.681   8.434
  387    HB2  HIS  46           1HB      HIS  46  -1.698   1.915   7.342
  388    HB3  HIS  46           2HB      HIS  46  -2.482   1.169   8.756
  389    HD1  HIS  46           1HD      HIS  46  -0.207   4.172   8.089
  390    HD2  HIS  46           2HD      HIS  46  -3.545   3.132  10.442
  391    HE1  HIS  46           1HE      HIS  46  -0.773   6.169   9.378
  392    H    GLN  47           H        GLN  47  -1.435  -0.614  10.325
  393    HA   GLN  47           HA       GLN  47  -1.005   0.703  12.850
  394    HB2  GLN  47           1HB      GLN  47  -1.670  -2.137  12.071
  395    HB3  GLN  47           2HB      GLN  47  -1.513  -1.608  13.763
  396    HG2  GLN  47           1HG      GLN  47  -3.572   0.068  13.262
  397    HG3  GLN  47           2HG      GLN  47  -3.267  -0.662  11.669
  398   HE21  GLN  47          2HE2      GLN  47  -5.772  -0.668  12.991
  399   HE22  GLN  47          1HE2      GLN  47  -6.178  -2.308  13.372
  400    H    ARG  48           H        ARG  48   0.880  -1.604  10.991
  401    HA   ARG  48           HA       ARG  48   2.783  -2.113  13.149
  402    HB2  ARG  48           1HB      ARG  48   2.827  -2.679  10.226
  403    HB3  ARG  48           2HB      ARG  48   4.200  -2.991  11.311
  404    HG2  ARG  48           1HG      ARG  48   2.848  -4.525  12.635
  405    HG3  ARG  48           2HG      ARG  48   1.421  -4.166  11.631
  406    HD2  ARG  48           1HD      ARG  48   2.543  -5.138   9.713
  407    HD3  ARG  48           2HD      ARG  48   3.949  -5.516  10.735
  408    HE   ARG  48           HE       ARG  48   1.767  -6.930  11.910
  409   HH11  ARG  48          1HH1      ARG  48   3.258  -6.870   8.758
  410   HH12  ARG  48          2HH1      ARG  48   2.844  -8.556   8.524
  411   HH21  ARG  48          1HH2      ARG  48   1.279  -8.859  11.652
  412   HH22  ARG  48          2HH2      ARG  48   1.714  -9.692  10.173
  413    H    GLY  49           H        GLY  49   2.278   0.430  10.895
  414    HA2  GLY  49           1HA      GLY  49   3.322   2.544  11.092
  415    HA3  GLY  49           2HA      GLY  49   4.638   1.799  12.029
  416    H    VAL  50           H        VAL  50   3.538   0.346   9.050
  417    HA   VAL  50           HA       VAL  50   6.206   0.866   7.813
  418    HB   VAL  50           HB       VAL  50   3.874  -0.873   6.903
  419   HG11  VAL  50          1HG1      VAL  50   5.527  -1.820   5.328
  420   HG12  VAL  50          2HG1      VAL  50   5.297  -0.078   5.044
  421   HG13  VAL  50          3HG1      VAL  50   6.744  -0.657   5.905
  422   HG21  VAL  50          3HG2      VAL  50   4.839  -1.708   8.962
  423   HG22  VAL  50          1HG2      VAL  50   5.263  -2.762   7.592
  424   HG23  VAL  50          2HG2      VAL  50   6.470  -1.631   8.251
  425    H    ILE  51           H        ILE  51   2.767   1.423   7.122
  426    HA   ILE  51           HA       ILE  51   3.651   3.485   5.122
  427    HB   ILE  51           HB       ILE  51   1.660   2.911   3.768
  428   HG12  ILE  51          1HG1      ILE  51   1.292   0.633   5.696
  429   HG13  ILE  51          2HG1      ILE  51   0.302   2.109   5.624
  430   HG21  ILE  51          1HG2      ILE  51   2.422   0.728   2.895
  431   HG22  ILE  51          2HG2      ILE  51   3.802   1.799   3.230
  432   HG23  ILE  51          3HG2      ILE  51   3.403   0.485   4.360
  433   HD11  ILE  51          3HD1      ILE  51   0.582   0.046   3.410
  434   HD12  ILE  51          1HD1      ILE  51  -0.819   0.232   4.490
  435   HD13  ILE  51          2HD1      ILE  51  -0.407   1.525   3.338
  436    H    TYR  52           H        TYR  52   2.103   5.131   4.643
  437    HA   TYR  52           HA       TYR  52   0.408   5.748   7.042
  438    HB2  TYR  52           1HB      TYR  52   2.461   7.071   7.061
  439    HB3  TYR  52           2HB      TYR  52   2.117   7.629   5.406
  440    HD1  TYR  52           1HD      TYR  52   0.678   7.633   8.861
  441    HD2  TYR  52           2HD      TYR  52   0.885   9.596   5.083
  442    HE1  TYR  52           1HE      TYR  52  -0.641   9.519   9.779
  443    HE2  TYR  52           2HE      TYR  52  -0.430  11.486   5.980
  444    HH   TYR  52           HH       TYR  52  -1.499  12.356   7.794
  445    H    ARG  53           H        ARG  53  -1.583   6.437   6.734
  446    HA   ARG  53           HA       ARG  53  -2.590   6.343   3.947
  447    HB2  ARG  53           1HB      ARG  53  -3.766   5.030   5.485
  448    HB3  ARG  53           2HB      ARG  53  -3.995   6.417   6.575
  449    HG2  ARG  53           1HG      ARG  53  -5.352   7.521   4.800
  450    HG3  ARG  53           2HG      ARG  53  -5.201   6.045   3.817
  451    HD2  ARG  53           1HD      ARG  53  -6.432   6.141   6.550
  452    HD3  ARG  53           2HD      ARG  53  -7.338   6.300   5.026
  453    HE   ARG  53           HE       ARG  53  -6.082   3.779   4.803
  454   HH11  ARG  53          1HH1      ARG  53  -8.094   5.229   7.253
  455   HH12  ARG  53          2HH1      ARG  53  -8.734   3.653   7.671
  456   HH21  ARG  53          1HH2      ARG  53  -6.800   1.964   5.274
  457   HH22  ARG  53          2HH2      ARG  53  -7.997   1.790   6.543
  458    H    LYS  54           H        LYS  54  -2.664   8.072   2.746
  459    HA   LYS  54           HA       LYS  54  -3.592  10.609   4.056
  460    HB2  LYS  54           1HB      LYS  54  -2.153  10.162   1.436
  461    HB3  LYS  54           2HB      LYS  54  -2.768  11.726   2.024
  462    HG2  LYS  54           1HG      LYS  54  -1.241  11.578   3.965
  463    HG3  LYS  54           2HG      LYS  54  -0.607  10.040   3.335
  464    HD2  LYS  54           1HD      LYS  54   0.168  11.179   1.302
  465    HD3  LYS  54           2HD      LYS  54  -0.489  12.718   1.906
  466    HE2  LYS  54           1HE      LYS  54   1.027  12.605   3.841
  467    HE3  LYS  54           2HE      LYS  54   1.692  11.074   3.226
  468    HZ1  LYS  54           3HZ      LYS  54   1.836  13.680   1.851
  469    HZ2  LYS  54           1HZ      LYS  54   3.081  12.944   2.645
  470    HZ3  LYS  54           2HZ      LYS  54   2.452  12.260   1.280
  471    H    TRP  55           H        TRP  55  -4.955  11.993   2.659
  472    HA   TRP  55           HA       TRP  55  -6.923  10.290   1.163
  473    HB2  TRP  55           1HB      TRP  55  -7.447  12.510   3.183
  474    HB3  TRP  55           2HB      TRP  55  -8.685  11.854   2.086
  475    HD1  TRP  55           HD       TRP  55  -6.773  11.146   5.142
  476    HE1  TRP  55           1HE      TRP  55  -7.793   8.974   6.385
  477    HE3  TRP  55           3HE      TRP  55  -9.939   9.624   1.470
  478    HZ2  TRP  55           2HZ      TRP  55  -9.654   7.034   5.741
  479    HZ3  TRP  55           3HZ      TRP  55 -11.302   7.653   1.782
  480    HH2  TRP  55           HH       TRP  55 -11.210   6.341   3.857
  481    H    ARG  56           H        ARG  56  -7.292  10.861  -0.836
  482    HA   ARG  56           HA       ARG  56  -6.841  13.710  -1.621
  483    HB2  ARG  56           1HB      ARG  56  -7.311  11.288  -3.301
  484    HB3  ARG  56           2HB      ARG  56  -7.168  12.959  -3.892
  485    HG2  ARG  56           1HG      ARG  56  -4.871  13.039  -2.886
  486    HG3  ARG  56           2HG      ARG  56  -5.031  11.305  -2.518
  487    HD2  ARG  56           1HD      ARG  56  -5.399  10.947  -4.962
  488    HD3  ARG  56           2HD      ARG  56  -4.915  12.643  -5.194
  489    HE   ARG  56           HE       ARG  56  -2.779  11.199  -3.813
  490   HH11  ARG  56          1HH1      ARG  56  -4.246  11.482  -6.963
  491   HH12  ARG  56          2HH1      ARG  56  -2.722  11.058  -7.718
  492   HH21  ARG  56          1HH2      ARG  56  -1.029  10.703  -4.663
  493   HH22  ARG  56          2HH2      ARG  56  -0.887  10.612  -6.406
  494    H    HIS  57           H        HIS  57  -8.398  14.918  -2.681
  495    HA   HIS  57           HA       HIS  57 -11.203  13.996  -2.145
  496    HB2  HIS  57           1HB      HIS  57 -10.081  16.832  -1.983
  497    HB3  HIS  57           2HB      HIS  57 -11.782  16.367  -1.739
  498    HD2  HIS  57           2HD      HIS  57  -8.576  16.854   0.401
  499    HE1  HIS  57           1HE      HIS  57 -11.374  14.591   2.657
  500    HE2  HIS  57           2HE      HIS  57  -9.129  15.959   2.670
  501    H    PHE  58           H        PHE  58 -11.947  13.322  -4.019
  502    HA   PHE  58           HA       PHE  58 -11.577  15.126  -6.386
  503    HB2  PHE  58           1HB      PHE  58 -12.231  12.156  -6.198
  504    HB3  PHE  58           2HB      PHE  58 -12.270  13.095  -7.708
  505    HD1  PHE  58           2HD      PHE  58 -10.235  13.905  -8.723
  506    HD2  PHE  58           1HD      PHE  58 -10.173  11.535  -5.170
  507    HE1  PHE  58           2HE      PHE  58  -7.827  13.457  -9.067
  508    HE2  PHE  58           1HE      PHE  58  -7.765  11.087  -5.509
  509    HZ   PHE  58           HZ       PHE  58  -6.592  12.047  -7.457
  510    H    SER  59           H        SER  59 -13.143  16.552  -6.457
  511    HA   SER  59           HA       SER  59 -15.362  17.409  -6.628
  512    HB2  SER  59           1HB      SER  59 -15.996  14.596  -7.285
  513    HB3  SER  59           2HB      SER  59 -17.032  16.026  -7.492
  514    HG   SER  59           HG       SER  59 -15.900  15.467  -9.402
  515    H    GLY  60           H        GLY  60 -14.263  16.410  -4.006
  516    HA2  GLY  60           1HA      GLY  60 -15.271  16.732  -1.891
  517    HA3  GLY  60           2HA      GLY  60 -16.871  16.462  -2.618
  518    H    ARG  61           H        ARG  61 -15.053  14.077  -3.882
  519    HA   ARG  61           HA       ARG  61 -16.037  12.118  -1.875
  520    HB2  ARG  61           1HB      ARG  61 -14.946  11.717  -4.624
  521    HB3  ARG  61           2HB      ARG  61 -15.480  10.437  -3.511
  522    HG2  ARG  61           1HG      ARG  61 -17.753  11.385  -3.522
  523    HG3  ARG  61           2HG      ARG  61 -17.214  12.647  -4.657
  524    HD2  ARG  61           1HD      ARG  61 -16.669  10.882  -6.273
  525    HD3  ARG  61           2HD      ARG  61 -17.364   9.692  -5.148
  526    HE   ARG  61           HE       ARG  61 -19.435  11.613  -5.780
  527   HH11  ARG  61          1HH1      ARG  61 -17.570   9.162  -7.415
  528   HH12  ARG  61          2HH1      ARG  61 -18.903   8.876  -8.517
  529   HH21  ARG  61          1HH2      ARG  61 -20.967  11.302  -7.039
  530   HH22  ARG  61          2HH2      ARG  61 -20.840  10.095  -8.304
  531    H    LYS  62           H        LYS  62 -14.830  10.745  -0.727
  532    HA   LYS  62           HA       LYS  62 -11.995  11.561  -0.402
  533    HB2  LYS  62           1HB      LYS  62 -13.823   9.748   1.179
  534    HB3  LYS  62           2HB      LYS  62 -12.110  10.036   1.565
  535    HG2  LYS  62           1HG      LYS  62 -12.585  12.431   1.893
  536    HG3  LYS  62           2HG      LYS  62 -14.298  12.142   1.509
  537    HD2  LYS  62           1HD      LYS  62 -14.490  10.640   3.443
  538    HD3  LYS  62           2HD      LYS  62 -12.770  10.895   3.820
  539    HE2  LYS  62           1HE      LYS  62 -13.196  13.290   4.161
  540    HE3  LYS  62           2HE      LYS  62 -14.914  13.042   3.776
  541    HZ1  LYS  62           3HZ      LYS  62 -13.476  11.837   6.053
  542    HZ2  LYS  62           1HZ      LYS  62 -14.533  13.100   6.146
  543    HZ3  LYS  62           2HZ      LYS  62 -15.071  11.607   5.696
  544    H    TYR  63           H        TYR  63 -10.326  10.523  -1.135
  545    HA   TYR  63           HA       TYR  63 -10.693   7.675  -2.000
  546    HB2  TYR  63           1HB      TYR  63 -10.777   9.101  -3.960
  547    HB3  TYR  63           2HB      TYR  63  -9.271   9.907  -3.459
  548    HD1  TYR  63           1HD      TYR  63 -10.438   6.367  -3.944
  549    HD2  TYR  63           2HD      TYR  63  -7.404   9.271  -4.675
  550    HE1  TYR  63           1HE      TYR  63  -9.125   4.670  -5.182
  551    HE2  TYR  63           2HE      TYR  63  -6.080   7.592  -5.912
  552    HH   TYR  63           HH       TYR  63  -5.977   5.446  -6.670
  553    H    ARG  64           H        ARG  64  -9.190   6.278  -1.429
  554    HA   ARG  64           HA       ARG  64  -7.354   7.233   0.652
  555    HB2  ARG  64           1HB      ARG  64  -7.975   4.497  -0.359
  556    HB3  ARG  64           2HB      ARG  64  -6.798   4.870   0.922
  557    HG2  ARG  64           1HG      ARG  64  -8.574   5.830   2.300
  558    HG3  ARG  64           2HG      ARG  64  -9.761   5.517   1.009
  559    HD2  ARG  64           1HD      ARG  64  -9.395   3.139   1.258
  560    HD3  ARG  64           2HD      ARG  64  -8.216   3.456   2.552
  561    HE   ARG  64           HE       ARG  64 -10.148   3.920   4.046
  562   HH11  ARG  64          1HH1      ARG  64 -11.214   3.454   0.759
  563   HH12  ARG  64          2HH1      ARG  64 -12.866   3.271   1.314
  564   HH21  ARG  64          1HH2      ARG  64 -12.036   3.720   4.698
  565   HH22  ARG  64          2HH2      ARG  64 -13.336   3.423   3.560
  566    H    GLU  65           H        GLU  65  -5.275   7.618   0.541
  567    HA   GLU  65           HA       GLU  65  -3.720   6.198  -1.592
  568    HB2  GLU  65           1HB      GLU  65  -3.945   8.548  -2.206
  569    HB3  GLU  65           2HB      GLU  65  -3.326   9.029  -0.608
  570    HG2  GLU  65           1HG      GLU  65  -1.106   7.899  -1.207
  571    HG3  GLU  65           2HG      GLU  65  -1.894   7.523  -2.757
  572    H    TYR  66           H        TYR  66  -1.755   5.409  -1.060
  573    HA   TYR  66           HA       TYR  66  -1.051   5.551   1.852
  574    HB2  TYR  66           1HB      TYR  66  -1.121   3.139   0.031
  575    HB3  TYR  66           2HB      TYR  66  -0.352   3.173   1.637
  576    HD1  TYR  66           1HD      TYR  66  -3.568   3.219  -0.173
  577    HD2  TYR  66           2HD      TYR  66  -1.695   3.171   3.657
  578    HE1  TYR  66           1HE      TYR  66  -5.742   2.660   0.874
  579    HE2  TYR  66           2HE      TYR  66  -3.856   2.614   4.719
  580    HH   TYR  66           HH       TYR  66  -6.849   2.217   2.807
  581    H    CYS  67           H        CYS  67   0.889   6.227   2.249
  582    HA   CYS  67           HA       CYS  67   3.000   6.027   0.079
  583    HB2  CYS  67           1HB      CYS  67   2.543   7.989   2.371
  584    HB3  CYS  67           2HB      CYS  67   3.774   8.117   1.091
  585    HG   CYS  67           HG       CYS  67   2.041   9.912   0.756
  586    H    LEU  68           H        LEU  68   4.997   5.275   0.631
  587    HA   LEU  68           HA       LEU  68   5.166   3.551   2.972
  588    HB2  LEU  68           1HB      LEU  68   6.090   3.015   0.913
  589    HB3  LEU  68           2HB      LEU  68   7.264   4.351   0.880
  590    HG   LEU  68           HG       LEU  68   8.261   3.383   2.999
  591   HD11  LEU  68          1HD1      LEU  68   7.780   0.962   3.447
  592   HD12  LEU  68          2HD1      LEU  68   6.318   1.958   3.636
  593   HD13  LEU  68          3HD1      LEU  68   6.549   0.985   2.163
  594   HD21  LEU  68          3HD2      LEU  68   9.335   3.113   0.841
  595   HD22  LEU  68          1HD2      LEU  68   9.541   1.635   1.810
  596   HD23  LEU  68          2HD2      LEU  68   8.343   1.678   0.495
  597    H    LYS  69           H        LYS  69   5.729   4.012   4.931
  598    HA   LYS  69           HA       LYS  69   7.199   6.568   5.431
  599    HB2  LYS  69           1HB      LYS  69   5.052   6.231   6.579
  600    HB3  LYS  69           2HB      LYS  69   5.695   4.745   7.316
  601    HG2  LYS  69           1HG      LYS  69   7.375   6.039   8.527
  602    HG3  LYS  69           2HG      LYS  69   6.816   7.535   7.743
  603    HD2  LYS  69           1HD      LYS  69   4.589   7.222   8.786
  604    HD3  LYS  69           2HD      LYS  69   5.199   5.769   9.611
  605    HE2  LYS  69           1HE      LYS  69   6.889   7.123  10.766
  606    HE3  LYS  69           2HE      LYS  69   6.295   8.578   9.934
  607    HZ1  LYS  69           3HZ      LYS  69   4.735   6.921  11.810
  608    HZ2  LYS  69           1HZ      LYS  69   5.396   8.393  12.153
  609    HZ3  LYS  69           2HZ      LYS  69   4.184   8.271  11.040
  610    H    HIS  70           H        HIS  70   7.319   3.081   6.004
  611    HA   HIS  70           HA       HIS  70   9.555   2.994   7.733
  612    HB2  HIS  70           1HB      HIS  70   8.178   1.000   7.126
  613    HB3  HIS  70           2HB      HIS  70   8.880   1.037   5.491
  614    HD1  HIS  70           1HD      HIS  70  10.076   0.745   9.106
  615    HD2  HIS  70           2HD      HIS  70  11.116  -0.643   5.263
  616    HE1  HIS  70           1HE      HIS  70  12.008  -0.720   9.417
  617    H    ARG  71           H        ARG  71  11.651   3.270   7.589
  618    HA   ARG  71           HA       ARG  71  12.808   4.872   5.628
  619    HB2  ARG  71           1HB      ARG  71  13.780   4.364   7.798
  620    HB3  ARG  71           2HB      ARG  71  14.262   2.771   7.170
  621    HG2  ARG  71           1HG      ARG  71  15.672   3.842   5.482
  622    HG3  ARG  71           2HG      ARG  71  15.164   5.447   6.061
  623    HD2  ARG  71           1HD      ARG  71  16.232   5.047   8.174
  624    HD3  ARG  71           2HD      ARG  71  16.691   3.410   7.652
  625    HE   ARG  71           HE       ARG  71  18.516   4.458   6.347
  626   HH11  ARG  71          1HH1      ARG  71  16.362   6.905   7.586
  627   HH12  ARG  71          2HH1      ARG  71  17.535   8.146   7.192
  628   HH21  ARG  71          1HH2      ARG  71  19.867   5.869   5.882
  629   HH22  ARG  71          2HH2      ARG  71  19.534   7.557   6.219
  630    H    ASP  72           H        ASP  72  13.442   4.721   3.630
  631    HA   ASP  72           HA       ASP  72  12.853   2.403   2.056
  632    HB2  ASP  72           1HB      ASP  72  14.634   4.831   1.412
  633    HB3  ASP  72           2HB      ASP  72  14.199   3.441   0.386
  634    H    GLU  73           H        GLU  73  15.891   3.566   3.475
  635    HA   GLU  73           HA       GLU  73  17.610   1.593   2.350
  636    HB2  GLU  73           1HB      GLU  73  18.371   3.566   3.587
  637    HB3  GLU  73           2HB      GLU  73  17.694   2.878   5.084
  638    HG2  GLU  73           1HG      GLU  73  19.355   0.961   4.904
  639    HG3  GLU  73           2HG      GLU  73  19.876   1.735   3.390
  640    H    LEU  74           H        LEU  74  15.706   1.507   5.364
  641    HA   LEU  74           HA       LEU  74  16.597  -1.148   6.080
  642    HB2  LEU  74           1HB      LEU  74  14.276   0.529   6.755
  643    HB3  LEU  74           2HB      LEU  74  14.493  -1.013   7.615
  644    HG   LEU  74           HG       LEU  74  16.386   1.369   7.662
  645   HD11  LEU  74          1HD1      LEU  74  15.732   1.504  10.082
  646   HD12  LEU  74          2HD1      LEU  74  14.320   1.704   9.017
  647   HD13  LEU  74          3HD1      LEU  74  14.605   0.149   9.836
  648   HD21  LEU  74          3HD2      LEU  74  17.602  -0.727   7.766
  649   HD22  LEU  74          1HD2      LEU  74  17.648   0.080   9.352
  650   HD23  LEU  74          2HD2      LEU  74  16.558  -1.302   9.086
  651    H    ALA  75           H        ALA  75  13.873   0.086   4.207
  652    HA   ALA  75           HA       ALA  75  12.479  -2.388   3.945
  653    HB1  ALA  75           1HB      ALA  75  11.469  -1.368   1.941
  654    HB2  ALA  75           2HB      ALA  75  11.493  -0.231   3.311
  655    HB3  ALA  75           3HB      ALA  75  12.680  -0.066   1.995
  656    H    ASP  76           H        ASP  76  15.065  -0.935   1.970
  657    HA   ASP  76           HA       ASP  76  15.151  -3.077   0.040
  658    HB2  ASP  76           1HB      ASP  76  17.277  -0.998   0.837
  659    HB3  ASP  76           2HB      ASP  76  17.374  -2.295  -0.380
  660    H    LEU  77           H        LEU  77  16.750  -2.559   3.146
  661    HA   LEU  77           HA       LEU  77  18.476  -4.872   2.943
  662    HB2  LEU  77           1HB      LEU  77  17.316  -3.302   5.143
  663    HB3  LEU  77           2HB      LEU  77  18.473  -4.592   5.544
  664    HG   LEU  77           HG       LEU  77  19.055  -2.144   3.833
  665   HD11  LEU  77          1HD1      LEU  77  20.503  -1.442   5.757
  666   HD12  LEU  77          2HD1      LEU  77  18.800  -1.591   6.251
  667   HD13  LEU  77          3HD1      LEU  77  19.963  -2.873   6.665
  668   HD21  LEU  77          3HD2      LEU  77  20.342  -4.078   3.139
  669   HD22  LEU  77          1HD2      LEU  77  21.405  -2.898   3.942
  670   HD23  LEU  77          2HD2      LEU  77  20.877  -4.359   4.813
  671    H    GLU  78           H        GLU  78  15.169  -4.378   4.071
  672    HA   GLU  78           HA       GLU  78  14.889  -7.105   5.072
  673    HB2  GLU  78           1HB      GLU  78  12.933  -4.923   4.350
  674    HB3  GLU  78           2HB      GLU  78  12.435  -6.530   4.933
  675    HG2  GLU  78           1HG      GLU  78  13.632  -6.099   7.110
  676    HG3  GLU  78           2HG      GLU  78  14.201  -4.589   6.362
  677    H    HIS  79           H        HIS  79  14.461  -5.510   1.981
  678    HA   HIS  79           HA       HIS  79  12.958  -7.620   0.720
  679    HB2  HIS  79           1HB      HIS  79  14.820  -5.500  -0.441
  680    HB3  HIS  79           2HB      HIS  79  13.788  -6.578  -1.410
  681    HD1  HIS  79           1HD      HIS  79  13.445  -3.587  -1.667
  682    HD2  HIS  79           2HD      HIS  79  11.185  -5.897   1.038
  683    HE1  HIS  79           1HE      HIS  79  11.457  -2.265  -1.148
  Start of MODEL   10
    1    H    LYS   3           H        LYS   3   5.969 -14.740  -7.067
    2    HA   LYS   3           HA       LYS   3   6.174 -12.349  -5.558
    3    HB2  LYS   3           1HB      LYS   3   3.825 -12.473  -7.453
    4    HB3  LYS   3           2HB      LYS   3   3.916 -11.416  -6.026
    5    HG2  LYS   3           1HG      LYS   3   5.938 -10.337  -7.007
    6    HG3  LYS   3           2HG      LYS   3   5.722 -11.333  -8.467
    7    HD2  LYS   3           1HD      LYS   3   3.566  -9.499  -7.388
    8    HD3  LYS   3           2HD      LYS   3   4.789  -8.961  -8.563
    9    HE2  LYS   3           1HE      LYS   3   4.073 -10.872 -10.042
   10    HE3  LYS   3           2HE      LYS   3   2.731 -11.158  -8.909
   11    HZ1  LYS   3           3HZ      LYS   3   3.206  -8.662 -10.412
   12    HZ2  LYS   3           1HZ      LYS   3   2.055  -9.790 -10.765
   13    HZ3  LYS   3           2HZ      LYS   3   1.961  -8.927  -9.362
   14    H    ALA   4           H        ALA   4   4.242 -15.105  -6.572
   15    HA   ALA   4           HA       ALA   4   2.442 -15.074  -4.345
   16    HB1  ALA   4           1HB      ALA   4   1.947 -17.401  -4.991
   17    HB2  ALA   4           2HB      ALA   4   1.973 -16.323  -6.405
   18    HB3  ALA   4           3HB      ALA   4   3.353 -17.396  -6.078
   19    H    LYS   5           H        LYS   5   5.721 -16.170  -4.706
   20    HA   LYS   5           HA       LYS   5   5.776 -17.917  -2.399
   21    HB2  LYS   5           1HB      LYS   5   7.920 -16.363  -3.847
   22    HB3  LYS   5           2HB      LYS   5   8.238 -17.485  -2.503
   23    HG2  LYS   5           1HG      LYS   5   7.298 -19.337  -3.821
   24    HG3  LYS   5           2HG      LYS   5   6.964 -18.217  -5.163
   25    HD2  LYS   5           1HD      LYS   5   9.369 -17.739  -5.368
   26    HD3  LYS   5           2HD      LYS   5   9.707 -18.850  -4.021
   27    HE2  LYS   5           1HE      LYS   5   8.780 -20.717  -5.311
   28    HE3  LYS   5           2HE      LYS   5   8.409 -19.612  -6.655
   29    HZ1  LYS   5           3HZ      LYS   5  11.108 -20.214  -5.627
   30    HZ2  LYS   5           1HZ      LYS   5  10.461 -20.804  -7.025
   31    HZ3  LYS   5           2HZ      LYS   5  10.764 -19.190  -6.872
   32    H    LEU   6           H        LEU   6   5.868 -14.467  -2.805
   33    HA   LEU   6           HA       LEU   6   6.844 -14.079  -0.026
   34    HB2  LEU   6           1HB      LEU   6   6.008 -12.242  -2.174
   35    HB3  LEU   6           2HB      LEU   6   6.728 -11.618  -0.672
   36    HG   LEU   6           HG       LEU   6   8.096 -13.328  -2.786
   37   HD11  LEU   6          1HD1      LEU   6   9.552 -11.305  -3.076
   38   HD12  LEU   6          2HD1      LEU   6   7.846 -10.925  -3.405
   39   HD13  LEU   6          3HD1      LEU   6   8.581 -10.450  -1.855
   40   HD21  LEU   6          3HD2      LEU   6   8.844 -13.958  -0.567
   41   HD22  LEU   6          1HD2      LEU   6  10.136 -13.072  -1.414
   42   HD23  LEU   6          2HD2      LEU   6   9.170 -12.256  -0.161
   43    H    SER   7           H        SER   7   5.733 -12.851   1.521
   44    HA   SER   7           HA       SER   7   2.879 -13.390   1.786
   45    HB2  SER   7           1HB      SER   7   4.127 -13.319   3.681
   46    HB3  SER   7           2HB      SER   7   4.762 -11.700   3.308
   47    HG   SER   7           HG       SER   7   2.147 -12.454   4.053
   48    H    LEU   8           H        LEU   8   1.162 -11.946   1.708
   49    HA   LEU   8           HA       LEU   8   1.201  -9.859  -0.260
   50    HB2  LEU   8           1HB      LEU   8  -0.541 -10.533   2.012
   51    HB3  LEU   8           2HB      LEU   8  -1.050  -9.235   0.908
   52    HG   LEU   8           HG       LEU   8  -0.616 -12.156   0.174
   53   HD11  LEU   8          1HD1      LEU   8  -3.096 -12.164  -0.203
   54   HD12  LEU   8          2HD1      LEU   8  -2.700 -11.765   1.485
   55   HD13  LEU   8          3HD1      LEU   8  -3.170 -10.476   0.352
   56   HD21  LEU   8          3HD2      LEU   8  -0.009 -10.678  -1.649
   57   HD22  LEU   8          1HD2      LEU   8  -1.526 -11.524  -2.034
   58   HD23  LEU   8          2HD2      LEU   8  -1.562  -9.821  -1.511
   59    H    THR   9           H        THR   9   1.926  -9.884   3.153
   60    HA   THR   9           HA       THR   9   1.893  -6.967   3.404
   61    HB   THR   9           HB       THR   9   2.971  -7.351   5.577
   62    HG1  THR   9           1HG      THR   9   3.055 -10.097   4.777
   63   HG21  THR   9          3HG2      THR   9   0.769  -9.379   5.017
   64   HG22  THR   9          1HG2      THR   9   1.236  -8.765   6.621
   65   HG23  THR   9          2HG2      THR   9   0.524  -7.662   5.421
   66    H    GLN  10           H        GLN  10   4.171  -9.372   2.351
   67    HA   GLN  10           HA       GLN  10   6.406  -7.443   2.365
   68    HB2  GLN  10           1HB      GLN  10   6.074 -10.225   1.225
   69    HB3  GLN  10           2HB      GLN  10   7.564  -9.260   1.106
   70    HG2  GLN  10           1HG      GLN  10   7.793  -9.432   3.740
   71    HG3  GLN  10           2HG      GLN  10   6.133 -10.024   3.497
   72   HE21  GLN  10          2HE2      GLN  10   8.579 -11.211   4.800
   73   HE22  GLN  10          1HE2      GLN  10   8.774 -12.757   4.043
   74    H    LEU  11           H        LEU  11   4.068  -8.779   0.090
   75    HA   LEU  11           HA       LEU  11   5.342  -7.706  -2.273
   76    HB2  LEU  11           1HB      LEU  11   2.629  -8.558  -1.536
   77    HB3  LEU  11           2HB      LEU  11   2.912  -8.045  -3.216
   78    HG   LEU  11           HG       LEU  11   4.254 -10.380  -1.798
   79   HD11  LEU  11          1HD1      LEU  11   2.961 -11.782  -3.427
   80   HD12  LEU  11          2HD1      LEU  11   1.875 -10.825  -2.395
   81   HD13  LEU  11          3HD1      LEU  11   2.198 -10.308  -4.067
   82   HD21  LEU  11          3HD2      LEU  11   5.746  -9.317  -3.385
   83   HD22  LEU  11          1HD2      LEU  11   5.222 -10.897  -4.011
   84   HD23  LEU  11          2HD2      LEU  11   4.503  -9.402  -4.656
   85    H    ILE  12           H        ILE  12   2.740  -6.507  -0.164
   86    HA   ILE  12           HA       ILE  12   2.306  -4.058  -1.637
   87    HB   ILE  12           HB       ILE  12   1.843  -4.803   1.285
   88   HG12  ILE  12          1HG1      ILE  12  -0.137  -4.373  -0.930
   89   HG13  ILE  12          2HG1      ILE  12   0.545  -5.956  -0.496
   90   HG21  ILE  12          1HG2      ILE  12   0.488  -2.741   1.420
   91   HG22  ILE  12          2HG2      ILE  12   2.189  -2.365   1.066
   92   HG23  ILE  12          3HG2      ILE  12   0.977  -2.310  -0.235
   93   HD11  ILE  12          3HD1      ILE  12  -1.076  -4.158   1.338
   94   HD12  ILE  12          1HD1      ILE  12  -1.667  -5.630   0.536
   95   HD13  ILE  12          2HD1      ILE  12  -0.392  -5.741   1.772
   96    H    LEU  13           H        LEU  13   4.402  -4.802   1.136
   97    HA   LEU  13           HA       LEU  13   5.519  -2.214   1.435
   98    HB2  LEU  13           1HB      LEU  13   5.742  -4.199   2.801
   99    HB3  LEU  13           2HB      LEU  13   7.024  -4.864   1.763
  100    HG   LEU  13           HG       LEU  13   7.126  -2.191   3.215
  101   HD11  LEU  13          1HD1      LEU  13   8.861  -3.302   4.648
  102   HD12  LEU  13          2HD1      LEU  13   7.292  -4.128   4.777
  103   HD13  LEU  13          3HD1      LEU  13   8.585  -4.827   3.774
  104   HD21  LEU  13          3HD2      LEU  13   8.376  -2.173   1.138
  105   HD22  LEU  13          1HD2      LEU  13   9.497  -2.164   2.521
  106   HD23  LEU  13          2HD2      LEU  13   9.227  -3.666   1.602
  107    H    ILE  14           H        ILE  14   6.575  -4.878  -0.686
  108    HA   ILE  14           HA       ILE  14   8.782  -3.431  -1.850
  109    HB   ILE  14           HB       ILE  14   7.072  -5.735  -2.883
  110   HG12  ILE  14          1HG1      ILE  14   9.920  -5.732  -1.932
  111   HG13  ILE  14          2HG1      ILE  14   8.523  -6.055  -0.879
  112   HG21  ILE  14          1HG2      ILE  14   8.812  -6.032  -4.613
  113   HG22  ILE  14          2HG2      ILE  14   8.009  -4.455  -4.779
  114   HG23  ILE  14          3HG2      ILE  14   9.628  -4.557  -4.049
  115   HD11  ILE  14          3HD1      ILE  14   9.301  -7.659  -3.339
  116   HD12  ILE  14          1HD1      ILE  14   9.557  -8.153  -1.651
  117   HD13  ILE  14          2HD1      ILE  14   7.904  -7.980  -2.287
  118    H    ARG  15           H        ARG  15   5.382  -3.694  -2.806
  119    HA   ARG  15           HA       ARG  15   5.688  -2.181  -5.236
  120    HB2  ARG  15           1HB      ARG  15   3.817  -3.591  -4.905
  121    HB3  ARG  15           2HB      ARG  15   3.282  -2.608  -3.522
  122    HG2  ARG  15           1HG      ARG  15   1.937  -2.044  -5.445
  123    HG3  ARG  15           2HG      ARG  15   3.004  -0.673  -5.060
  124    HD2  ARG  15           1HD      ARG  15   4.514  -1.405  -6.840
  125    HD3  ARG  15           2HD      ARG  15   3.353  -2.685  -7.257
  126    HE   ARG  15           HE       ARG  15   2.020  -0.109  -7.504
  127   HH11  ARG  15          1HH1      ARG  15   4.508  -1.972  -9.084
  128   HH12  ARG  15          2HH1      ARG  15   4.117  -1.210 -10.612
  129   HH21  ARG  15          1HH2      ARG  15   1.566   0.779  -9.245
  130   HH22  ARG  15          2HH2      ARG  15   2.440   0.362 -10.706
  131    H    LEU  16           H        LEU  16   5.153  -1.247  -1.879
  132    HA   LEU  16           HA       LEU  16   4.664   1.561  -2.652
  133    HB2  LEU  16           1HB      LEU  16   4.963   0.113  -0.105
  134    HB3  LEU  16           2HB      LEU  16   4.562   1.846  -0.087
  135    HG   LEU  16           HG       LEU  16   2.855  -0.432  -1.158
  136   HD11  LEU  16          1HD1      LEU  16   1.253   0.317   0.622
  137   HD12  LEU  16          2HD1      LEU  16   2.818  -0.165   1.320
  138   HD13  LEU  16          3HD1      LEU  16   2.423   1.560   1.127
  139   HD21  LEU  16          3HD2      LEU  16   2.664   1.501  -2.611
  140   HD22  LEU  16          1HD2      LEU  16   1.164   1.296  -1.673
  141   HD23  LEU  16          2HD2      LEU  16   2.338   2.553  -1.214
  142    H    SER  17           H        SER  17   7.331  -0.440  -1.788
  143    HA   SER  17           HA       SER  17   9.175   1.754  -1.066
  144    HB2  SER  17           1HB      SER  17  10.827   0.206  -1.038
  145    HB3  SER  17           2HB      SER  17   9.395  -0.491  -0.248
  146    HG   SER  17           HG       SER  17  10.260  -1.005  -2.901
  147    H    ASN  18           H        ASN  18   7.879   0.337  -3.980
  148    HA   ASN  18           HA       ASN  18  10.064   1.499  -5.641
  149    HB2  ASN  18           1HB      ASN  18   7.715  -0.281  -6.640
  150    HB3  ASN  18           2HB      ASN  18   9.049   0.643  -7.374
  151   HD21  ASN  18          2HD2      ASN  18   8.353  -2.272  -7.244
  152   HD22  ASN  18          1HD2      ASN  18   9.801  -3.041  -6.684
  153    H    ARG  19           H        ARG  19   6.551   1.761  -5.144
  154    HA   ARG  19           HA       ARG  19   6.463   4.064  -7.017
  155    HB2  ARG  19           1HB      ARG  19   4.292   2.639  -5.547
  156    HB3  ARG  19           2HB      ARG  19   4.077   4.047  -6.612
  157    HG2  ARG  19           1HG      ARG  19   5.251   1.389  -7.482
  158    HG3  ARG  19           2HG      ARG  19   3.547   1.860  -7.700
  159    HD2  ARG  19           1HD      ARG  19   5.868   3.387  -8.824
  160    HD3  ARG  19           2HD      ARG  19   5.000   2.100  -9.691
  161    HE   ARG  19           HE       ARG  19   2.986   3.995  -9.096
  162   HH11  ARG  19          1HH1      ARG  19   6.096   4.225 -10.656
  163   HH12  ARG  19          2HH1      ARG  19   5.501   5.534 -11.659
  164   HH21  ARG  19          1HH2      ARG  19   2.293   5.497 -10.232
  165   HH22  ARG  19          2HH2      ARG  19   3.334   6.260 -11.418
  166    H    GLY  20           H        GLY  20   6.081   3.353  -3.571
  167    HA2  GLY  20           1HA      GLY  20   6.724   5.037  -1.936
  168    HA3  GLY  20           2HA      GLY  20   6.191   6.297  -3.075
  169    H    CYS  21           H        CYS  21   3.735   5.096  -3.858
  170    HA   CYS  21           HA       CYS  21   2.044   4.689  -1.453
  171    HB2  CYS  21           1HB      CYS  21   2.671   7.082  -1.356
  172    HB3  CYS  21           2HB      CYS  21   2.102   7.302  -3.029
  173    HG   CYS  21           HG       CYS  21   0.531   8.449  -1.399
  174    H    GLN  22           H        GLN  22   0.422   3.435  -2.113
  175    HA   GLN  22           HA       GLN  22  -0.644   3.791  -4.883
  176    HB2  GLN  22           1HB      GLN  22   0.072   1.201  -3.494
  177    HB3  GLN  22           2HB      GLN  22  -0.899   1.317  -4.979
  178    HG2  GLN  22           1HG      GLN  22   2.116   2.214  -4.905
  179    HG3  GLN  22           2HG      GLN  22   1.290   0.673  -5.232
  180   HE21  GLN  22          2HE2      GLN  22   0.972   4.147  -6.115
  181   HE22  GLN  22          1HE2      GLN  22   0.713   3.864  -7.804
  182    H    THR  23           H        THR  23  -2.772   2.952  -5.228
  183    HA   THR  23           HA       THR  23  -4.471   3.098  -2.807
  184    HB   THR  23           HB       THR  23  -6.350   3.043  -4.325
  185    HG1  THR  23           1HG      THR  23  -5.689   2.904  -6.695
  186   HG21  THR  23          3HG2      THR  23  -4.118   4.733  -5.520
  187   HG22  THR  23          1HG2      THR  23  -5.861   4.978  -5.781
  188   HG23  THR  23          2HG2      THR  23  -5.161   5.203  -4.159
  189    H    LEU  24           H        LEU  24  -6.270   1.506  -2.608
  190    HA   LEU  24           HA       LEU  24  -5.298  -1.151  -2.263
  191    HB2  LEU  24           1HB      LEU  24  -7.104  -0.274  -1.135
  192    HB3  LEU  24           2HB      LEU  24  -8.163  -0.094  -2.553
  193    HG   LEU  24           HG       LEU  24  -8.010  -2.602  -2.854
  194   HD11  LEU  24          1HD1      LEU  24  -7.338  -3.928  -0.834
  195   HD12  LEU  24          2HD1      LEU  24  -5.979  -2.963  -1.456
  196   HD13  LEU  24          3HD1      LEU  24  -6.874  -2.418  -0.016
  197   HD21  LEU  24          3HD2      LEU  24  -9.983  -1.549  -1.917
  198   HD22  LEU  24          1HD2      LEU  24  -9.677  -3.099  -1.099
  199   HD23  LEU  24          2HD2      LEU  24  -9.256  -1.569  -0.292
  200    H    GLU  25           H        GLU  25  -6.953   0.374  -4.992
  201    HA   GLU  25           HA       GLU  25  -7.312  -2.121  -6.442
  202    HB2  GLU  25           1HB      GLU  25  -7.374   0.779  -7.276
  203    HB3  GLU  25           2HB      GLU  25  -7.721  -0.580  -8.370
  204    HG2  GLU  25           1HG      GLU  25  -9.702  -1.208  -6.923
  205    HG3  GLU  25           2HG      GLU  25  -9.175   0.109  -5.851
  206    H    GLU  26           H        GLU  26  -4.866   0.443  -6.461
  207    HA   GLU  26           HA       GLU  26  -3.332  -0.689  -8.639
  208    HB2  GLU  26           1HB      GLU  26  -2.637   1.165  -6.362
  209    HB3  GLU  26           2HB      GLU  26  -1.484   0.683  -7.631
  210    HG2  GLU  26           1HG      GLU  26  -2.991   1.765  -9.362
  211    HG3  GLU  26           2HG      GLU  26  -4.086   2.104  -8.003
  212    H    LEU  27           H        LEU  27  -3.325  -1.165  -5.136
  213    HA   LEU  27           HA       LEU  27  -1.080  -3.024  -5.207
  214    HB2  LEU  27           1HB      LEU  27  -3.276  -2.448  -3.337
  215    HB3  LEU  27           2HB      LEU  27  -2.036  -3.629  -2.861
  216    HG   LEU  27           HG       LEU  27  -1.555  -0.687  -3.472
  217   HD11  LEU  27          1HD1      LEU  27  -1.071  -0.508  -1.017
  218   HD12  LEU  27          2HD1      LEU  27  -2.742  -1.044  -1.308
  219   HD13  LEU  27          3HD1      LEU  27  -1.500  -2.223  -0.822
  220   HD21  LEU  27          3HD2      LEU  27   0.339  -2.072  -4.083
  221   HD22  LEU  27          1HD2      LEU  27   0.730  -1.113  -2.634
  222   HD23  LEU  27          2HD2      LEU  27   0.332  -2.840  -2.478
  223    H    GLU  28           H        GLU  28  -4.559  -3.270  -5.590
  224    HA   GLU  28           HA       GLU  28  -4.717  -6.143  -5.479
  225    HB2  GLU  28           1HB      GLU  28  -6.659  -4.647  -5.379
  226    HB3  GLU  28           2HB      GLU  28  -6.354  -4.155  -7.062
  227    HG2  GLU  28           1HG      GLU  28  -6.743  -6.625  -7.732
  228    HG3  GLU  28           2HG      GLU  28  -7.134  -6.838  -6.010
  229    H    GLU  29           H        GLU  29  -3.944  -3.881  -8.091
  230    HA   GLU  29           HA       GLU  29  -3.825  -5.870 -10.174
  231    HB2  GLU  29           1HB      GLU  29  -2.490  -3.186  -9.821
  232    HB3  GLU  29           2HB      GLU  29  -2.337  -4.184 -11.287
  233    HG2  GLU  29           1HG      GLU  29  -4.809  -3.972 -11.689
  234    HG3  GLU  29           2HG      GLU  29  -4.884  -3.154 -10.111
  235    H    PHE  30           H        PHE  30  -1.432  -4.659  -7.860
  236    HA   PHE  30           HA       PHE  30   0.791  -6.064  -9.091
  237    HB2  PHE  30           1HB      PHE  30   1.092  -4.063  -7.629
  238    HB3  PHE  30           2HB      PHE  30   0.497  -5.010  -6.245
  239    HD1  PHE  30           1HD      PHE  30   3.183  -4.853  -8.802
  240    HD2  PHE  30           2HD      PHE  30   1.928  -6.316  -4.990
  241    HE1  PHE  30           1HE      PHE  30   5.486  -5.625  -8.343
  242    HE2  PHE  30           2HE      PHE  30   4.231  -7.088  -4.526
  243    HZ   PHE  30           HZ       PHE  30   6.010  -6.744  -6.204
  244    H    THR  31           H        THR  31  -1.365  -6.781  -6.351
  245    HA   THR  31           HA       THR  31   0.125  -9.300  -5.860
  246    HB   THR  31           HB       THR  31  -1.275  -9.514  -3.866
  247    HG1  THR  31           1HG      THR  31  -2.532  -7.062  -4.595
  248   HG21  THR  31          3HG2      THR  31  -0.278  -6.659  -4.225
  249   HG22  THR  31          1HG2      THR  31  -0.604  -7.458  -2.671
  250   HG23  THR  31          2HG2      THR  31   0.710  -8.047  -3.717
  251    H    GLN  32           H        GLN  32  -2.768  -8.201  -7.411
  252    HA   GLN  32           HA       GLN  32  -4.697  -9.291  -8.109
  253    HB2  GLN  32           1HB      GLN  32  -2.759 -11.608  -8.279
  254    HB3  GLN  32           2HB      GLN  32  -4.388 -11.570  -8.993
  255    HG2  GLN  32           1HG      GLN  32  -2.042  -9.734 -10.006
  256    HG3  GLN  32           2HG      GLN  32  -2.746 -11.293 -10.497
  257   HE21  GLN  32          2HE2      GLN  32  -2.813  -7.971 -10.944
  258   HE22  GLN  32          1HE2      GLN  32  -4.355  -7.829 -11.717
  259    H    ALA  33           H        ALA  33  -4.230  -9.151  -5.290
  260    HA   ALA  33           HA       ALA  33  -5.484 -11.696  -4.372
  261    HB1  ALA  33           1HB      ALA  33  -4.950 -10.900  -2.102
  262    HB2  ALA  33           2HB      ALA  33  -3.497 -10.975  -3.125
  263    HB3  ALA  33           3HB      ALA  33  -4.267  -9.408  -2.786
  264    H    LYS  34           H        LYS  34  -7.200 -11.522  -2.733
  265    HA   LYS  34           HA       LYS  34  -9.382  -9.906  -3.692
  266    HB2  LYS  34           1HB      LYS  34  -9.580 -12.083  -2.506
  267    HB3  LYS  34           2HB      LYS  34  -9.064 -11.265  -1.013
  268    HG2  LYS  34           1HG      LYS  34 -11.044  -9.782  -1.168
  269    HG3  LYS  34           2HG      LYS  34 -11.572 -10.668  -2.619
  270    HD2  LYS  34           1HD      LYS  34 -11.602 -12.766  -1.241
  271    HD3  LYS  34           2HD      LYS  34 -11.264 -11.768   0.194
  272    HE2  LYS  34           1HE      LYS  34 -13.328 -10.449  -0.317
  273    HE3  LYS  34           2HE      LYS  34 -13.686 -11.603  -1.623
  274    HZ1  LYS  34           3HZ      LYS  34 -13.441 -12.276   1.239
  275    HZ2  LYS  34           1HZ      LYS  34 -14.857 -12.157   0.399
  276    HZ3  LYS  34           2HZ      LYS  34 -13.774 -13.345   0.029
  277    H    ARG  35           H        ARG  35 -10.308  -8.077  -3.015
  278    HA   ARG  35           HA       ARG  35  -8.661  -6.068  -1.842
  279    HB2  ARG  35           1HB      ARG  35 -11.612  -6.211  -2.220
  280    HB3  ARG  35           2HB      ARG  35 -10.760  -4.808  -1.533
  281    HG2  ARG  35           1HG      ARG  35  -9.483  -4.546  -3.599
  282    HG3  ARG  35           2HG      ARG  35 -10.275  -5.983  -4.289
  283    HD2  ARG  35           1HD      ARG  35 -12.423  -4.813  -4.134
  284    HD3  ARG  35           2HD      ARG  35 -11.553  -3.365  -3.576
  285    HE   ARG  35           HE       ARG  35 -10.481  -4.029  -6.166
  286   HH11  ARG  35          1HH1      ARG  35 -13.565  -3.078  -4.844
  287   HH12  ARG  35          2HH1      ARG  35 -13.974  -2.286  -6.353
  288   HH21  ARG  35          1HH2      ARG  35 -10.940  -3.133  -7.903
  289   HH22  ARG  35          2HH2      ARG  35 -12.479  -2.317  -8.099
  290    H    GLU  36           H        GLU  36 -11.232  -8.062  -0.391
  291    HA   GLU  36           HA       GLU  36 -11.140  -6.968   2.223
  292    HB2  GLU  36           1HB      GLU  36 -12.810  -8.578   1.449
  293    HB3  GLU  36           2HB      GLU  36 -11.556  -9.837   1.367
  294    HG2  GLU  36           1HG      GLU  36 -11.268  -9.643   3.892
  295    HG3  GLU  36           2HG      GLU  36 -12.510  -8.374   3.792
  296    H    VAL  37           H        VAL  37  -9.206  -9.635   0.849
  297    HA   VAL  37           HA       VAL  37  -7.714 -10.114   3.294
  298    HB   VAL  37           HB       VAL  37  -7.074 -10.748   0.382
  299   HG11  VAL  37          1HG1      VAL  37  -5.404 -12.316   1.312
  300   HG12  VAL  37          2HG1      VAL  37  -5.028 -10.636   1.766
  301   HG13  VAL  37          3HG1      VAL  37  -5.772 -11.733   2.955
  302   HG21  VAL  37          3HG2      VAL  37  -9.073 -11.861   1.177
  303   HG22  VAL  37          1HG2      VAL  37  -7.743 -13.023   0.973
  304   HG23  VAL  37          2HG2      VAL  37  -8.194 -12.466   2.601
  305    H    LEU  38           H        LEU  38  -7.116  -8.065   0.470
  306    HA   LEU  38           HA       LEU  38  -4.458  -7.302   1.269
  307    HB2  LEU  38           1HB      LEU  38  -6.591  -6.142  -0.377
  308    HB3  LEU  38           2HB      LEU  38  -5.061  -5.240  -0.270
  309    HG   LEU  38           HG       LEU  38  -5.400  -8.067  -1.348
  310   HD11  LEU  38          1HD1      LEU  38  -4.823  -7.027  -3.557
  311   HD12  LEU  38          2HD1      LEU  38  -6.313  -6.325  -2.883
  312   HD13  LEU  38          3HD1      LEU  38  -4.778  -5.429  -2.778
  313   HD21  LEU  38          3HD2      LEU  38  -3.252  -7.754  -0.265
  314   HD22  LEU  38          1HD2      LEU  38  -3.034  -7.857  -2.029
  315   HD23  LEU  38          2HD2      LEU  38  -2.957  -6.277  -1.212
  316    H    LEU  39           H        LEU  39  -7.658  -5.985   2.000
  317    HA   LEU  39           HA       LEU  39  -6.705  -3.655   3.397
  318    HB2  LEU  39           1HB      LEU  39  -9.117  -5.329   3.481
  319    HB3  LEU  39           2HB      LEU  39  -9.072  -3.895   4.532
  320    HG   LEU  39           HG       LEU  39  -8.862  -3.878   1.498
  321   HD11  LEU  39          1HD1      LEU  39 -11.135  -2.820   1.583
  322   HD12  LEU  39          2HD1      LEU  39 -11.153  -4.452   2.293
  323   HD13  LEU  39          3HD1      LEU  39 -11.144  -3.019   3.351
  324   HD21  LEU  39          3HD2      LEU  39  -7.616  -2.069   2.523
  325   HD22  LEU  39          1HD2      LEU  39  -9.070  -1.427   1.722
  326   HD23  LEU  39          2HD2      LEU  39  -9.033  -1.603   3.493
  327    H    VAL  40           H        VAL  40  -7.283  -6.991   4.402
  328    HA   VAL  40           HA       VAL  40  -6.740  -6.559   7.223
  329    HB   VAL  40           HB       VAL  40  -6.435  -9.013   5.445
  330   HG11  VAL  40          1HG1      VAL  40  -6.273 -10.280   7.562
  331   HG12  VAL  40          2HG1      VAL  40  -4.923  -9.133   7.398
  332   HG13  VAL  40          3HG1      VAL  40  -6.287  -8.755   8.477
  333   HG21  VAL  40          3HG2      VAL  40  -8.725  -8.257   5.670
  334   HG22  VAL  40          1HG2      VAL  40  -8.471  -9.775   6.562
  335   HG23  VAL  40          2HG2      VAL  40  -8.564  -8.230   7.442
  336    H    THR  41           H        THR  41  -4.650  -7.367   4.470
  337    HA   THR  41           HA       THR  41  -2.284  -7.542   6.175
  338    HB   THR  41           HB       THR  41  -1.037  -7.657   4.044
  339    HG1  THR  41           1HG      THR  41  -2.288  -7.583   2.082
  340   HG21  THR  41          3HG2      THR  41  -3.570  -9.345   4.037
  341   HG22  THR  41          1HG2      THR  41  -2.071  -9.716   3.153
  342   HG23  THR  41          2HG2      THR  41  -2.078  -9.714   4.933
  343    H    LEU  42           H        LEU  42  -3.916  -5.015   4.399
  344    HA   LEU  42           HA       LEU  42  -1.774  -3.072   4.682
  345    HB2  LEU  42           1HB      LEU  42  -4.680  -3.008   4.278
  346    HB3  LEU  42           2HB      LEU  42  -3.832  -1.446   4.379
  347    HG   LEU  42           HG       LEU  42  -3.262  -3.618   2.327
  348   HD11  LEU  42          1HD1      LEU  42  -4.356  -2.058   0.693
  349   HD12  LEU  42          2HD1      LEU  42  -5.494  -2.568   1.963
  350   HD13  LEU  42          3HD1      LEU  42  -4.747  -0.954   2.032
  351   HD21  LEU  42          3HD2      LEU  42  -1.326  -2.251   2.842
  352   HD22  LEU  42          1HD2      LEU  42  -1.921  -1.867   1.208
  353   HD23  LEU  42          2HD2      LEU  42  -2.264  -0.765   2.564
  354    H    THR  43           H        THR  43  -4.596  -3.966   6.645
  355    HA   THR  43           HA       THR  43  -4.099  -2.085   8.761
  356    HB   THR  43           HB       THR  43  -5.337  -4.869   8.869
  357    HG1  THR  43           1HG      THR  43  -7.294  -3.611   8.828
  358   HG21  THR  43          3HG2      THR  43  -5.451  -2.557  10.845
  359   HG22  THR  43          1HG2      THR  43  -6.350  -4.085  10.980
  360   HG23  THR  43          2HG2      THR  43  -4.574  -4.086  11.084
  361    H    ARG  44           H        ARG  44  -2.850  -5.346   8.130
  362    HA   ARG  44           HA       ARG  44  -1.318  -5.594  10.534
  363    HB2  ARG  44           1HB      ARG  44  -0.926  -6.760   7.820
  364    HB3  ARG  44           2HB      ARG  44   0.115  -7.109   9.221
  365    HG2  ARG  44           1HG      ARG  44  -1.762  -8.049  10.436
  366    HG3  ARG  44           2HG      ARG  44  -2.876  -7.597   9.124
  367    HD2  ARG  44           1HD      ARG  44  -1.716  -9.132   7.638
  368    HD3  ARG  44           2HD      ARG  44  -0.649  -9.606   8.981
  369    HE   ARG  44           HE       ARG  44  -3.350 -10.223   9.788
  370   HH11  ARG  44          1HH1      ARG  44  -1.109 -11.238   7.317
  371   HH12  ARG  44          2HH1      ARG  44  -1.830 -12.835   7.311
  372   HH21  ARG  44          1HH2      ARG  44  -4.192 -12.045   9.786
  373   HH22  ARG  44          2HH2      ARG  44  -3.590 -13.296   8.717
  374    H    LEU  45           H        LEU  45  -0.427  -4.266   7.347
  375    HA   LEU  45           HA       LEU  45   2.261  -3.583   8.207
  376    HB2  LEU  45           1HB      LEU  45   0.489  -2.793   5.999
  377    HB3  LEU  45           2HB      LEU  45   2.146  -2.149   6.021
  378    HG   LEU  45           HG       LEU  45   1.347  -5.079   5.820
  379   HD11  LEU  45          1HD1      LEU  45   2.353  -4.925   3.529
  380   HD12  LEU  45          2HD1      LEU  45   0.988  -3.798   3.712
  381   HD13  LEU  45          3HD1      LEU  45   2.660  -3.193   3.796
  382   HD21  LEU  45          3HD2      LEU  45   3.389  -4.806   7.099
  383   HD22  LEU  45          1HD2      LEU  45   3.758  -5.509   5.506
  384   HD23  LEU  45          2HD2      LEU  45   4.089  -3.787   5.817
  385    H    HIS  46           H        HIS  46  -0.835  -2.036   8.446
  386    HA   HIS  46           HA       HIS  46   0.222   0.613   9.035
  387    HB2  HIS  46           1HB      HIS  46  -2.128   0.243   8.260
  388    HB3  HIS  46           2HB      HIS  46  -2.471  -0.609   9.785
  389    HD2  HIS  46           2HD      HIS  46  -3.437   1.093  11.807
  390    HE1  HIS  46           1HE      HIS  46  -2.102   4.689   9.978
  391    HE2  HIS  46           2HE      HIS  46  -3.434   3.591  11.960
  392    H    GLN  47           H        GLN  47  -0.893  -2.124  11.024
  393    HA   GLN  47           HA       GLN  47  -0.276  -0.753  13.519
  394    HB2  GLN  47           1HB      GLN  47  -0.805  -3.644  12.812
  395    HB3  GLN  47           2HB      GLN  47  -0.518  -3.064  14.470
  396    HG2  GLN  47           1HG      GLN  47  -2.759  -1.574  14.149
  397    HG3  GLN  47           2HG      GLN  47  -2.570  -2.356  12.563
  398   HE21  GLN  47          2HE2      GLN  47  -4.913  -2.534  14.099
  399   HE22  GLN  47          1HE2      GLN  47  -5.114  -4.174  14.618
  400    H    ARG  48           H        ARG  48   1.502  -2.742  11.274
  401    HA   ARG  48           HA       ARG  48   3.708  -3.310  13.084
  402    HB2  ARG  48           1HB      ARG  48   3.416  -3.443  10.126
  403    HB3  ARG  48           2HB      ARG  48   4.955  -3.733  10.969
  404    HG2  ARG  48           1HG      ARG  48   4.001  -5.605  12.173
  405    HG3  ARG  48           2HG      ARG  48   2.392  -5.266  11.491
  406    HD2  ARG  48           1HD      ARG  48   3.253  -5.780   9.272
  407    HD3  ARG  48           2HD      ARG  48   4.828  -6.182   9.996
  408    HE   ARG  48           HE       ARG  48   2.980  -7.974  11.215
  409   HH11  ARG  48          1HH1      ARG  48   3.883  -7.246   7.926
  410   HH12  ARG  48          2HH1      ARG  48   3.543  -8.902   7.460
  411   HH21  ARG  48          1HH2      ARG  48   2.579  -9.871  10.696
  412   HH22  ARG  48          2HH2      ARG  48   2.798 -10.398   9.039
  413    H    GLY  49           H        GLY  49   2.712  -0.539  11.298
  414    HA2  GLY  49           1HA      GLY  49   3.655   1.609  11.415
  415    HA3  GLY  49           2HA      GLY  49   5.087   0.928  12.221
  416    H    VAL  50           H        VAL  50   3.863  -0.533   9.299
  417    HA   VAL  50           HA       VAL  50   6.380   0.224   7.877
  418    HB   VAL  50           HB       VAL  50   4.156  -1.731   7.151
  419   HG11  VAL  50          1HG1      VAL  50   5.729  -2.493   5.402
  420   HG12  VAL  50          2HG1      VAL  50   5.294  -0.783   5.171
  421   HG13  VAL  50          3HG1      VAL  50   6.873  -1.213   5.873
  422   HG21  VAL  50          3HG2      VAL  50   5.407  -2.473   9.089
  423   HG22  VAL  50          1HG2      VAL  50   5.793  -3.469   7.667
  424   HG23  VAL  50          2HG2      VAL  50   6.940  -2.224   8.219
  425    H    ILE  51           H        ILE  51   2.863   0.496   7.489
  426    HA   ILE  51           HA       ILE  51   3.399   2.628   5.439
  427    HB   ILE  51           HB       ILE  51   1.386   1.917   4.235
  428   HG12  ILE  51          1HG1      ILE  51   1.204  -0.357   6.193
  429   HG13  ILE  51          2HG1      ILE  51   0.212   1.119   6.246
  430   HG21  ILE  51          1HG2      ILE  51   2.147  -0.269   3.370
  431   HG22  ILE  51          2HG2      ILE  51   3.516   0.844   3.587
  432   HG23  ILE  51          3HG2      ILE  51   3.228  -0.449   4.773
  433   HD11  ILE  51          3HD1      ILE  51   0.276  -0.899   3.975
  434   HD12  ILE  51          1HD1      ILE  51  -1.014  -0.737   5.188
  435   HD13  ILE  51          2HD1      ILE  51  -0.714   0.577   4.027
  436    H    TYR  52           H        TYR  52   1.508   4.034   5.060
  437    HA   TYR  52           HA       TYR  52  -0.212   4.377   7.456
  438    HB2  TYR  52           1HB      TYR  52   1.798   5.703   7.914
  439    HB3  TYR  52           2HB      TYR  52   1.591   6.541   6.356
  440    HD1  TYR  52           1HD      TYR  52  -0.156   5.907   9.605
  441    HD2  TYR  52           2HD      TYR  52   0.312   8.503   6.254
  442    HE1  TYR  52           1HE      TYR  52  -1.624   7.575  10.702
  443    HE2  TYR  52           2HE      TYR  52  -1.149  10.178   7.335
  444    HH   TYR  52           HH       TYR  52  -2.409  10.693   9.160
  445    H    ARG  53           H        ARG  53  -2.167   5.154   7.058
  446    HA   ARG  53           HA       ARG  53  -2.866   5.494   4.193
  447    HB2  ARG  53           1HB      ARG  53  -4.129   3.940   5.535
  448    HB3  ARG  53           2HB      ARG  53  -4.647   5.284   6.580
  449    HG2  ARG  53           1HG      ARG  53  -5.936   6.268   4.855
  450    HG3  ARG  53           2HG      ARG  53  -5.178   5.252   3.605
  451    HD2  ARG  53           1HD      ARG  53  -7.353   4.462   3.926
  452    HD3  ARG  53           2HD      ARG  53  -6.253   3.293   4.693
  453    HE   ARG  53           HE       ARG  53  -7.496   5.174   6.634
  454   HH11  ARG  53          1HH1      ARG  53  -7.849   2.124   4.980
  455   HH12  ARG  53          2HH1      ARG  53  -8.896   1.544   6.260
  456   HH21  ARG  53          1HH2      ARG  53  -8.699   4.527   8.104
  457   HH22  ARG  53          2HH2      ARG  53  -9.383   2.914   8.041
  458    H    LYS  54           H        LYS  54  -3.268   7.316   3.227
  459    HA   LYS  54           HA       LYS  54  -3.909   9.703   4.931
  460    HB2  LYS  54           1HB      LYS  54  -2.262   9.540   2.405
  461    HB3  LYS  54           2HB      LYS  54  -2.826  11.052   3.153
  462    HG2  LYS  54           1HG      LYS  54  -1.539  10.492   5.197
  463    HG3  LYS  54           2HG      LYS  54  -0.931   9.027   4.390
  464    HD2  LYS  54           1HD      LYS  54   0.114  10.413   2.648
  465    HD3  LYS  54           2HD      LYS  54  -0.504  11.881   3.442
  466    HE2  LYS  54           1HE      LYS  54   0.797  11.330   5.461
  467    HE3  LYS  54           2HE      LYS  54   1.428   9.877   4.653
  468    HZ1  LYS  54           3HZ      LYS  54   1.866  12.658   3.767
  469    HZ2  LYS  54           1HZ      LYS  54   2.979  11.707   4.529
  470    HZ3  LYS  54           2HZ      LYS  54   2.451  11.311   3.017
  471    H    TRP  55           H        TRP  55  -5.224  11.315   3.995
  472    HA   TRP  55           HA       TRP  55  -7.133  10.149   1.995
  473    HB2  TRP  55           1HB      TRP  55  -7.536  12.065   4.321
  474    HB3  TRP  55           2HB      TRP  55  -8.737  11.867   3.021
  475    HD1  TRP  55           HD       TRP  55 -10.279  10.006   3.185
  476    HE1  TRP  55           1HE      TRP  55 -10.710   7.959   4.898
  477    HE3  TRP  55           3HE      TRP  55  -6.009  10.420   5.911
  478    HZ2  TRP  55           2HZ      TRP  55  -9.328   6.842   7.014
  479    HZ3  TRP  55           3HZ      TRP  55  -5.582   8.895   7.736
  480    HH2  TRP  55           HH       TRP  55  -7.170   7.115   8.327
  481    H    ARG  56           H        ARG  56  -6.528  10.823   0.062
  482    HA   ARG  56           HA       ARG  56  -5.708  13.598  -0.421
  483    HB2  ARG  56           1HB      ARG  56  -4.784  11.851  -1.741
  484    HB3  ARG  56           2HB      ARG  56  -6.405  11.410  -2.328
  485    HG2  ARG  56           1HG      ARG  56  -6.618  13.587  -3.424
  486    HG3  ARG  56           2HG      ARG  56  -5.019  14.067  -2.807
  487    HD2  ARG  56           1HD      ARG  56  -3.976  12.350  -4.126
  488    HD3  ARG  56           2HD      ARG  56  -5.567  11.815  -4.714
  489    HE   ARG  56           HE       ARG  56  -5.187  14.571  -5.537
  490   HH11  ARG  56          1HH1      ARG  56  -3.840  11.424  -6.201
  491   HH12  ARG  56          2HH1      ARG  56  -3.446  11.930  -7.832
  492   HH21  ARG  56          1HH2      ARG  56  -4.734  15.167  -7.400
  493   HH22  ARG  56          2HH2      ARG  56  -3.956  14.066  -8.517
  494    H    HIS  57           H        HIS  57  -6.819  15.258  -1.230
  495    HA   HIS  57           HA       HIS  57  -9.794  14.878  -1.332
  496    HB2  HIS  57           1HB      HIS  57  -8.225  17.323  -0.390
  497    HB3  HIS  57           2HB      HIS  57  -9.997  17.174  -0.457
  498    HD2  HIS  57           2HD      HIS  57  -7.071  16.413   2.035
  499    HE1  HIS  57           1HE      HIS  57 -10.643  14.632   3.489
  500    HE2  HIS  57           2HE      HIS  57  -8.152  15.295   3.995
  501    H    PHE  58           H        PHE  58 -10.707  15.196  -3.184
  502    HA   PHE  58           HA       PHE  58  -9.847  17.436  -4.899
  503    HB2  PHE  58           1HB      PHE  58  -8.360  15.592  -5.658
  504    HB3  PHE  58           2HB      PHE  58  -9.787  14.567  -5.935
  505    HD1  PHE  58           1HD      PHE  58  -8.229  17.788  -6.954
  506    HD2  PHE  58           2HD      PHE  58 -10.854  14.572  -7.968
  507    HE1  PHE  58           1HE      PHE  58  -8.409  18.664  -9.259
  508    HE2  PHE  58           2HE      PHE  58 -11.034  15.444 -10.273
  509    HZ   PHE  58           HZ       PHE  58  -9.812  17.493 -10.918
  510    H    SER  59           H        SER  59 -11.532  18.433  -5.639
  511    HA   SER  59           HA       SER  59 -13.761  18.810  -6.414
  512    HB2  SER  59           1HB      SER  59 -13.705  15.898  -6.927
  513    HB3  SER  59           2HB      SER  59 -14.926  17.074  -7.461
  514    HG   SER  59           HG       SER  59 -13.329  16.669  -9.051
  515    H    GLY  60           H        GLY  60 -13.006  17.921  -3.535
  516    HA2  GLY  60           1HA      GLY  60 -14.323  17.955  -1.600
  517    HA3  GLY  60           2HA      GLY  60 -15.782  17.811  -2.606
  518    H    ARG  61           H        ARG  61 -13.586  15.517  -3.615
  519    HA   ARG  61           HA       ARG  61 -15.019  13.402  -2.060
  520    HB2  ARG  61           1HB      ARG  61 -13.527  13.235  -4.640
  521    HB3  ARG  61           2HB      ARG  61 -14.233  11.866  -3.753
  522    HG2  ARG  61           1HG      ARG  61 -16.472  12.889  -3.996
  523    HG3  ARG  61           2HG      ARG  61 -15.746  14.214  -4.938
  524    HD2  ARG  61           1HD      ARG  61 -15.013  12.566  -6.598
  525    HD3  ARG  61           2HD      ARG  61 -15.870  11.308  -5.677
  526    HE   ARG  61           HE       ARG  61 -17.806  13.328  -6.442
  527   HH11  ARG  61          1HH1      ARG  61 -15.788  10.923  -7.961
  528   HH12  ARG  61          2HH1      ARG  61 -16.965  10.740  -9.247
  529   HH21  ARG  61          1HH2      ARG  61 -19.158  13.135  -7.912
  530   HH22  ARG  61          2HH2      ARG  61 -18.887  12.001  -9.220
  531    H    LYS  62           H        LYS  62 -14.007  11.795  -0.982
  532    HA   LYS  62           HA       LYS  62 -11.164  12.380  -0.277
  533    HB2  LYS  62           1HB      LYS  62 -13.311  10.726   1.059
  534    HB3  LYS  62           2HB      LYS  62 -11.617  10.805   1.602
  535    HG2  LYS  62           1HG      LYS  62 -11.846  13.202   2.036
  536    HG3  LYS  62           2HG      LYS  62 -13.521  13.166   1.438
  537    HD2  LYS  62           1HD      LYS  62 -14.113  11.575   3.240
  538    HD3  LYS  62           2HD      LYS  62 -12.445  11.673   3.854
  539    HE2  LYS  62           1HE      LYS  62 -12.716  14.065   4.270
  540    HE3  LYS  62           2HE      LYS  62 -14.362  14.011   3.601
  541    HZ1  LYS  62           3HZ      LYS  62 -13.443  12.578   6.009
  542    HZ2  LYS  62           1HZ      LYS  62 -14.374  13.938   6.000
  543    HZ3  LYS  62           2HZ      LYS  62 -14.970  12.527   5.390
  544    H    TYR  63           H        TYR  63  -9.540  11.124  -0.771
  545    HA   TYR  63           HA       TYR  63 -10.170   8.436  -1.951
  546    HB2  TYR  63           1HB      TYR  63  -8.014  10.383  -2.791
  547    HB3  TYR  63           2HB      TYR  63  -8.292   8.756  -3.460
  548    HD1  TYR  63           2HD      TYR  63 -10.221   8.326  -4.920
  549    HD2  TYR  63           1HD      TYR  63  -9.447  12.240  -3.413
  550    HE1  TYR  63           2HE      TYR  63 -11.789   9.265  -6.584
  551    HE2  TYR  63           1HE      TYR  63 -11.016  13.198  -5.074
  552    HH   TYR  63           HH       TYR  63 -12.761  11.150  -7.415
  553    H    ARG  64           H        ARG  64  -9.639   7.018  -0.470
  554    HA   ARG  64           HA       ARG  64  -7.432   7.394   1.379
  555    HB2  ARG  64           1HB      ARG  64  -9.052   4.984   0.700
  556    HB3  ARG  64           2HB      ARG  64  -7.769   5.040   1.929
  557    HG2  ARG  64           1HG      ARG  64  -9.013   6.729   3.182
  558    HG3  ARG  64           2HG      ARG  64 -10.283   6.739   1.934
  559    HD2  ARG  64           1HD      ARG  64 -10.846   4.466   2.462
  560    HD3  ARG  64           2HD      ARG  64  -9.539   4.404   3.667
  561    HE   ARG  64           HE       ARG  64 -11.014   5.736   5.172
  562   HH11  ARG  64          1HH1      ARG  64 -12.459   5.342   2.022
  563   HH12  ARG  64          2HH1      ARG  64 -14.011   5.841   2.666
  564   HH21  ARG  64          1HH2      ARG  64 -12.781   6.317   5.921
  565   HH22  ARG  64          2HH2      ARG  64 -14.196   6.398   4.889
  566    H    GLU  65           H        GLU  65  -5.375   7.213   1.050
  567    HA   GLU  65           HA       GLU  65  -4.437   5.185  -0.950
  568    HB2  GLU  65           1HB      GLU  65  -3.312   7.943  -0.440
  569    HB3  GLU  65           2HB      GLU  65  -2.564   6.689  -1.459
  570    HG2  GLU  65           1HG      GLU  65  -4.623   6.806  -2.983
  571    HG3  GLU  65           2HG      GLU  65  -5.186   8.065  -1.861
  572    H    TYR  66           H        TYR  66  -2.501   4.158  -0.542
  573    HA   TYR  66           HA       TYR  66  -1.676   4.297   2.343
  574    HB2  TYR  66           1HB      TYR  66  -1.720   1.945   0.441
  575    HB3  TYR  66           2HB      TYR  66  -1.068   1.929   2.097
  576    HD1  TYR  66           1HD      TYR  66  -4.167   2.194   0.084
  577    HD2  TYR  66           2HD      TYR  66  -2.529   1.771   3.998
  578    HE1  TYR  66           1HE      TYR  66  -6.419   1.640   0.959
  579    HE2  TYR  66           2HE      TYR  66  -4.767   1.218   4.887
  580    HH   TYR  66           HH       TYR  66  -7.567   0.751   2.788
  581    H    CYS  67           H        CYS  67   0.182   5.234   2.602
  582    HA   CYS  67           HA       CYS  67   2.276   5.050   0.430
  583    HB2  CYS  67           1HB      CYS  67   2.984   7.143   1.407
  584    HB3  CYS  67           2HB      CYS  67   1.213   7.220   1.246
  585    HG   CYS  67           HG       CYS  67   2.984   6.503   3.896
  586    H    LEU  68           H        LEU  68   4.448   4.698   1.044
  587    HA   LEU  68           HA       LEU  68   4.825   2.889   3.323
  588    HB2  LEU  68           1HB      LEU  68   5.837   2.601   1.221
  589    HB3  LEU  68           2HB      LEU  68   6.850   4.058   1.336
  590    HG   LEU  68           HG       LEU  68   7.829   3.034   3.460
  591   HD11  LEU  68          1HD1      LEU  68   7.663   0.536   3.627
  592   HD12  LEU  68          2HD1      LEU  68   6.067   1.303   3.798
  593   HD13  LEU  68          3HD1      LEU  68   6.527   0.536   2.259
  594   HD21  LEU  68          3HD2      LEU  68   9.068   3.147   1.379
  595   HD22  LEU  68          1HD2      LEU  68   9.414   1.612   2.210
  596   HD23  LEU  68          2HD2      LEU  68   8.309   1.638   0.814
  597    H    LYS  69           H        LYS  69   5.515   3.300   5.270
  598    HA   LYS  69           HA       LYS  69   5.743   6.038   6.175
  599    HB2  LYS  69           1HB      LYS  69   4.928   4.173   7.561
  600    HB3  LYS  69           2HB      LYS  69   6.559   3.461   7.527
  601    HG2  LYS  69           1HG      LYS  69   6.272   4.594   9.636
  602    HG3  LYS  69           2HG      LYS  69   7.420   5.524   8.645
  603    HD2  LYS  69           1HD      LYS  69   5.674   7.099   8.023
  604    HD3  LYS  69           2HD      LYS  69   4.455   6.135   8.891
  605    HE2  LYS  69           1HE      LYS  69   5.630   6.549  11.008
  606    HE3  LYS  69           2HE      LYS  69   6.856   7.505  10.145
  607    HZ1  LYS  69           3HZ      LYS  69   3.984   8.161  10.324
  608    HZ2  LYS  69           1HZ      LYS  69   5.192   8.906  11.164
  609    HZ3  LYS  69           2HZ      LYS  69   5.122   9.047   9.522
  610    H    HIS  70           H        HIS  70   8.123   3.501   5.472
  611    HA   HIS  70           HA       HIS  70  10.458   4.853   6.307
  612    HB2  HIS  70           1HB      HIS  70  10.469   2.510   5.489
  613    HB3  HIS  70           2HB      HIS  70  10.098   3.084   3.846
  614    HD1  HIS  70           1HD      HIS  70  12.825   3.451   6.485
  615    HD2  HIS  70           2HD      HIS  70  12.402   3.514   2.293
  616    HE1  HIS  70           1HE      HIS  70  15.079   3.727   5.585
  617    H    ARG  71           H        ARG  71  11.705   6.434   5.600
  618    HA   ARG  71           HA       ARG  71  10.672   8.584   4.198
  619    HB2  ARG  71           1HB      ARG  71  12.739   8.579   5.485
  620    HB3  ARG  71           2HB      ARG  71  13.545   7.786   4.113
  621    HG2  ARG  71           1HG      ARG  71  13.054   9.711   2.688
  622    HG3  ARG  71           2HG      ARG  71  12.197  10.503   4.033
  623    HD2  ARG  71           1HD      ARG  71  14.257  10.623   5.281
  624    HD3  ARG  71           2HD      ARG  71  15.118   9.816   3.950
  625    HE   ARG  71           HE       ARG  71  15.089  11.989   2.765
  626   HH11  ARG  71          1HH1      ARG  71  13.051  12.138   5.590
  627   HH12  ARG  71          2HH1      ARG  71  12.972  13.882   5.448
  628   HH21  ARG  71          1HH2      ARG  71  15.001  13.986   2.583
  629   HH22  ARG  71          2HH2      ARG  71  14.084  14.938   3.734
  630    H    ASP  72           H        ASP  72  10.050   9.040   2.248
  631    HA   ASP  72           HA       ASP  72  10.081   7.070   0.163
  632    HB2  ASP  72           1HB      ASP  72   9.494  10.090   0.044
  633    HB3  ASP  72           2HB      ASP  72   9.443   8.879  -1.262
  634    H    GLU  73           H        GLU  73  12.165   9.857   0.820
  635    HA   GLU  73           HA       GLU  73  13.692   9.773  -1.585
  636    HB2  GLU  73           1HB      GLU  73  13.806  11.568   0.077
  637    HB3  GLU  73           2HB      GLU  73  14.570  10.445   1.228
  638    HG2  GLU  73           1HG      GLU  73  16.558  10.252  -0.345
  639    HG3  GLU  73           2HG      GLU  73  15.638  11.328  -1.421
  640    H    LEU  74           H        LEU  74  14.209   8.067   1.506
  641    HA   LEU  74           HA       LEU  74  16.569   6.685   0.570
  642    HB2  LEU  74           1HB      LEU  74  14.583   6.222   2.691
  643    HB3  LEU  74           2HB      LEU  74  16.013   5.169   2.615
  644    HG   LEU  74           HG       LEU  74  16.016   8.176   3.078
  645   HD11  LEU  74          1HD1      LEU  74  16.851   7.565   5.364
  646   HD12  LEU  74          2HD1      LEU  74  15.241   6.872   5.057
  647   HD13  LEU  74          3HD1      LEU  74  16.689   5.843   4.946
  648   HD21  LEU  74          3HD2      LEU  74  17.959   7.465   1.816
  649   HD22  LEU  74          1HD2      LEU  74  18.440   7.906   3.471
  650   HD23  LEU  74          2HD2      LEU  74  18.305   6.191   3.010
  651    H    ALA  75           H        ALA  75  13.124   5.934   0.526
  652    HA   ALA  75           HA       ALA  75  13.418   3.223  -0.364
  653    HB1  ALA  75           1HB      ALA  75  11.071   3.435  -1.082
  654    HB2  ALA  75           2HB      ALA  75  11.313   4.085   0.558
  655    HB3  ALA  75           3HB      ALA  75  11.153   5.193  -0.825
  656    H    ASP  76           H        ASP  76  13.252   6.317  -2.078
  657    HA   ASP  76           HA       ASP  76  13.257   5.130  -4.727
  658    HB2  ASP  76           1HB      ASP  76  13.984   7.964  -3.770
  659    HB3  ASP  76           2HB      ASP  76  14.034   7.287  -5.417
  660    H    LEU  77           H        LEU  77  15.769   6.176  -2.475
  661    HA   LEU  77           HA       LEU  77  17.954   5.837  -4.336
  662    HB2  LEU  77           1HB      LEU  77  17.654   5.801  -1.414
  663    HB3  LEU  77           2HB      LEU  77  19.293   5.664  -2.090
  664    HG   LEU  77           HG       LEU  77  17.396   8.013  -2.472
  665   HD11  LEU  77          1HD1      LEU  77  19.040   9.258  -1.042
  666   HD12  LEU  77          2HD1      LEU  77  18.324   7.887  -0.162
  667   HD13  LEU  77          3HD1      LEU  77  19.969   7.756  -0.829
  668   HD21  LEU  77          3HD2      LEU  77  18.830   7.668  -4.397
  669   HD22  LEU  77          1HD2      LEU  77  19.339   9.128  -3.515
  670   HD23  LEU  77          2HD2      LEU  77  20.271   7.618  -3.352
  671    H    GLU  78           H        GLU  78  16.314   3.671  -2.076
  672    HA   GLU  78           HA       GLU  78  18.101   1.429  -2.646
  673    HB2  GLU  78           1HB      GLU  78  15.357   1.640  -1.404
  674    HB3  GLU  78           2HB      GLU  78  16.242   0.109  -1.600
  675    HG2  GLU  78           1HG      GLU  78  18.064   0.996  -0.086
  676    HG3  GLU  78           2HG      GLU  78  17.140   2.515  -0.070
  677    H    HIS  79           H        HIS  79  15.043   2.630  -3.943
  678    HA   HIS  79           HA       HIS  79  14.444   0.388  -5.612
  679    HB2  HIS  79           1HB      HIS  79  12.805   2.186  -5.225
  680    HB3  HIS  79           2HB      HIS  79  13.868   3.353  -6.046
  681    HD1  HIS  79           1HD      HIS  79  11.948   0.153  -6.814
  682    HD2  HIS  79           2HD      HIS  79  13.292   3.625  -8.788
  683    HE1  HIS  79           1HE      HIS  79  11.106  -0.004  -9.103
  Start of MODEL   11
    1    H    LYS   3           H        LYS   3  10.711 -14.646  -4.843
    2    HA   LYS   3           HA       LYS   3   8.489 -16.198  -4.017
    3    HB2  LYS   3           1HB      LYS   3  10.631 -15.824  -1.920
    4    HB3  LYS   3           2HB      LYS   3   8.944 -16.283  -1.586
    5    HG2  LYS   3           1HG      LYS   3   9.252 -18.346  -2.908
    6    HG3  LYS   3           2HG      LYS   3  10.946 -17.890  -3.209
    7    HD2  LYS   3           1HD      LYS   3  11.402 -17.954  -0.795
    8    HD3  LYS   3           2HD      LYS   3   9.704 -18.389  -0.483
    9    HE2  LYS   3           1HE      LYS   3   9.995 -20.454  -1.786
   10    HE3  LYS   3           2HE      LYS   3  11.692 -20.019  -2.095
   11    HZ1  LYS   3           3HZ      LYS   3  10.510 -20.539   0.558
   12    HZ2  LYS   3           1HZ      LYS   3  11.487 -21.573  -0.276
   13    HZ3  LYS   3           2HZ      LYS   3  12.084 -20.136   0.272
   14    H    ALA   4           H        ALA   4  10.539 -13.426  -3.778
   15    HA   ALA   4           HA       ALA   4   8.824 -11.803  -2.151
   16    HB1  ALA   4           1HB      ALA   4  10.090  -9.909  -3.089
   17    HB2  ALA   4           2HB      ALA   4  11.170 -11.225  -2.572
   18    HB3  ALA   4           3HB      ALA   4  10.811 -10.994  -4.300
   19    H    LYS   5           H        LYS   5   8.888 -12.531  -5.598
   20    HA   LYS   5           HA       LYS   5   6.780 -10.559  -6.191
   21    HB2  LYS   5           1HB      LYS   5   8.083 -12.748  -7.815
   22    HB3  LYS   5           2HB      LYS   5   6.823 -11.651  -8.429
   23    HG2  LYS   5           1HG      LYS   5   8.309  -9.724  -8.009
   24    HG3  LYS   5           2HG      LYS   5   9.571 -10.834  -7.425
   25    HD2  LYS   5           1HD      LYS   5   9.652 -11.921  -9.624
   26    HD3  LYS   5           2HD      LYS   5   8.364 -10.842 -10.212
   27    HE2  LYS   5           1HE      LYS   5   9.820  -8.895  -9.803
   28    HE3  LYS   5           2HE      LYS   5  11.110  -9.985  -9.243
   29    HZ1  LYS   5           3HZ      LYS   5   9.946  -9.959 -11.953
   30    HZ2  LYS   5           1HZ      LYS   5  11.420  -9.346 -11.537
   31    HZ3  LYS   5           2HZ      LYS   5  11.142 -10.968 -11.435
   32    H    LEU   6           H        LEU   6   7.001 -13.903  -5.280
   33    HA   LEU   6           HA       LEU   6   4.288 -14.578  -6.124
   34    HB2  LEU   6           1HB      LEU   6   6.239 -15.715  -4.234
   35    HB3  LEU   6           2HB      LEU   6   4.721 -16.591  -4.545
   36    HG   LEU   6           HG       LEU   6   6.911 -15.983  -6.569
   37   HD11  LEU   6          1HD1      LEU   6   7.202 -18.474  -6.602
   38   HD12  LEU   6          2HD1      LEU   6   7.491 -17.812  -4.977
   39   HD13  LEU   6          3HD1      LEU   6   5.950 -18.623  -5.348
   40   HD21  LEU   6          3HD2      LEU   6   4.718 -15.891  -7.598
   41   HD22  LEU   6          1HD2      LEU   6   5.579 -17.356  -8.131
   42   HD23  LEU   6          2HD2      LEU   6   4.293 -17.475  -6.904
   43    H    SER   7           H        SER   7   5.809 -13.474  -3.120
   44    HA   SER   7           HA       SER   7   3.360 -13.480  -1.513
   45    HB2  SER   7           1HB      SER   7   5.301 -13.611  -0.376
   46    HB3  SER   7           2HB      SER   7   6.001 -12.205  -1.208
   47    HG   SER   7           HG       SER   7   3.724 -12.156   0.483
   48    H    LEU   8           H        LEU   8   1.696 -12.122  -1.681
   49    HA   LEU   8           HA       LEU   8   1.694  -9.770  -3.356
   50    HB2  LEU   8           1HB      LEU   8   0.025 -10.748  -1.139
   51    HB3  LEU   8           2HB      LEU   8  -0.497  -9.298  -2.030
   52    HG   LEU   8           HG       LEU   8  -0.170 -12.106  -3.161
   53   HD11  LEU   8          1HD1      LEU   8  -2.655 -11.975  -3.481
   54   HD12  LEU   8          2HD1      LEU   8  -2.214 -11.810  -1.764
   55   HD13  LEU   8          3HD1      LEU   8  -2.654 -10.370  -2.714
   56   HD21  LEU   8          3HD2      LEU   8   0.461 -10.427  -4.794
   57   HD22  LEU   8          1HD2      LEU   8  -1.094 -11.162  -5.249
   58   HD23  LEU   8          2HD2      LEU   8  -1.056  -9.542  -4.514
   59    H    THR   9           H        THR   9   2.279 -10.300   0.085
   60    HA   THR   9           HA       THR   9   2.350  -7.534   0.847
   61    HB   THR   9           HB       THR   9   3.890  -9.900   2.000
   62    HG1  THR   9           1HG      THR   9   2.128  -9.860   3.519
   63   HG21  THR   9          3HG2      THR   9   3.233  -7.170   3.175
   64   HG22  THR   9          1HG2      THR   9   4.037  -8.504   4.032
   65   HG23  THR   9          2HG2      THR   9   4.843  -7.716   2.654
   66    H    GLN  10           H        GLN  10   4.928  -9.733  -0.263
   67    HA   GLN  10           HA       GLN  10   6.945  -7.624  -0.094
   68    HB2  GLN  10           1HB      GLN  10   6.938 -10.344  -1.421
   69    HB3  GLN  10           2HB      GLN  10   8.354  -9.274  -1.295
   70    HG2  GLN  10           1HG      GLN  10   7.033 -10.731   1.155
   71    HG3  GLN  10           2HG      GLN  10   8.507 -10.887   0.171
   72   HE21  GLN  10          2HE2      GLN  10   7.243  -9.682   3.003
   73   HE22  GLN  10          1HE2      GLN  10   8.434  -8.474   3.356
   74    H    LEU  11           H        LEU  11   4.847  -8.936  -2.588
   75    HA   LEU  11           HA       LEU  11   6.231  -7.761  -4.824
   76    HB2  LEU  11           1HB      LEU  11   4.753  -9.521  -5.010
   77    HB3  LEU  11           2HB      LEU  11   3.309  -8.629  -4.478
   78    HG   LEU  11           HG       LEU  11   3.562  -7.130  -6.457
   79   HD11  LEU  11          1HD1      LEU  11   5.073  -7.878  -8.315
   80   HD12  LEU  11          2HD1      LEU  11   5.997  -7.496  -6.842
   81   HD13  LEU  11          3HD1      LEU  11   5.673  -9.192  -7.276
   82   HD21  LEU  11          3HD2      LEU  11   2.008  -8.990  -6.525
   83   HD22  LEU  11          1HD2      LEU  11   2.744  -8.756  -8.128
   84   HD23  LEU  11          2HD2      LEU  11   3.297 -10.086  -7.079
   85    H    ILE  12           H        ILE  12   3.578  -6.599  -2.764
   86    HA   ILE  12           HA       ILE  12   3.245  -4.054  -4.060
   87    HB   ILE  12           HB       ILE  12   2.877  -4.935  -1.164
   88   HG12  ILE  12          1HG1      ILE  12   0.826  -4.243  -3.248
   89   HG13  ILE  12          2HG1      ILE  12   1.427  -5.890  -2.948
   90   HG21  ILE  12          1HG2      ILE  12   1.664  -2.806  -0.840
   91   HG22  ILE  12          2HG2      ILE  12   3.369  -2.514  -1.254
   92   HG23  ILE  12          3HG2      ILE  12   2.105  -2.302  -2.489
   93   HD11  ILE  12          3HD1      ILE  12   0.011  -4.118  -0.925
   94   HD12  ILE  12          1HD1      ILE  12  -0.710  -5.497  -1.787
   95   HD13  ILE  12          2HD1      ILE  12   0.611  -5.766  -0.626
   96    H    LEU  13           H        LEU  13   5.527  -5.119  -1.576
   97    HA   LEU  13           HA       LEU  13   6.661  -2.494  -1.177
   98    HB2  LEU  13           1HB      LEU  13   7.602  -5.256  -0.809
   99    HB3  LEU  13           2HB      LEU  13   8.635  -3.925  -0.239
  100    HG   LEU  13           HG       LEU  13   5.846  -4.625   0.758
  101   HD11  LEU  13          1HD1      LEU  13   7.036  -5.109   2.913
  102   HD12  LEU  13          2HD1      LEU  13   7.640  -6.141   1.596
  103   HD13  LEU  13          3HD1      LEU  13   8.585  -4.729   2.125
  104   HD21  LEU  13          3HD2      LEU  13   6.174  -2.224   0.730
  105   HD22  LEU  13          1HD2      LEU  13   6.185  -2.818   2.408
  106   HD23  LEU  13          2HD2      LEU  13   7.715  -2.395   1.603
  107    H    ILE  14           H        ILE  14   7.339  -5.114  -3.435
  108    HA   ILE  14           HA       ILE  14   9.748  -3.984  -4.553
  109    HB   ILE  14           HB       ILE  14   7.599  -5.800  -5.730
  110   HG12  ILE  14          1HG1      ILE  14  10.420  -6.421  -4.910
  111   HG13  ILE  14          2HG1      ILE  14   9.002  -6.623  -3.854
  112   HG21  ILE  14          1HG2      ILE  14   9.194  -6.219  -7.569
  113   HG22  ILE  14          2HG2      ILE  14   8.701  -4.511  -7.526
  114   HG23  ILE  14          3HG2      ILE  14  10.294  -4.993  -6.896
  115   HD11  ILE  14          3HD1      ILE  14   9.454  -8.020  -6.515
  116   HD12  ILE  14          1HD1      ILE  14   9.640  -8.757  -4.908
  117   HD13  ILE  14          2HD1      ILE  14   8.035  -8.223  -5.459
  118    H    ARG  15           H        ARG  15   6.331  -3.553  -5.414
  119    HA   ARG  15           HA       ARG  15   6.920  -1.758  -7.610
  120    HB2  ARG  15           1HB      ARG  15   4.404  -2.124  -6.046
  121    HB3  ARG  15           2HB      ARG  15   4.595  -1.148  -7.520
  122    HG2  ARG  15           1HG      ARG  15   5.121  -4.130  -7.357
  123    HG3  ARG  15           2HG      ARG  15   3.584  -3.410  -7.899
  124    HD2  ARG  15           1HD      ARG  15   4.809  -2.277  -9.697
  125    HD3  ARG  15           2HD      ARG  15   6.279  -3.141  -9.189
  126    HE   ARG  15           HE       ARG  15   4.190  -5.067  -9.898
  127   HH11  ARG  15          1HH1      ARG  15   6.440  -2.840 -11.358
  128   HH12  ARG  15          2HH1      ARG  15   6.505  -3.837 -12.797
  129   HH21  ARG  15          1HH2      ARG  15   4.246  -6.217 -11.543
  130   HH22  ARG  15          2HH2      ARG  15   5.254  -5.764 -12.905
  131    H    LEU  16           H        LEU  16   6.259  -1.294  -4.166
  132    HA   LEU  16           HA       LEU  16   6.214   1.624  -4.427
  133    HB2  LEU  16           1HB      LEU  16   6.390  -0.287  -2.196
  134    HB3  LEU  16           2HB      LEU  16   6.279   1.451  -1.836
  135    HG   LEU  16           HG       LEU  16   4.185  -0.279  -3.208
  136   HD11  LEU  16          1HD1      LEU  16   2.794   0.318  -1.207
  137   HD12  LEU  16          2HD1      LEU  16   4.282  -0.532  -0.730
  138   HD13  LEU  16          3HD1      LEU  16   4.167   1.234  -0.545
  139   HD21  LEU  16          3HD2      LEU  16   4.260   1.922  -4.227
  140   HD22  LEU  16          1HD2      LEU  16   2.782   1.755  -3.247
  141   HD23  LEU  16          2HD2      LEU  16   4.160   2.697  -2.627
  142    H    SER  17           H        SER  17   8.620  -0.824  -3.954
  143    HA   SER  17           HA       SER  17  10.766   0.851  -2.905
  144    HB2  SER  17           1HB      SER  17  10.829  -1.462  -2.683
  145    HB3  SER  17           2HB      SER  17  10.843  -1.672  -4.449
  146    HG   SER  17           HG       SER  17  12.939  -1.736  -3.529
  147    H    ASN  18           H        ASN  18   9.829  -0.234  -6.200
  148    HA   ASN  18           HA       ASN  18  12.004   1.284  -7.440
  149    HB2  ASN  18           1HB      ASN  18   9.689  -0.230  -8.869
  150    HB3  ASN  18           2HB      ASN  18  11.054   0.794  -9.375
  151   HD21  ASN  18          2HD2      ASN  18  10.374  -2.076  -9.817
  152   HD22  ASN  18          1HD2      ASN  18  11.785  -2.949  -9.323
  153    H    ARG  19           H        ARG  19   8.541   1.749  -6.928
  154    HA   ARG  19           HA       ARG  19   8.643   4.180  -8.662
  155    HB2  ARG  19           1HB      ARG  19   6.312   2.613  -7.654
  156    HB3  ARG  19           2HB      ARG  19   6.228   4.125  -8.587
  157    HG2  ARG  19           1HG      ARG  19   7.297   3.056 -10.488
  158    HG3  ARG  19           2HG      ARG  19   7.516   1.556  -9.555
  159    HD2  ARG  19           1HD      ARG  19   5.102   1.310  -9.424
  160    HD3  ARG  19           2HD      ARG  19   4.912   2.780 -10.406
  161    HE   ARG  19           HE       ARG  19   5.640   0.121 -11.518
  162   HH11  ARG  19          1HH1      ARG  19   5.561   3.560 -12.084
  163   HH12  ARG  19          2HH1      ARG  19   5.675   3.284 -13.810
  164   HH21  ARG  19          1HH2      ARG  19   5.763  -0.213 -13.493
  165   HH22  ARG  19          2HH2      ARG  19   5.791   1.134 -14.616
  166    H    GLY  20           H        GLY  20   8.449   3.170  -5.375
  167    HA2  GLY  20           1HA      GLY  20   8.965   4.641  -3.593
  168    HA3  GLY  20           2HA      GLY  20   8.523   6.028  -4.618
  169    H    CYS  21           H        CYS  21   6.050   5.698  -5.405
  170    HA   CYS  21           HA       CYS  21   4.289   4.885  -3.110
  171    HB2  CYS  21           1HB      CYS  21   5.189   7.145  -2.629
  172    HB3  CYS  21           2HB      CYS  21   4.626   7.705  -4.222
  173    HG   CYS  21           HG       CYS  21   3.209   8.715  -2.374
  174    H    GLN  22           H        GLN  22   2.361   4.196  -3.833
  175    HA   GLN  22           HA       GLN  22   1.407   4.993  -6.527
  176    HB2  GLN  22           1HB      GLN  22   1.960   2.144  -5.669
  177    HB3  GLN  22           2HB      GLN  22   1.014   2.612  -7.103
  178    HG2  GLN  22           1HG      GLN  22   4.085   3.258  -6.855
  179    HG3  GLN  22           2HG      GLN  22   3.146   1.891  -7.502
  180   HE21  GLN  22          2HE2      GLN  22   4.031   5.268  -7.879
  181   HE22  GLN  22          1HE2      GLN  22   3.419   5.459  -9.489
  182    H    THR  23           H        THR  23  -0.762   4.465  -6.967
  183    HA   THR  23           HA       THR  23  -2.418   4.706  -4.567
  184    HB   THR  23           HB       THR  23  -4.305   4.815  -6.136
  185    HG1  THR  23           1HG      THR  23  -2.432   4.433  -8.248
  186   HG21  THR  23          3HG2      THR  23  -1.900   6.394  -7.130
  187   HG22  THR  23          1HG2      THR  23  -3.605   6.789  -7.444
  188   HG23  THR  23          2HG2      THR  23  -2.965   6.861  -5.784
  189    H    LEU  24           H        LEU  24  -4.291   3.394  -4.137
  190    HA   LEU  24           HA       LEU  24  -3.640   0.631  -3.840
  191    HB2  LEU  24           1HB      LEU  24  -5.113   1.781  -2.486
  192    HB3  LEU  24           2HB      LEU  24  -6.349   2.064  -3.733
  193    HG   LEU  24           HG       LEU  24  -6.613  -0.425  -3.935
  194   HD11  LEU  24          1HD1      LEU  24  -5.742  -1.828  -2.046
  195   HD12  LEU  24          2HD1      LEU  24  -4.413  -1.066  -2.951
  196   HD13  LEU  24          3HD1      LEU  24  -4.920  -0.396  -1.382
  197   HD21  LEU  24          3HD2      LEU  24  -8.195   0.898  -2.661
  198   HD22  LEU  24          1HD2      LEU  24  -7.948  -0.678  -1.872
  199   HD23  LEU  24          2HD2      LEU  24  -7.172   0.781  -1.210
  200    H    GLU  25           H        GLU  25  -5.514   2.328  -6.319
  201    HA   GLU  25           HA       GLU  25  -6.423  -0.058  -7.661
  202    HB2  GLU  25           1HB      GLU  25  -5.998   2.783  -8.587
  203    HB3  GLU  25           2HB      GLU  25  -6.696   1.502  -9.606
  204    HG2  GLU  25           1HG      GLU  25  -8.615   1.285  -7.966
  205    HG3  GLU  25           2HG      GLU  25  -7.756   2.504  -6.997
  206    H    GLU  26           H        GLU  26  -3.587   2.037  -8.141
  207    HA   GLU  26           HA       GLU  26  -2.521   0.580 -10.374
  208    HB2  GLU  26           1HB      GLU  26  -1.319   2.338  -8.248
  209    HB3  GLU  26           2HB      GLU  26  -0.321   1.537  -9.486
  210    HG2  GLU  26           1HG      GLU  26  -1.521   2.797 -11.286
  211    HG3  GLU  26           2HG      GLU  26  -2.625   3.365 -10.012
  212    H    LEU  27           H        LEU  27  -2.002   0.245  -6.868
  213    HA   LEU  27           HA       LEU  27  -0.054  -1.861  -7.114
  214    HB2  LEU  27           1HB      LEU  27  -1.951  -0.996  -5.042
  215    HB3  LEU  27           2HB      LEU  27  -0.804  -2.298  -4.643
  216    HG   LEU  27           HG       LEU  27  -0.080   0.549  -5.440
  217   HD11  LEU  27          1HD1      LEU  27   0.719   0.744  -3.069
  218   HD12  LEU  27          2HD1      LEU  27  -1.023   0.390  -3.137
  219   HD13  LEU  27          3HD1      LEU  27   0.134  -0.907  -2.754
  220   HD21  LEU  27          3HD2      LEU  27   1.565  -1.055  -6.212
  221   HD22  LEU  27          1HD2      LEU  27   2.231  -0.105  -4.863
  222   HD23  LEU  27          2HD2      LEU  27   1.672  -1.774  -4.588
  223    H    GLU  28           H        GLU  28  -3.579  -1.855  -6.892
  224    HA   GLU  28           HA       GLU  28  -3.892  -4.705  -6.664
  225    HB2  GLU  28           1HB      GLU  28  -5.677  -3.090  -6.224
  226    HB3  GLU  28           2HB      GLU  28  -5.683  -2.635  -7.946
  227    HG2  GLU  28           1HG      GLU  28  -6.382  -5.049  -8.492
  228    HG3  GLU  28           2HG      GLU  28  -6.373  -5.273  -6.728
  229    H    GLU  29           H        GLU  29  -3.669  -2.553  -9.485
  230    HA   GLU  29           HA       GLU  29  -3.989  -4.710 -11.405
  231    HB2  GLU  29           1HB      GLU  29  -2.863  -1.916 -11.599
  232    HB3  GLU  29           2HB      GLU  29  -3.009  -3.027 -12.983
  233    HG2  GLU  29           1HG      GLU  29  -5.515  -3.033 -12.694
  234    HG3  GLU  29           2HG      GLU  29  -5.233  -2.052 -11.238
  235    H    PHE  30           H        PHE  30  -1.269  -3.316  -9.686
  236    HA   PHE  30           HA       PHE  30   0.772  -4.583 -11.319
  237    HB2  PHE  30           1HB      PHE  30   0.796  -3.449  -8.492
  238    HB3  PHE  30           2HB      PHE  30   2.236  -4.089  -9.317
  239    HD1  PHE  30           1HD      PHE  30   0.851  -2.882 -12.031
  240    HD2  PHE  30           2HD      PHE  30   2.210  -1.397  -8.262
  241    HE1  PHE  30           1HE      PHE  30   1.255  -0.666 -13.051
  242    HE2  PHE  30           2HE      PHE  30   2.613   0.820  -9.279
  243    HZ   PHE  30           HZ       PHE  30   2.136   1.184 -11.675
  244    H    THR  31           H        THR  31  -1.077  -5.552  -8.474
  245    HA   THR  31           HA       THR  31   0.589  -8.011  -8.229
  246    HB   THR  31           HB       THR  31  -0.630  -8.378  -6.120
  247    HG1  THR  31           1HG      THR  31  -1.978  -5.946  -6.797
  248   HG21  THR  31          3HG2      THR  31   0.379  -5.519  -6.402
  249   HG22  THR  31          1HG2      THR  31   0.197  -6.412  -4.872
  250   HG23  THR  31          2HG2      THR  31   1.387  -6.950  -6.082
  251    H    GLN  32           H        GLN  32  -2.398  -6.939  -9.519
  252    HA   GLN  32           HA       GLN  32  -4.276  -8.079 -10.292
  253    HB2  GLN  32           1HB      GLN  32  -2.091 -10.105 -10.805
  254    HB3  GLN  32           2HB      GLN  32  -3.752 -10.243 -11.426
  255    HG2  GLN  32           1HG      GLN  32  -1.815  -7.930 -12.323
  256    HG3  GLN  32           2HG      GLN  32  -2.208  -9.551 -12.942
  257   HE21  GLN  32          2HE2      GLN  32  -3.000  -6.272 -12.998
  258   HE22  GLN  32          1HE2      GLN  32  -4.551  -6.387 -13.759
  259    H    ALA  33           H        ALA  33  -4.560  -8.094  -7.755
  260    HA   ALA  33           HA       ALA  33  -5.411 -10.858  -7.103
  261    HB1  ALA  33           1HB      ALA  33  -4.414 -10.713  -4.853
  262    HB2  ALA  33           2HB      ALA  33  -3.170 -10.658  -6.123
  263    HB3  ALA  33           3HB      ALA  33  -3.657  -9.164  -5.291
  264    H    LYS  34           H        LYS  34  -6.707 -10.902  -5.046
  265    HA   LYS  34           HA       LYS  34  -8.917  -9.104  -5.339
  266    HB2  LYS  34           1HB      LYS  34  -9.005 -11.396  -4.387
  267    HB3  LYS  34           2HB      LYS  34  -8.161 -10.783  -2.944
  268    HG2  LYS  34           1HG      LYS  34 -10.024  -9.311  -2.425
  269    HG3  LYS  34           2HG      LYS  34 -10.856  -9.786  -3.926
  270    HD2  LYS  34           1HD      LYS  34 -10.938 -12.130  -3.094
  271    HD3  LYS  34           2HD      LYS  34 -10.202 -11.586  -1.568
  272    HE2  LYS  34           1HE      LYS  34 -12.105 -10.087  -1.175
  273    HE3  LYS  34           2HE      LYS  34 -12.840 -10.610  -2.709
  274    HZ1  LYS  34           3HZ      LYS  34 -12.304 -12.348  -0.387
  275    HZ2  LYS  34           1HZ      LYS  34 -13.783 -11.771  -0.831
  276    HZ3  LYS  34           2HZ      LYS  34 -12.984 -12.832  -1.809
  277    H    ARG  35           H        ARG  35  -9.398  -7.199  -4.572
  278    HA   ARG  35           HA       ARG  35  -7.397  -5.530  -3.439
  279    HB2  ARG  35           1HB      ARG  35  -9.309  -4.736  -4.693
  280    HB3  ARG  35           2HB      ARG  35 -10.352  -5.133  -3.308
  281    HG2  ARG  35           1HG      ARG  35  -9.225  -3.506  -1.922
  282    HG3  ARG  35           2HG      ARG  35  -8.029  -3.187  -3.202
  283    HD2  ARG  35           1HD      ARG  35 -10.968  -2.583  -3.316
  284    HD3  ARG  35           2HD      ARG  35  -9.655  -1.420  -3.025
  285    HE   ARG  35           HE       ARG  35  -9.099  -2.449  -5.603
  286   HH11  ARG  35          1HH1      ARG  35 -11.922  -0.996  -4.159
  287   HH12  ARG  35          2HH1      ARG  35 -12.383  -0.333  -5.715
  288   HH21  ARG  35          1HH2      ARG  35  -9.618  -1.703  -7.393
  289   HH22  ARG  35          2HH2      ARG  35 -11.071  -0.737  -7.559
  290    H    GLU  36           H        GLU  36 -10.082  -7.255  -1.862
  291    HA   GLU  36           HA       GLU  36  -9.678  -6.249   0.762
  292    HB2  GLU  36           1HB      GLU  36 -11.611  -7.578   0.058
  293    HB3  GLU  36           2HB      GLU  36 -10.559  -9.006  -0.111
  294    HG2  GLU  36           1HG      GLU  36 -10.124  -8.945   2.383
  295    HG3  GLU  36           2HG      GLU  36 -11.108  -7.464   2.391
  296    H    VAL  37           H        VAL  37  -8.250  -9.133  -0.781
  297    HA   VAL  37           HA       VAL  37  -6.609  -9.876   1.478
  298    HB   VAL  37           HB       VAL  37  -6.256 -10.360  -1.509
  299   HG11  VAL  37          1HG1      VAL  37  -4.647 -12.109  -0.827
  300   HG12  VAL  37          2HG1      VAL  37  -4.097 -10.497  -0.311
  301   HG13  VAL  37          3HG1      VAL  37  -4.824 -11.610   0.872
  302   HG21  VAL  37          3HG2      VAL  37  -8.266 -11.366  -0.604
  303   HG22  VAL  37          1HG2      VAL  37  -7.056 -12.610  -0.997
  304   HG23  VAL  37          2HG2      VAL  37  -7.320 -12.130   0.697
  305    H    LEU  38           H        LEU  38  -6.019  -7.706  -1.255
  306    HA   LEU  38           HA       LEU  38  -3.258  -7.221  -0.583
  307    HB2  LEU  38           1HB      LEU  38  -5.342  -5.693  -1.993
  308    HB3  LEU  38           2HB      LEU  38  -3.665  -5.099  -2.023
  309    HG   LEU  38           HG       LEU  38  -4.619  -7.766  -3.137
  310   HD11  LEU  38          1HD1      LEU  38  -4.153  -6.733  -5.376
  311   HD12  LEU  38          2HD1      LEU  38  -5.411  -5.832  -4.499
  312   HD13  LEU  38          3HD1      LEU  38  -3.747  -5.201  -4.568
  313   HD21  LEU  38          3HD2      LEU  38  -2.336  -7.853  -2.330
  314   HD22  LEU  38          1HD2      LEU  38  -2.352  -7.910  -4.108
  315   HD23  LEU  38          2HD2      LEU  38  -1.916  -6.402  -3.270
  316    H    LEU  39           H        LEU  39  -6.288  -5.736   0.442
  317    HA   LEU  39           HA       LEU  39  -5.044  -3.552   1.873
  318    HB2  LEU  39           1HB      LEU  39  -7.605  -4.984   2.028
  319    HB3  LEU  39           2HB      LEU  39  -7.363  -3.582   3.096
  320    HG   LEU  39           HG       LEU  39  -7.323  -3.535   0.052
  321   HD11  LEU  39          1HD1      LEU  39  -9.459  -2.239   0.285
  322   HD12  LEU  39          2HD1      LEU  39  -9.612  -3.870   0.981
  323   HD13  LEU  39          3HD1      LEU  39  -9.385  -2.464   2.049
  324   HD21  LEU  39          3HD2      LEU  39  -5.829  -1.886   1.017
  325   HD22  LEU  39          1HD2      LEU  39  -7.249  -1.078   0.312
  326   HD23  LEU  39          2HD2      LEU  39  -7.128  -1.286   2.076
  327    H    VAL  40           H        VAL  40  -5.836  -6.879   2.705
  328    HA   VAL  40           HA       VAL  40  -5.203  -6.668   5.531
  329    HB   VAL  40           HB       VAL  40  -5.084  -9.011   3.588
  330   HG11  VAL  40          1HG1      VAL  40  -4.943 -10.427   5.610
  331   HG12  VAL  40          2HG1      VAL  40  -3.533  -9.348   5.483
  332   HG13  VAL  40          3HG1      VAL  40  -4.846  -8.967   6.625
  333   HG21  VAL  40          3HG2      VAL  40  -7.321  -8.143   3.929
  334   HG22  VAL  40          1HG2      VAL  40  -7.131  -9.729   4.711
  335   HG23  VAL  40          2HG2      VAL  40  -7.112  -8.246   5.694
  336    H    THR  41           H        THR  41  -3.224  -7.419   2.682
  337    HA   THR  41           HA       THR  41  -0.823  -7.819   4.282
  338    HB   THR  41           HB       THR  41   0.364  -7.778   2.121
  339    HG1  THR  41           1HG      THR  41  -0.913  -7.416   0.210
  340   HG21  THR  41          3HG2      THR  41  -2.262  -9.312   1.986
  341   HG22  THR  41          1HG2      THR  41  -0.802  -9.664   1.032
  342   HG23  THR  41          2HG2      THR  41  -0.780  -9.861   2.801
  343    H    LEU  42           H        LEU  42  -2.335  -5.076   2.691
  344    HA   LEU  42           HA       LEU  42  -0.095  -3.277   3.084
  345    HB2  LEU  42           1HB      LEU  42  -2.996  -3.006   2.713
  346    HB3  LEU  42           2HB      LEU  42  -2.035  -1.515   2.848
  347    HG   LEU  42           HG       LEU  42  -1.617  -3.652   0.726
  348   HD11  LEU  42          1HD1      LEU  42  -2.681  -2.013  -0.848
  349   HD12  LEU  42          2HD1      LEU  42  -3.816  -2.513   0.427
  350   HD13  LEU  42          3HD1      LEU  42  -3.007  -0.930   0.524
  351   HD21  LEU  42          3HD2      LEU  42   0.376  -2.371   1.239
  352   HD22  LEU  42          1HD2      LEU  42  -0.233  -1.926  -0.372
  353   HD23  LEU  42          2HD2      LEU  42  -0.511  -0.845   1.015
  354    H    THR  43           H        THR  43  -2.936  -4.141   5.018
  355    HA   THR  43           HA       THR  43  -2.379  -2.315   7.178
  356    HB   THR  43           HB       THR  43  -3.789  -5.017   7.201
  357    HG1  THR  43           1HG      THR  43  -5.662  -3.638   7.163
  358   HG21  THR  43          3HG2      THR  43  -3.790  -2.749   9.232
  359   HG22  THR  43          1HG2      THR  43  -4.785  -4.221   9.316
  360   HG23  THR  43          2HG2      THR  43  -3.014  -4.336   9.447
  361    H    ARG  44           H        ARG  44  -1.318  -5.630   6.493
  362    HA   ARG  44           HA       ARG  44   0.113  -6.004   8.956
  363    HB2  ARG  44           1HB      ARG  44   0.417  -7.249   6.268
  364    HB3  ARG  44           2HB      ARG  44   1.426  -7.662   7.675
  365    HG2  ARG  44           1HG      ARG  44  -0.516  -8.418   8.906
  366    HG3  ARG  44           2HG      ARG  44  -1.598  -7.879   7.600
  367    HD2  ARG  44           1HD      ARG  44  -0.639  -9.533   6.122
  368    HD3  ARG  44           2HD      ARG  44   0.447 -10.070   7.426
  369    HE   ARG  44           HE       ARG  44  -2.248 -10.472   8.366
  370   HH11  ARG  44          1HH1      ARG  44  -0.228 -11.672   5.790
  371   HH12  ARG  44          2HH1      ARG  44  -1.073 -13.207   5.833
  372   HH21  ARG  44          1HH2      ARG  44  -3.232 -12.220   8.422
  373   HH22  ARG  44          2HH2      ARG  44  -2.788 -13.520   7.333
  374    H    LEU  45           H        LEU  45   0.992  -4.478   5.896
  375    HA   LEU  45           HA       LEU  45   3.763  -4.041   6.630
  376    HB2  LEU  45           1HB      LEU  45   1.853  -2.809   4.768
  377    HB3  LEU  45           2HB      LEU  45   3.531  -2.221   4.761
  378    HG   LEU  45           HG       LEU  45   2.613  -5.050   4.115
  379   HD11  LEU  45          1HD1      LEU  45   3.400  -4.501   1.796
  380   HD12  LEU  45          2HD1      LEU  45   2.095  -3.407   2.312
  381   HD13  LEU  45          3HD1      LEU  45   3.785  -2.850   2.334
  382   HD21  LEU  45          3HD2      LEU  45   4.777  -5.038   5.211
  383   HD22  LEU  45          1HD2      LEU  45   4.969  -5.449   3.489
  384   HD23  LEU  45          2HD2      LEU  45   5.382  -3.815   4.066
  385    H    HIS  46           H        HIS  46   0.773  -2.205   7.064
  386    HA   HIS  46           HA       HIS  46   1.989   0.121   8.229
  387    HB2  HIS  46           1HB      HIS  46  -0.760  -1.144   8.591
  388    HB3  HIS  46           2HB      HIS  46  -0.283   0.407   9.322
  389    HD1  HIS  46           1HD      HIS  46   1.221   1.621   6.894
  390    HD2  HIS  46           2HD      HIS  46  -2.539  -0.257   6.584
  391    HE1  HIS  46           1HE      HIS  46   0.143   2.592   4.927
  392    H    GLN  47           H        GLN  47   0.958  -2.974   9.614
  393    HA   GLN  47           HA       GLN  47   1.326  -2.213  12.355
  394    HB2  GLN  47           1HB      GLN  47   1.437  -4.874  10.928
  395    HB3  GLN  47           2HB      GLN  47   1.589  -4.700  12.692
  396    HG2  GLN  47           1HG      GLN  47  -0.909  -3.692  12.662
  397    HG3  GLN  47           2HG      GLN  47  -0.554  -3.888  10.929
  398   HE21  GLN  47          2HE2      GLN  47  -2.814  -4.981  12.236
  399   HE22  GLN  47          1HE2      GLN  47  -2.685  -6.707  12.189
  400    H    ARG  48           H        ARG  48   3.551  -3.445   9.914
  401    HA   ARG  48           HA       ARG  48   5.749  -3.633  11.878
  402    HB2  ARG  48           1HB      ARG  48   5.686  -4.031   8.922
  403    HB3  ARG  48           2HB      ARG  48   7.135  -4.155   9.948
  404    HG2  ARG  48           1HG      ARG  48   4.650  -5.830  10.377
  405    HG3  ARG  48           2HG      ARG  48   6.001  -6.345   9.340
  406    HD2  ARG  48           1HD      ARG  48   7.493  -6.163  11.273
  407    HD3  ARG  48           2HD      ARG  48   6.081  -5.777  12.285
  408    HE   ARG  48           HE       ARG  48   5.563  -8.357  11.136
  409   HH11  ARG  48          1HH1      ARG  48   7.980  -6.961  13.227
  410   HH12  ARG  48          2HH1      ARG  48   8.193  -8.508  14.023
  411   HH21  ARG  48          1HH2      ARG  48   5.803 -10.137  12.033
  412   HH22  ARG  48          2HH2      ARG  48   6.954 -10.321  13.342
  413    H    GLY  49           H        GLY  49   4.270  -1.181  10.103
  414    HA2  GLY  49           1HA      GLY  49   4.801   1.083  10.078
  415    HA3  GLY  49           2HA      GLY  49   6.269   0.719  11.014
  416    H    VAL  50           H        VAL  50   5.234  -0.574   7.856
  417    HA   VAL  50           HA       VAL  50   7.897   0.243   6.737
  418    HB   VAL  50           HB       VAL  50   5.805  -1.713   5.695
  419   HG11  VAL  50          1HG1      VAL  50   7.577  -2.362   4.097
  420   HG12  VAL  50          2HG1      VAL  50   7.136  -0.648   3.904
  421   HG13  VAL  50          3HG1      VAL  50   8.636  -1.093   4.755
  422   HG21  VAL  50          3HG2      VAL  50   6.848  -2.536   7.721
  423   HG22  VAL  50          1HG2      VAL  50   7.410  -3.453   6.303
  424   HG23  VAL  50          2HG2      VAL  50   8.464  -2.221   7.040
  425    H    ILE  51           H        ILE  51   4.425   0.406   6.002
  426    HA   ILE  51           HA       ILE  51   5.072   2.707   4.177
  427    HB   ILE  51           HB       ILE  51   3.218   2.009   2.726
  428   HG12  ILE  51          1HG1      ILE  51   2.978  -0.421   4.477
  429   HG13  ILE  51          2HG1      ILE  51   1.900   0.993   4.533
  430   HG21  ILE  51          1HG2      ILE  51   4.184  -0.057   1.774
  431   HG22  ILE  51          2HG2      ILE  51   5.461   1.103   2.214
  432   HG23  ILE  51          3HG2      ILE  51   5.133  -0.298   3.261
  433   HD11  ILE  51          3HD1      ILE  51   2.312  -0.836   2.141
  434   HD12  ILE  51          1HD1      ILE  51   0.900  -0.837   3.221
  435   HD13  ILE  51          2HD1      ILE  51   1.235   0.580   2.197
  436    H    TYR  52           H        TYR  52   3.278   4.147   3.758
  437    HA   TYR  52           HA       TYR  52   1.217   4.163   5.915
  438    HB2  TYR  52           1HB      TYR  52   1.630   6.320   6.597
  439    HB3  TYR  52           2HB      TYR  52   3.264   5.632   6.442
  440    HD1  TYR  52           1HD      TYR  52   0.819   7.968   4.952
  441    HD2  TYR  52           2HD      TYR  52   4.795   6.439   4.752
  442    HE1  TYR  52           1HE      TYR  52   1.438   9.806   3.412
  443    HE2  TYR  52           2HE      TYR  52   5.430   8.267   3.213
  444    HH   TYR  52           HH       TYR  52   4.739  10.125   2.094
  445    H    ARG  53           H        ARG  53  -0.616   5.470   5.482
  446    HA   ARG  53           HA       ARG  53  -1.106   5.586   2.524
  447    HB2  ARG  53           1HB      ARG  53  -2.343   3.851   3.541
  448    HB3  ARG  53           2HB      ARG  53  -3.002   4.979   4.747
  449    HG2  ARG  53           1HG      ARG  53  -4.117   6.231   2.917
  450    HG3  ARG  53           2HG      ARG  53  -3.518   5.020   1.758
  451    HD2  ARG  53           1HD      ARG  53  -5.873   4.753   2.428
  452    HD3  ARG  53           2HD      ARG  53  -4.844   3.331   2.725
  453    HE   ARG  53           HE       ARG  53  -5.897   5.060   4.976
  454   HH11  ARG  53          1HH1      ARG  53  -4.681   2.013   3.794
  455   HH12  ARG  53          2HH1      ARG  53  -4.951   1.289   5.367
  456   HH21  ARG  53          1HH2      ARG  53  -6.218   4.244   6.780
  457   HH22  ARG  53          2HH2      ARG  53  -5.827   2.560   7.070
  458    H    LYS  54           H        LYS  54  -2.061   7.293   1.588
  459    HA   LYS  54           HA       LYS  54  -3.212   9.408   3.330
  460    HB2  LYS  54           1HB      LYS  54  -2.053  11.170   2.180
  461    HB3  LYS  54           2HB      LYS  54  -0.892  10.075   2.968
  462    HG2  LYS  54           1HG      LYS  54  -0.450   8.996   0.788
  463    HG3  LYS  54           2HG      LYS  54  -1.584  10.126   0.011
  464    HD2  LYS  54           1HD      LYS  54  -0.180  12.023   0.725
  465    HD3  LYS  54           2HD      LYS  54   0.959  10.887   1.487
  466    HE2  LYS  54           1HE      LYS  54   1.442   9.871  -0.673
  467    HE3  LYS  54           2HE      LYS  54   0.239  10.919  -1.460
  468    HZ1  LYS  54           3HZ      LYS  54   2.699  11.841  -0.119
  469    HZ2  LYS  54           1HZ      LYS  54   2.471  11.754  -1.750
  470    HZ3  LYS  54           2HZ      LYS  54   1.584  12.813  -0.849
  471    H    TRP  55           H        TRP  55  -4.599  10.871   2.262
  472    HA   TRP  55           HA       TRP  55  -5.981   9.531  -0.007
  473    HB2  TRP  55           1HB      TRP  55  -6.790  11.755   1.910
  474    HB3  TRP  55           2HB      TRP  55  -7.776  11.251   0.516
  475    HD1  TRP  55           HD       TRP  55  -6.918  10.424   3.951
  476    HE1  TRP  55           1HE      TRP  55  -8.338   8.282   4.790
  477    HE3  TRP  55           3HE      TRP  55  -8.781   8.972  -0.550
  478    HZ2  TRP  55           2HZ      TRP  55  -9.945   6.391   3.576
  479    HZ3  TRP  55           3HZ      TRP  55 -10.224   7.038  -0.700
  480    HH2  TRP  55           HH       TRP  55 -10.836   5.731   1.289
  481    H    ARG  56           H        ARG  56  -5.913  10.170  -2.008
  482    HA   ARG  56           HA       ARG  56  -4.941  12.957  -2.563
  483    HB2  ARG  56           1HB      ARG  56  -3.374  11.362  -3.334
  484    HB3  ARG  56           2HB      ARG  56  -4.644  10.501  -4.233
  485    HG2  ARG  56           1HG      ARG  56  -4.973  12.493  -5.651
  486    HG3  ARG  56           2HG      ARG  56  -3.675  13.327  -4.765
  487    HD2  ARG  56           1HD      ARG  56  -3.324  10.793  -6.332
  488    HD3  ARG  56           2HD      ARG  56  -3.018  12.430  -6.956
  489    HE   ARG  56           HE       ARG  56  -1.201  11.000  -5.066
  490   HH11  ARG  56          1HH1      ARG  56  -2.003  14.004  -6.643
  491   HH12  ARG  56          2HH1      ARG  56  -0.408  14.629  -6.278
  492   HH21  ARG  56          1HH2      ARG  56   0.632  11.699  -4.647
  493   HH22  ARG  56          2HH2      ARG  56   1.097  13.316  -5.139
  494    H    HIS  57           H        HIS  57  -6.469  14.287  -3.085
  495    HA   HIS  57           HA       HIS  57  -9.055  13.420  -4.078
  496    HB2  HIS  57           1HB      HIS  57  -8.625  15.547  -2.743
  497    HB3  HIS  57           2HB      HIS  57  -7.874  16.226  -4.208
  498    HD2  HIS  57           2HD      HIS  57 -11.484  15.644  -2.713
  499    HE1  HIS  57           1HE      HIS  57 -11.787  17.224  -6.646
  500    HE2  HIS  57           2HE      HIS  57 -13.039  16.612  -4.417
  501    H    PHE  58           H        PHE  58  -9.850  13.204  -6.035
  502    HA   PHE  58           HA       PHE  58  -8.503  14.331  -8.385
  503    HB2  PHE  58           1HB      PHE  58  -7.109  12.313  -7.967
  504    HB3  PHE  58           2HB      PHE  58  -8.574  11.306  -8.006
  505    HD1  PHE  58           1HD      PHE  58  -6.618  13.713 -10.068
  506    HD2  PHE  58           2HD      PHE  58  -9.282  10.374  -9.972
  507    HE1  PHE  58           1HE      PHE  58  -6.370  13.448 -12.513
  508    HE2  PHE  58           2HE      PHE  58  -9.034  10.105 -12.417
  509    HZ   PHE  58           HZ       PHE  58  -7.579  11.644 -13.688
  510    H    SER  59           H        SER  59 -10.049  15.054  -9.592
  511    HA   SER  59           HA       SER  59 -12.081  15.099 -10.841
  512    HB2  SER  59           1HB      SER  59 -11.862  12.165 -10.540
  513    HB3  SER  59           2HB      SER  59 -12.950  13.068 -11.618
  514    HG   SER  59           HG       SER  59 -11.074  13.966 -12.587
  515    H    GLY  60           H        GLY  60 -12.100  15.258  -7.822
  516    HA2  GLY  60           1HA      GLY  60 -14.002  15.957  -6.593
  517    HA3  GLY  60           2HA      GLY  60 -15.042  14.999  -7.672
  518    H    ARG  61           H        ARG  61 -12.447  13.093  -6.908
  519    HA   ARG  61           HA       ARG  61 -13.724  11.974  -4.448
  520    HB2  ARG  61           1HB      ARG  61 -13.088  10.401  -6.903
  521    HB3  ARG  61           2HB      ARG  61 -13.487   9.729  -5.304
  522    HG2  ARG  61           1HG      ARG  61 -15.325  11.538  -6.900
  523    HG3  ARG  61           2HG      ARG  61 -15.394   9.761  -6.942
  524    HD2  ARG  61           1HD      ARG  61 -15.831   9.758  -4.538
  525    HD3  ARG  61           2HD      ARG  61 -15.852  11.536  -4.567
  526    HE   ARG  61           HE       ARG  61 -18.087   9.826  -5.561
  527   HH11  ARG  61          1HH1      ARG  61 -16.710  13.025  -5.404
  528   HH12  ARG  61          2HH1      ARG  61 -18.259  13.720  -5.838
  529   HH21  ARG  61          1HH2      ARG  61 -19.869  10.606  -6.051
  530   HH22  ARG  61          2HH2      ARG  61 -20.062  12.342  -6.206
  531    H    LYS  62           H        LYS  62 -12.391  11.323  -2.934
  532    HA   LYS  62           HA       LYS  62  -9.479  11.491  -3.459
  533    HB2  LYS  62           1HB      LYS  62 -11.116  11.029  -0.964
  534    HB3  LYS  62           2HB      LYS  62  -9.338  11.026  -1.009
  535    HG2  LYS  62           1HG      LYS  62  -9.349  13.364  -1.771
  536    HG3  LYS  62           2HG      LYS  62 -11.128  13.370  -1.739
  537    HD2  LYS  62           1HD      LYS  62 -11.079  12.907   0.685
  538    HD3  LYS  62           2HD      LYS  62  -9.299  12.932   0.647
  539    HE2  LYS  62           1HE      LYS  62  -9.338  15.265  -0.108
  540    HE3  LYS  62           2HE      LYS  62 -11.116  15.245  -0.098
  541    HZ1  LYS  62           3HZ      LYS  62  -9.385  14.876   2.261
  542    HZ2  LYS  62           1HZ      LYS  62 -10.226  16.247   1.895
  543    HZ3  LYS  62           2HZ      LYS  62 -11.034  14.857   2.271
  544    H    TYR  63           H        TYR  63  -8.096   9.887  -3.608
  545    HA   TYR  63           HA       TYR  63  -9.184   7.110  -3.254
  546    HB2  TYR  63           1HB      TYR  63  -7.184   8.133  -5.279
  547    HB3  TYR  63           2HB      TYR  63  -7.656   6.431  -5.046
  548    HD1  TYR  63           2HD      TYR  63  -9.895   5.662  -5.722
  549    HD2  TYR  63           1HD      TYR  63  -8.648   9.677  -6.434
  550    HE1  TYR  63           2HE      TYR  63 -11.775   5.955  -7.302
  551    HE2  TYR  63           1HE      TYR  63 -10.524   9.988  -8.021
  552    HH   TYR  63           HH       TYR  63 -12.844   7.372  -8.728
  553    H    ARG  64           H        ARG  64  -7.786   5.497  -2.562
  554    HA   ARG  64           HA       ARG  64  -5.924   6.441  -0.526
  555    HB2  ARG  64           1HB      ARG  64  -6.555   3.670  -1.437
  556    HB3  ARG  64           2HB      ARG  64  -5.527   4.118  -0.056
  557    HG2  ARG  64           1HG      ARG  64  -7.421   5.144   1.069
  558    HG3  ARG  64           2HG      ARG  64  -8.463   4.821  -0.338
  559    HD2  ARG  64           1HD      ARG  64  -8.173   2.432   0.028
  560    HD3  ARG  64           2HD      ARG  64  -7.192   2.790   1.470
  561    HE   ARG  64           HE       ARG  64  -9.775   3.969   1.929
  562   HH11  ARG  64          1HH1      ARG  64  -8.504   0.766   1.391
  563   HH12  ARG  64          2HH1      ARG  64  -9.784   0.087   2.378
  564   HH21  ARG  64          1HH2      ARG  64 -11.251   3.205   3.054
  565   HH22  ARG  64          2HH2      ARG  64 -11.351   1.475   3.325
  566    H    GLU  65           H        GLU  65  -3.864   6.824  -0.647
  567    HA   GLU  65           HA       GLU  65  -2.297   5.453  -2.808
  568    HB2  GLU  65           1HB      GLU  65  -2.646   7.844  -3.298
  569    HB3  GLU  65           2HB      GLU  65  -1.902   8.249  -1.732
  570    HG2  GLU  65           1HG      GLU  65   0.278   7.246  -2.539
  571    HG3  GLU  65           2HG      GLU  65  -0.618   6.801  -4.010
  572    H    TYR  66           H        TYR  66  -0.580   4.367  -2.228
  573    HA   TYR  66           HA       TYR  66   0.198   4.532   0.667
  574    HB2  TYR  66           1HB      TYR  66   0.228   2.218  -1.278
  575    HB3  TYR  66           2HB      TYR  66   0.957   2.186   0.345
  576    HD1  TYR  66           1HD      TYR  66  -2.250   2.427  -1.507
  577    HD2  TYR  66           2HD      TYR  66  -0.398   1.876   2.294
  578    HE1  TYR  66           1HE      TYR  66  -4.436   1.765  -0.545
  579    HE2  TYR  66           2HE      TYR  66  -2.571   1.214   3.270
  580    HH   TYR  66           HH       TYR  66  -5.573   1.194   1.342
  581    H    CYS  67           H        CYS  67   2.185   4.979   1.224
  582    HA   CYS  67           HA       CYS  67   4.278   5.183  -0.966
  583    HB2  CYS  67           1HB      CYS  67   3.282   7.308  -0.156
  584    HB3  CYS  67           2HB      CYS  67   3.698   6.859   1.515
  585    HG   CYS  67           HG       CYS  67   6.225   6.794   1.166
  586    H    LEU  68           H        LEU  68   6.245   4.333  -0.546
  587    HA   LEU  68           HA       LEU  68   6.566   2.582   1.771
  588    HB2  LEU  68           1HB      LEU  68   7.336   2.087  -0.388
  589    HB3  LEU  68           2HB      LEU  68   8.551   3.385  -0.427
  590    HG   LEU  68           HG       LEU  68   9.639   2.321   1.576
  591   HD11  LEU  68          1HD1      LEU  68   9.060  -0.074   2.051
  592   HD12  LEU  68          2HD1      LEU  68   7.672   0.998   2.347
  593   HD13  LEU  68          3HD1      LEU  68   7.743   0.024   0.859
  594   HD21  LEU  68          3HD2      LEU  68  10.539   2.007  -0.652
  595   HD22  LEU  68          1HD2      LEU  68  10.733   0.515   0.296
  596   HD23  LEU  68          2HD2      LEU  68   9.448   0.630  -0.932
  597    H    LYS  69           H        LYS  69   6.400   3.910   3.556
  598    HA   LYS  69           HA       LYS  69   8.944   4.891   4.502
  599    HB2  LYS  69           1HB      LYS  69   8.325   6.764   3.023
  600    HB3  LYS  69           2HB      LYS  69   6.810   6.956   3.936
  601    HG2  LYS  69           1HG      LYS  69   8.074   7.514   5.956
  602    HG3  LYS  69           2HG      LYS  69   9.606   7.265   5.085
  603    HD2  LYS  69           1HD      LYS  69   8.962   9.086   3.513
  604    HD3  LYS  69           2HD      LYS  69   7.499   9.370   4.486
  605    HE2  LYS  69           1HE      LYS  69   8.891   9.882   6.442
  606    HE3  LYS  69           2HE      LYS  69  10.358   9.581   5.483
  607    HZ1  LYS  69           3HZ      LYS  69   8.369  11.697   4.956
  608    HZ2  LYS  69           1HZ      LYS  69   9.856  11.925   5.631
  609    HZ3  LYS  69           2HZ      LYS  69   9.729  11.418   4.066
  610    H    HIS  70           H        HIS  70   9.037   5.035   6.650
  611    HA   HIS  70           HA       HIS  70   6.992   3.833   8.221
  612    HB2  HIS  70           1HB      HIS  70   9.400   4.008   8.909
  613    HB3  HIS  70           2HB      HIS  70   9.163   5.752   9.175
  614    HD1  HIS  70           1HD      HIS  70   7.673   2.455  10.402
  615    HD2  HIS  70           2HD      HIS  70   8.509   6.328  11.841
  616    HE1  HIS  70           1HE      HIS  70   7.005   2.461  12.753
  617    H    ARG  71           H        ARG  71   5.146   4.473   8.976
  618    HA   ARG  71           HA       ARG  71   4.112   7.088   8.351
  619    HB2  ARG  71           1HB      ARG  71   2.791   5.025   8.543
  620    HB3  ARG  71           2HB      ARG  71   2.974   5.150  10.309
  621    HG2  ARG  71           1HG      ARG  71   1.812   7.283  10.317
  622    HG3  ARG  71           2HG      ARG  71   1.712   7.265   8.539
  623    HD2  ARG  71           1HD      ARG  71   0.281   5.323   8.639
  624    HD3  ARG  71           2HD      ARG  71   0.383   5.336  10.415
  625    HE   ARG  71           HE       ARG  71  -1.235   7.213  10.385
  626   HH11  ARG  71          1HH1      ARG  71  -0.154   6.494   7.147
  627   HH12  ARG  71          2HH1      ARG  71  -1.452   7.470   6.490
  628   HH21  ARG  71          1HH2      ARG  71  -2.722   8.341   9.647
  629   HH22  ARG  71          2HH2      ARG  71  -2.917   8.524   7.915
  630    H    ASP  72           H        ASP  72   4.142   8.940   9.351
  631    HA   ASP  72           HA       ASP  72   5.733   9.328  11.727
  632    HB2  ASP  72           1HB      ASP  72   3.749  11.203  10.303
  633    HB3  ASP  72           2HB      ASP  72   4.725  11.498  11.763
  634    H    GLU  73           H        GLU  73   2.270   8.935  11.172
  635    HA   GLU  73           HA       GLU  73   1.417   9.545  13.843
  636    HB2  GLU  73           1HB      GLU  73  -0.075   9.327  11.895
  637    HB3  GLU  73           2HB      GLU  73   0.263   7.580  11.859
  638    HG2  GLU  73           1HG      GLU  73  -0.832   7.342  14.125
  639    HG3  GLU  73           2HG      GLU  73  -0.992   9.112  14.097
  640    H    LEU  74           H        LEU  74   2.500   6.507  12.348
  641    HA   LEU  74           HA       LEU  74   2.109   4.903  14.709
  642    HB2  LEU  74           1HB      LEU  74   3.873   4.764  12.359
  643    HB3  LEU  74           2HB      LEU  74   3.873   3.399  13.499
  644    HG   LEU  74           HG       LEU  74   1.514   4.379  11.843
  645   HD11  LEU  74          1HD1      LEU  74   1.727   2.151  10.710
  646   HD12  LEU  74          2HD1      LEU  74   3.212   3.114  10.527
  647   HD13  LEU  74          3HD1      LEU  74   3.149   1.792  11.716
  648   HD21  LEU  74          3HD2      LEU  74   0.789   3.579  14.014
  649   HD22  LEU  74          1HD2      LEU  74   0.315   2.419  12.748
  650   HD23  LEU  74          2HD2      LEU  74   1.712   2.072  13.798
  651    H    ALA  75           H        ALA  75   4.827   6.845  13.540
  652    HA   ALA  75           HA       ALA  75   6.659   6.068  15.598
  653    HB1  ALA  75           1HB      ALA  75   7.849   8.148  15.023
  654    HB2  ALA  75           2HB      ALA  75   7.375   7.243  13.566
  655    HB3  ALA  75           3HB      ALA  75   6.451   8.680  14.061
  656    H    ASP  76           H        ASP  76   4.202   8.626  15.425
  657    HA   ASP  76           HA       ASP  76   4.824   9.798  17.986
  658    HB2  ASP  76           1HB      ASP  76   2.223   9.816  16.342
  659    HB3  ASP  76           2HB      ASP  76   2.563  10.575  17.917
  660    H    LEU  77           H        LEU  77   2.757   7.109  17.001
  661    HA   LEU  77           HA       LEU  77   1.629   6.673  19.629
  662    HB2  LEU  77           1HB      LEU  77   2.113   5.012  17.251
  663    HB3  LEU  77           2HB      LEU  77   1.223   4.297  18.615
  664    HG   LEU  77           HG       LEU  77   0.354   6.713  16.982
  665   HD11  LEU  77          1HD1      LEU  77  -1.462   5.193  16.155
  666   HD12  LEU  77          2HD1      LEU  77   0.150   4.570  15.726
  667   HD13  LEU  77          3HD1      LEU  77  -0.748   3.858  17.089
  668   HD21  LEU  77          3HD2      LEU  77  -0.368   6.863  19.293
  669   HD22  LEU  77          1HD2      LEU  77  -1.765   6.529  18.241
  670   HD23  LEU  77          2HD2      LEU  77  -1.049   5.222  19.216
  671    H    GLU  78           H        GLU  78   4.567   5.575  18.012
  672    HA   GLU  78           HA       GLU  78   5.373   3.786  20.150
  673    HB2  GLU  78           1HB      GLU  78   6.870   5.207  17.950
  674    HB3  GLU  78           2HB      GLU  78   7.647   4.113  19.121
  675    HG2  GLU  78           1HG      GLU  78   6.245   2.208  18.263
  676    HG3  GLU  78           2HG      GLU  78   5.408   3.419  17.267
  677    H    HIS  79           H        HIS  79   5.648   7.232  19.592
  678    HA   HIS  79           HA       HIS  79   7.601   7.655  21.717
  679    HB2  HIS  79           1HB      HIS  79   5.716   9.581  20.287
  680    HB3  HIS  79           2HB      HIS  79   6.997  10.061  21.424
  681    HD2  HIS  79           2HD      HIS  79   9.100   7.650  19.691
  682    HE1  HIS  79           1HE      HIS  79   8.767  10.849  16.914
  683    HE2  HIS  79           2HE      HIS  79  10.068   8.677  17.625
  Start of MODEL   12
    1    H    LYS   3           H        LYS   3   6.143 -14.382 -10.120
    2    HA   LYS   3           HA       LYS   3   6.230 -11.788  -8.981
    3    HB2  LYS   3           1HB      LYS   3   4.332 -12.086 -11.313
    4    HB3  LYS   3           2HB      LYS   3   4.276 -10.782 -10.102
    5    HG2  LYS   3           1HG      LYS   3   6.523 -10.042 -10.806
    6    HG3  LYS   3           2HG      LYS   3   6.557 -11.333 -12.031
    7    HD2  LYS   3           1HD      LYS   3   4.573 -10.350 -13.116
    8    HD3  LYS   3           2HD      LYS   3   4.556  -9.051 -11.899
    9    HE2  LYS   3           1HE      LYS   3   6.751  -8.291 -12.637
   10    HE3  LYS   3           2HE      LYS   3   6.846  -9.629 -13.803
   11    HZ1  LYS   3           3HZ      LYS   3   4.863  -7.446 -13.857
   12    HZ2  LYS   3           1HZ      LYS   3   6.169  -7.580 -14.855
   13    HZ3  LYS   3           2HZ      LYS   3   4.950  -8.688 -14.940
   14    H    ALA   4           H        ALA   4   4.279 -14.525 -10.035
   15    HA   ALA   4           HA       ALA   4   2.250 -14.088  -7.990
   16    HB1  ALA   4           1HB      ALA   4   1.414 -16.298  -8.693
   17    HB2  ALA   4           2HB      ALA   4   1.703 -15.233 -10.090
   18    HB3  ALA   4           3HB      ALA   4   2.863 -16.524  -9.698
   19    H    LYS   5           H        LYS   5   5.390 -15.429  -8.032
   20    HA   LYS   5           HA       LYS   5   5.060 -17.293  -5.831
   21    HB2  LYS   5           1HB      LYS   5   7.453 -15.828  -6.948
   22    HB3  LYS   5           2HB      LYS   5   7.538 -17.024  -5.633
   23    HG2  LYS   5           1HG      LYS   5   6.652 -18.752  -7.139
   24    HG3  LYS   5           2HG      LYS   5   6.545 -17.558  -8.454
   25    HD2  LYS   5           1HD      LYS   5   8.980 -17.233  -8.367
   26    HD3  LYS   5           2HD      LYS   5   9.093 -18.409  -7.036
   27    HE2  LYS   5           1HE      LYS   5   8.211 -20.167  -8.503
   28    HE3  LYS   5           2HE      LYS   5   8.073 -18.994  -9.833
   29    HZ1  LYS   5           3HZ      LYS   5  10.586 -19.810  -8.521
   30    HZ2  LYS   5           1HZ      LYS   5  10.076 -20.307 -10.008
   31    HZ3  LYS   5           2HZ      LYS   5  10.458 -18.722  -9.755
   32    H    LEU   6           H        LEU   6   5.402 -13.843  -6.067
   33    HA   LEU   6           HA       LEU   6   6.169 -13.492  -3.265
   34    HB2  LEU   6           1HB      LEU   6   5.030 -11.731  -5.335
   35    HB3  LEU   6           2HB      LEU   6   5.582 -11.043  -3.790
   36    HG   LEU   6           HG       LEU   6   7.319 -12.435  -5.866
   37   HD11  LEU   6          1HD1      LEU   6   8.339 -10.162  -6.159
   38   HD12  LEU   6          2HD1      LEU   6   6.603 -10.146  -6.547
   39   HD13  LEU   6          3HD1      LEU   6   7.174  -9.505  -4.987
   40   HD21  LEU   6          3HD2      LEU   6   8.106 -12.863  -3.613
   41   HD22  LEU   6          1HD2      LEU   6   9.216 -11.746  -4.442
   42   HD23  LEU   6          2HD2      LEU   6   8.061 -11.124  -3.236
   43    H    SER   7           H        SER   7   4.975 -12.976  -1.534
   44    HA   SER   7           HA       SER   7   2.126 -13.682  -1.474
   45    HB2  SER   7           1HB      SER   7   2.172 -13.275   0.734
   46    HB3  SER   7           2HB      SER   7   3.704 -14.077   0.315
   47    HG   SER   7           HG       SER   7   4.184 -12.397   1.662
   48    H    LEU   8           H        LEU   8   0.527 -12.169  -0.545
   49    HA   LEU   8           HA       LEU   8   0.306  -9.705  -2.006
   50    HB2  LEU   8           1HB      LEU   8  -1.016 -11.140   0.104
   51    HB3  LEU   8           2HB      LEU   8  -1.418  -9.407   0.157
   52    HG   LEU   8           HG       LEU   8  -2.410  -9.470  -2.008
   53   HD11  LEU   8          1HD1      LEU   8  -2.373 -11.534  -3.434
   54   HD12  LEU   8          2HD1      LEU   8  -0.726 -10.950  -3.099
   55   HD13  LEU   8          3HD1      LEU   8  -1.376 -12.346  -2.208
   56   HD21  LEU   8          3HD2      LEU   8  -3.834 -10.317  -0.238
   57   HD22  LEU   8          1HD2      LEU   8  -4.188 -11.169  -1.761
   58   HD23  LEU   8          2HD2      LEU   8  -3.223 -11.969  -0.498
   59    H    THR   9           H        THR   9   1.580 -10.479   1.187
   60    HA   THR   9           HA       THR   9   1.963  -7.727   2.005
   61    HB   THR   9           HB       THR   9   3.430 -10.263   2.844
   62    HG1  THR   9           1HG      THR   9   1.992 -10.066   4.662
   63   HG21  THR   9          3HG2      THR   9   3.313  -7.507   4.132
   64   HG22  THR   9          1HG2      THR   9   4.105  -8.945   4.821
   65   HG23  THR   9          2HG2      THR   9   4.729  -8.216   3.321
   66    H    GLN  10           H        GLN  10   4.098 -10.111   0.438
   67    HA   GLN  10           HA       GLN  10   6.358  -8.322   0.307
   68    HB2  GLN  10           1HB      GLN  10   5.578 -10.790  -1.251
   69    HB3  GLN  10           2HB      GLN  10   7.109  -9.917  -1.498
   70    HG2  GLN  10           1HG      GLN  10   7.791 -10.579   0.978
   71    HG3  GLN  10           2HG      GLN  10   6.065 -11.013   0.964
   72   HE21  GLN  10          2HE2      GLN  10   8.680 -12.519   1.473
   73   HE22  GLN  10          1HE2      GLN  10   8.551 -13.928   0.475
   74    H    LEU  11           H        LEU  11   3.695  -9.032  -1.914
   75    HA   LEU  11           HA       LEU  11   4.750  -7.573  -4.146
   76    HB2  LEU  11           1HB      LEU  11   2.085  -8.322  -3.177
   77    HB3  LEU  11           2HB      LEU  11   2.166  -7.433  -4.716
   78    HG   LEU  11           HG       LEU  11   3.492 -10.115  -4.160
   79   HD11  LEU  11          1HD1      LEU  11   1.742 -11.044  -5.698
   80   HD12  LEU  11          2HD1      LEU  11   1.007 -10.303  -4.257
   81   HD13  LEU  11          3HD1      LEU  11   1.002  -9.430  -5.808
   82   HD21  LEU  11          3HD2      LEU  11   4.693  -8.784  -5.791
   83   HD22  LEU  11          1HD2      LEU  11   3.892 -10.155  -6.598
   84   HD23  LEU  11          2HD2      LEU  11   3.198  -8.520  -6.720
   85    H    ILE  12           H        ILE  12   2.586  -6.579  -1.500
   86    HA   ILE  12           HA       ILE  12   2.250  -3.872  -2.482
   87    HB   ILE  12           HB       ILE  12   1.928  -5.112   0.285
   88   HG12  ILE  12          1HG1      ILE  12  -0.149  -4.127  -1.648
   89   HG13  ILE  12          2HG1      ILE  12   0.406  -5.813  -1.546
   90   HG21  ILE  12          1HG2      ILE  12   0.781  -3.014   0.908
   91   HG22  ILE  12          2HG2      ILE  12   2.481  -2.712   0.483
   92   HG23  ILE  12          3HG2      ILE  12   1.191  -2.318  -0.677
   93   HD11  ILE  12          3HD1      ILE  12  -0.913  -4.238   0.693
   94   HD12  ILE  12          1HD1      ILE  12  -1.694  -5.492  -0.296
   95   HD13  ILE  12          2HD1      ILE  12  -0.356  -5.925   0.794
   96    H    LEU  13           H        LEU  13   4.488  -5.294  -0.122
   97    HA   LEU  13           HA       LEU  13   5.615  -2.748   0.629
   98    HB2  LEU  13           1HB      LEU  13   6.505  -5.548   0.732
   99    HB3  LEU  13           2HB      LEU  13   7.534  -4.309   1.487
  100    HG   LEU  13           HG       LEU  13   4.680  -5.008   2.278
  101   HD11  LEU  13          1HD1      LEU  13   5.741  -5.830   4.397
  102   HD12  LEU  13          2HD1      LEU  13   6.351  -6.720   2.982
  103   HD13  LEU  13          3HD1      LEU  13   7.344  -5.444   3.726
  104   HD21  LEU  13          3HD2      LEU  13   5.134  -2.645   2.574
  105   HD22  LEU  13          1HD2      LEU  13   5.037  -3.448   4.160
  106   HD23  LEU  13          2HD2      LEU  13   6.622  -3.015   3.478
  107    H    ILE  14           H        ILE  14   6.525  -5.177  -1.786
  108    HA   ILE  14           HA       ILE  14   8.957  -3.778  -2.586
  109    HB   ILE  14           HB       ILE  14   7.245  -5.908  -3.939
  110   HG12  ILE  14          1HG1      ILE  14  10.004  -6.105  -2.769
  111   HG13  ILE  14          2HG1      ILE  14   8.511  -6.476  -1.876
  112   HG21  ILE  14          1HG2      ILE  14   9.101  -6.135  -5.557
  113   HG22  ILE  14          2HG2      ILE  14   8.374  -4.514  -5.640
  114   HG23  ILE  14          3HG2      ILE  14   9.927  -4.749  -4.804
  115   HD11  ILE  14          3HD1      ILE  14   9.461  -7.865  -4.405
  116   HD12  ILE  14          1HD1      ILE  14   9.552  -8.527  -2.759
  117   HD13  ILE  14          2HD1      ILE  14   7.967  -8.235  -3.514
  118    H    ARG  15           H        ARG  15   5.617  -3.770  -3.746
  119    HA   ARG  15           HA       ARG  15   6.112  -2.061  -6.003
  120    HB2  ARG  15           1HB      ARG  15   4.132  -3.359  -5.837
  121    HB3  ARG  15           2HB      ARG  15   3.620  -2.438  -4.403
  122    HG2  ARG  15           1HG      ARG  15   2.394  -1.626  -6.312
  123    HG3  ARG  15           2HG      ARG  15   3.563  -0.380  -5.809
  124    HD2  ARG  15           1HD      ARG  15   5.055  -1.106  -7.598
  125    HD3  ARG  15           2HD      ARG  15   3.820  -2.274  -8.122
  126    HE   ARG  15           HE       ARG  15   2.662   0.385  -8.250
  127   HH11  ARG  15          1HH1      ARG  15   5.127  -1.493  -9.850
  128   HH12  ARG  15          2HH1      ARG  15   4.852  -0.600 -11.334
  129   HH21  ARG  15          1HH2      ARG  15   2.340   1.421  -9.938
  130   HH22  ARG  15          2HH2      ARG  15   3.263   1.062 -11.385
  131    H    LEU  16           H        LEU  16   5.298  -1.364  -2.618
  132    HA   LEU  16           HA       LEU  16   5.197   1.516  -3.074
  133    HB2  LEU  16           1HB      LEU  16   5.442  -0.220  -0.711
  134    HB3  LEU  16           2HB      LEU  16   5.247   1.533  -0.480
  135    HG   LEU  16           HG       LEU  16   3.245  -0.395  -1.720
  136   HD11  LEU  16          1HD1      LEU  16   1.814   0.294   0.223
  137   HD12  LEU  16          2HD1      LEU  16   3.338  -0.443   0.772
  138   HD13  LEU  16          3HD1      LEU  16   3.140   1.325   0.812
  139   HD21  LEU  16          3HD2      LEU  16   3.222   1.716  -2.912
  140   HD22  LEU  16          1HD2      LEU  16   1.748   1.560  -1.927
  141   HD23  LEU  16          2HD2      LEU  16   3.078   2.613  -1.382
  142    H    SER  17           H        SER  17   7.671  -0.804  -2.215
  143    HA   SER  17           HA       SER  17   9.748   1.049  -1.388
  144    HB2  SER  17           1HB      SER  17   9.856  -1.222  -0.881
  145    HB3  SER  17           2HB      SER  17   9.941  -1.636  -2.609
  146    HG   SER  17           HG       SER  17  12.003  -1.523  -1.620
  147    H    ASN  18           H        ASN  18   8.703  -0.287  -4.539
  148    HA   ASN  18           HA       ASN  18  10.940   0.928  -5.980
  149    HB2  ASN  18           1HB      ASN  18   8.428  -0.469  -7.178
  150    HB3  ASN  18           2HB      ASN  18   9.836   0.403  -7.833
  151   HD21  ASN  18          2HD2      ASN  18   8.914  -2.421  -8.038
  152   HD22  ASN  18          1HD2      ASN  18  10.278  -3.373  -7.557
  153    H    ARG  19           H        ARG  19   7.562   1.765  -5.362
  154    HA   ARG  19           HA       ARG  19   7.864   4.077  -7.248
  155    HB2  ARG  19           1HB      ARG  19   5.390   2.646  -6.384
  156    HB3  ARG  19           2HB      ARG  19   5.460   4.113  -7.386
  157    HG2  ARG  19           1HG      ARG  19   6.768   1.489  -8.150
  158    HG3  ARG  19           2HG      ARG  19   5.124   1.956  -8.653
  159    HD2  ARG  19           1HD      ARG  19   6.089   3.945  -9.731
  160    HD3  ARG  19           2HD      ARG  19   7.706   3.318  -9.338
  161    HE   ARG  19           HE       ARG  19   6.376   1.320 -10.947
  162   HH11  ARG  19          1HH1      ARG  19   7.532   4.590 -11.312
  163   HH12  ARG  19          2HH1      ARG  19   7.836   4.299 -13.013
  164   HH21  ARG  19          1HH2      ARG  19   6.711   0.974 -12.896
  165   HH22  ARG  19          2HH2      ARG  19   7.367   2.238 -13.918
  166    H    GLY  20           H        GLY  20   7.753   3.272  -3.991
  167    HA2  GLY  20           1HA      GLY  20   7.991   4.786  -2.215
  168    HA3  GLY  20           2HA      GLY  20   7.546   6.120  -3.304
  169    H    CYS  21           H        CYS  21   5.156   5.770  -4.189
  170    HA   CYS  21           HA       CYS  21   3.315   4.920  -1.949
  171    HB2  CYS  21           1HB      CYS  21   3.964   7.280  -1.644
  172    HB3  CYS  21           2HB      CYS  21   3.526   7.631  -3.335
  173    HG   CYS  21           HG       CYS  21   1.865   8.705  -1.745
  174    H    GLN  22           H        GLN  22   1.551   3.926  -2.711
  175    HA   GLN  22           HA       GLN  22   0.677   4.503  -5.512
  176    HB2  GLN  22           1HB      GLN  22   0.958   1.823  -4.146
  177    HB3  GLN  22           2HB      GLN  22  -0.014   2.085  -5.614
  178    HG2  GLN  22           1HG      GLN  22   3.107   2.492  -5.581
  179    HG3  GLN  22           2HG      GLN  22   2.026   1.126  -5.943
  180   HE21  GLN  22          2HE2      GLN  22   2.329   4.628  -6.713
  181   HE22  GLN  22          1HE2      GLN  22   1.988   4.456  -8.402
  182    H    THR  23           H        THR  23  -1.518   4.194  -5.965
  183    HA   THR  23           HA       THR  23  -3.241   4.799  -3.651
  184    HB   THR  23           HB       THR  23  -3.986   4.411  -6.579
  185    HG1  THR  23           1HG      THR  23  -3.928   6.736  -6.583
  186   HG21  THR  23          3HG2      THR  23  -5.430   5.763  -4.266
  187   HG22  THR  23          1HG2      THR  23  -5.996   5.701  -5.952
  188   HG23  THR  23          2HG2      THR  23  -5.874   4.204  -4.998
  189    H    LEU  24           H        LEU  24  -4.860   3.621  -2.815
  190    HA   LEU  24           HA       LEU  24  -4.586   0.889  -2.490
  191    HB2  LEU  24           1HB      LEU  24  -5.979   2.198  -1.230
  192    HB3  LEU  24           2HB      LEU  24  -7.164   2.549  -2.510
  193    HG   LEU  24           HG       LEU  24  -7.680   0.097  -2.613
  194   HD11  LEU  24          1HD1      LEU  24  -6.962  -1.317  -0.669
  195   HD12  LEU  24          2HD1      LEU  24  -5.560  -0.727  -1.592
  196   HD13  LEU  24          3HD1      LEU  24  -6.002   0.047  -0.051
  197   HD21  LEU  24          3HD2      LEU  24  -9.124   1.621  -1.398
  198   HD22  LEU  24          1HD2      LEU  24  -9.042   0.057  -0.551
  199   HD23  LEU  24          2HD2      LEU  24  -8.121   1.451   0.063
  200    H    GLU  25           H        GLU  25  -6.496   2.485  -5.035
  201    HA   GLU  25           HA       GLU  25  -7.459   0.027  -6.191
  202    HB2  GLU  25           1HB      GLU  25  -7.089   2.808  -7.305
  203    HB3  GLU  25           2HB      GLU  25  -7.842   1.467  -8.204
  204    HG2  GLU  25           1HG      GLU  25  -9.671   1.360  -6.457
  205    HG3  GLU  25           2HG      GLU  25  -8.756   2.624  -5.603
  206    H    GLU  26           H        GLU  26  -4.547   1.952  -6.697
  207    HA   GLU  26           HA       GLU  26  -3.670   0.482  -9.038
  208    HB2  GLU  26           1HB      GLU  26  -2.222   2.181  -7.006
  209    HB3  GLU  26           2HB      GLU  26  -1.444   1.457  -8.434
  210    HG2  GLU  26           1HG      GLU  26  -2.873   2.844  -9.940
  211    HG3  GLU  26           2HG      GLU  26  -3.780   3.316  -8.486
  212    H    LEU  27           H        LEU  27  -3.058   0.161  -5.557
  213    HA   LEU  27           HA       LEU  27  -1.243  -2.068  -5.828
  214    HB2  LEU  27           1HB      LEU  27  -3.057  -1.087  -3.731
  215    HB3  LEU  27           2HB      LEU  27  -1.987  -2.458  -3.352
  216    HG   LEU  27           HG       LEU  27  -1.091   0.339  -4.154
  217   HD11  LEU  27          1HD1      LEU  27  -0.272   0.489  -1.788
  218   HD12  LEU  27          2HD1      LEU  27  -2.033   0.248  -1.848
  219   HD13  LEU  27          3HD1      LEU  27  -0.961  -1.119  -1.463
  220   HD21  LEU  27          3HD2      LEU  27   0.444  -1.373  -4.928
  221   HD22  LEU  27          1HD2      LEU  27   1.175  -0.462  -3.586
  222   HD23  LEU  27          2HD2      LEU  27   0.511  -2.090  -3.301
  223    H    GLU  28           H        GLU  28  -4.755  -1.806  -5.594
  224    HA   GLU  28           HA       GLU  28  -5.288  -4.620  -5.367
  225    HB2  GLU  28           1HB      GLU  28  -6.951  -2.876  -4.955
  226    HB3  GLU  28           2HB      GLU  28  -6.896  -2.420  -6.676
  227    HG2  GLU  28           1HG      GLU  28  -7.764  -4.782  -7.230
  228    HG3  GLU  28           2HG      GLU  28  -7.818  -4.990  -5.465
  229    H    GLU  29           H        GLU  29  -4.954  -2.502  -8.212
  230    HA   GLU  29           HA       GLU  29  -5.427  -4.647 -10.106
  231    HB2  GLU  29           1HB      GLU  29  -4.134  -1.931 -10.338
  232    HB3  GLU  29           2HB      GLU  29  -4.367  -3.038 -11.712
  233    HG2  GLU  29           1HG      GLU  29  -6.865  -2.890 -11.390
  234    HG3  GLU  29           2HG      GLU  29  -6.503  -1.923  -9.943
  235    H    PHE  30           H        PHE  30  -2.575  -3.372  -8.494
  236    HA   PHE  30           HA       PHE  30  -0.633  -4.692 -10.165
  237    HB2  PHE  30           1HB      PHE  30   0.003  -2.858  -8.651
  238    HB3  PHE  30           2HB      PHE  30  -0.469  -3.835  -7.243
  239    HD1  PHE  30           1HD      PHE  30   1.858  -3.776 -10.143
  240    HD2  PHE  30           2HD      PHE  30   1.057  -5.190  -6.191
  241    HE1  PHE  30           1HE      PHE  30   4.153  -4.686 -10.004
  242    HE2  PHE  30           2HE      PHE  30   3.352  -6.098  -6.049
  243    HZ   PHE  30           HZ       PHE  30   4.899  -5.848  -7.958
  244    H    THR  31           H        THR  31  -2.164  -5.651  -7.088
  245    HA   THR  31           HA       THR  31  -0.798  -8.273  -7.224
  246    HB   THR  31           HB       THR  31  -1.855  -8.713  -5.063
  247    HG1  THR  31           1HG      THR  31  -3.168  -6.203  -5.471
  248   HG21  THR  31          3HG2      THR  31  -0.775  -5.871  -5.214
  249   HG22  THR  31          1HG2      THR  31  -0.881  -6.867  -3.744
  250   HG23  THR  31          2HG2      THR  31   0.205  -7.348  -5.069
  251    H    GLN  32           H        GLN  32  -3.755  -6.878  -8.237
  252    HA   GLN  32           HA       GLN  32  -5.758  -7.789  -8.982
  253    HB2  GLN  32           1HB      GLN  32  -3.961 -10.166  -9.515
  254    HB3  GLN  32           2HB      GLN  32  -5.595  -9.925 -10.177
  255    HG2  GLN  32           1HG      GLN  32  -4.524  -7.747 -11.438
  256    HG3  GLN  32           2HG      GLN  32  -3.149  -8.439 -10.547
  257   HE21  GLN  32          2HE2      GLN  32  -2.856  -8.068 -13.203
  258   HE22  GLN  32          1HE2      GLN  32  -2.906  -9.578 -14.049
  259    H    ALA  33           H        ALA  33  -5.178  -8.026  -6.190
  260    HA   ALA  33           HA       ALA  33  -6.532 -10.618  -5.573
  261    HB1  ALA  33           1HB      ALA  33  -5.626 -10.355  -3.296
  262    HB2  ALA  33           2HB      ALA  33  -4.332 -10.376  -4.518
  263    HB3  ALA  33           3HB      ALA  33  -4.841  -8.835  -3.787
  264    H    LYS  34           H        LYS  34  -7.975 -10.581  -3.662
  265    HA   LYS  34           HA       LYS  34 -10.083  -8.681  -4.003
  266    HB2  LYS  34           1HB      LYS  34 -10.297 -10.951  -3.024
  267    HB3  LYS  34           2HB      LYS  34  -9.444 -10.366  -1.576
  268    HG2  LYS  34           1HG      LYS  34 -11.242  -8.802  -1.098
  269    HG3  LYS  34           2HG      LYS  34 -12.072  -9.245  -2.608
  270    HD2  LYS  34           1HD      LYS  34 -12.305 -11.568  -1.769
  271    HD3  LYS  34           2HD      LYS  34 -11.540 -11.072  -0.242
  272    HE2  LYS  34           1HE      LYS  34 -13.348  -9.465   0.156
  273    HE3  LYS  34           2HE      LYS  34 -14.111  -9.935  -1.382
  274    HZ1  LYS  34           3HZ      LYS  34 -13.685 -11.712   0.935
  275    HZ2  LYS  34           1HZ      LYS  34 -15.126 -11.043   0.493
  276    HZ3  LYS  34           2HZ      LYS  34 -14.391 -12.148  -0.489
  277    H    ARG  35           H        ARG  35 -10.482  -6.743  -3.275
  278    HA   ARG  35           HA       ARG  35  -8.422  -5.151  -2.146
  279    HB2  ARG  35           1HB      ARG  35 -10.281  -4.285  -3.425
  280    HB3  ARG  35           2HB      ARG  35 -11.358  -4.623  -2.050
  281    HG2  ARG  35           1HG      ARG  35 -10.104  -3.053  -0.656
  282    HG3  ARG  35           2HG      ARG  35  -8.978  -2.741  -2.000
  283    HD2  ARG  35           1HD      ARG  35 -11.908  -2.095  -1.933
  284    HD3  ARG  35           2HD      ARG  35 -10.559  -0.952  -1.734
  285    HE   ARG  35           HE       ARG  35 -10.192  -1.994  -4.339
  286   HH11  ARG  35          1HH1      ARG  35 -12.897  -0.507  -2.719
  287   HH12  ARG  35          2HH1      ARG  35 -13.453   0.158  -4.242
  288   HH21  ARG  35          1HH2      ARG  35 -10.820  -1.250  -6.093
  289   HH22  ARG  35          2HH2      ARG  35 -12.270  -0.266  -6.168
  290    H    GLU  36           H        GLU  36 -11.201  -6.711  -0.558
  291    HA   GLU  36           HA       GLU  36 -10.766  -5.667   2.047
  292    HB2  GLU  36           1HB      GLU  36 -12.759  -6.911   1.351
  293    HB3  GLU  36           2HB      GLU  36 -11.783  -8.394   1.232
  294    HG2  GLU  36           1HG      GLU  36 -11.369  -8.284   3.730
  295    HG3  GLU  36           2HG      GLU  36 -12.286  -6.762   3.685
  296    H    VAL  37           H        VAL  37  -9.471  -8.650   0.577
  297    HA   VAL  37           HA       VAL  37  -7.919  -9.436   2.888
  298    HB   VAL  37           HB       VAL  37  -7.550 -10.029  -0.077
  299   HG11  VAL  37          1HG1      VAL  37  -6.079 -11.865   0.686
  300   HG12  VAL  37          2HG1      VAL  37  -5.430 -10.280   1.170
  301   HG13  VAL  37          3HG1      VAL  37  -6.256 -11.306   2.367
  302   HG21  VAL  37          3HG2      VAL  37  -9.642 -10.870   0.810
  303   HG22  VAL  37          1HG2      VAL  37  -8.515 -12.204   0.478
  304   HG23  VAL  37          2HG2      VAL  37  -8.778 -11.659   2.152
  305    H    LEU  38           H        LEU  38  -7.147  -7.399   0.097
  306    HA   LEU  38           HA       LEU  38  -4.392  -7.003   0.830
  307    HB2  LEU  38           1HB      LEU  38  -6.389  -5.437  -0.658
  308    HB3  LEU  38           2HB      LEU  38  -4.701  -4.875  -0.643
  309    HG   LEU  38           HG       LEU  38  -5.638  -7.557  -1.728
  310   HD11  LEU  38          1HD1      LEU  38  -5.164  -6.568  -3.984
  311   HD12  LEU  38          2HD1      LEU  38  -6.442  -5.665  -3.138
  312   HD13  LEU  38          3HD1      LEU  38  -4.787  -5.013  -3.206
  313   HD21  LEU  38          3HD2      LEU  38  -3.361  -7.597  -0.899
  314   HD22  LEU  38          1HD2      LEU  38  -3.361  -7.693  -2.676
  315   HD23  LEU  38          2HD2      LEU  38  -2.952  -6.161  -1.866
  316    H    LEU  39           H        LEU  39  -7.386  -5.405   1.781
  317    HA   LEU  39           HA       LEU  39  -6.071  -3.214   3.151
  318    HB2  LEU  39           1HB      LEU  39  -8.712  -4.492   3.237
  319    HB3  LEU  39           2HB      LEU  39  -8.439  -3.086   4.291
  320    HG   LEU  39           HG       LEU  39  -8.253  -3.096   1.254
  321   HD11  LEU  39          1HD1      LEU  39 -10.328  -1.690   1.360
  322   HD12  LEU  39          2HD1      LEU  39 -10.599  -3.297   2.072
  323   HD13  LEU  39          3HD1      LEU  39 -10.353  -1.887   3.128
  324   HD21  LEU  39          3HD2      LEU  39  -6.724  -1.509   2.267
  325   HD22  LEU  39          1HD2      LEU  39  -8.066  -0.643   1.480
  326   HD23  LEU  39          2HD2      LEU  39  -8.042  -0.825   3.250
  327    H    VAL  40           H        VAL  40  -7.060  -6.459   4.076
  328    HA   VAL  40           HA       VAL  40  -6.536  -6.186   6.913
  329    HB   VAL  40           HB       VAL  40  -6.393  -8.587   5.044
  330   HG11  VAL  40          1HG1      VAL  40  -6.380  -9.946   7.109
  331   HG12  VAL  40          2HG1      VAL  40  -4.937  -8.909   7.015
  332   HG13  VAL  40          3HG1      VAL  40  -6.287  -8.463   8.085
  333   HG21  VAL  40          3HG2      VAL  40  -8.618  -7.651   5.259
  334   HG22  VAL  40          1HG2      VAL  40  -8.508  -9.219   6.093
  335   HG23  VAL  40          2HG2      VAL  40  -8.490  -7.708   7.034
  336    H    THR  41           H        THR  41  -4.448  -7.177   4.205
  337    HA   THR  41           HA       THR  41  -2.088  -7.467   5.828
  338    HB   THR  41           HB       THR  41  -2.371  -6.762   2.876
  339    HG1  THR  41           1HG      THR  41  -1.909  -9.033   2.661
  340   HG21  THR  41          3HG2      THR  41   0.024  -7.771   4.462
  341   HG22  THR  41          1HG2      THR  41  -0.034  -7.541   2.699
  342   HG23  THR  41          2HG2      THR  41  -0.159  -6.135   3.784
  343    H    LEU  42           H        LEU  42  -3.419  -4.710   4.018
  344    HA   LEU  42           HA       LEU  42  -1.221  -2.943   4.604
  345    HB2  LEU  42           1HB      LEU  42  -4.062  -2.609   3.934
  346    HB3  LEU  42           2HB      LEU  42  -3.058  -1.147   4.070
  347    HG   LEU  42           HG       LEU  42  -2.553  -3.428   2.125
  348   HD11  LEU  42          1HD1      LEU  42  -3.368  -1.834   0.367
  349   HD12  LEU  42          2HD1      LEU  42  -4.643  -2.194   1.553
  350   HD13  LEU  42          3HD1      LEU  42  -3.756  -0.653   1.640
  351   HD21  LEU  42          3HD2      LEU  42  -0.544  -2.227   2.755
  352   HD22  LEU  42          1HD2      LEU  42  -0.974  -1.849   1.070
  353   HD23  LEU  42          2HD2      LEU  42  -1.316  -0.672   2.363
  354    H    THR  43           H        THR  43  -4.227  -3.693   6.302
  355    HA   THR  43           HA       THR  43  -3.951  -1.571   8.254
  356    HB   THR  43           HB       THR  43  -5.483  -4.203   8.374
  357    HG1  THR  43           1HG      THR  43  -7.254  -2.772   7.897
  358   HG21  THR  43          3HG2      THR  43  -5.670  -1.716  10.121
  359   HG22  THR  43          1HG2      THR  43  -6.742  -3.132  10.210
  360   HG23  THR  43          2HG2      THR  43  -5.019  -3.294  10.625
  361    H    ARG  44           H        ARG  44  -3.045  -5.011   8.241
  362    HA   ARG  44           HA       ARG  44  -2.077  -5.024  10.957
  363    HB2  ARG  44           1HB      ARG  44  -1.578  -6.813   8.632
  364    HB3  ARG  44           2HB      ARG  44  -0.797  -7.023  10.217
  365    HG2  ARG  44           1HG      ARG  44  -3.006  -7.243  11.276
  366    HG3  ARG  44           2HG      ARG  44  -3.785  -7.038   9.688
  367    HD2  ARG  44           1HD      ARG  44  -2.818  -9.083   8.913
  368    HD3  ARG  44           2HD      ARG  44  -1.929  -9.272  10.442
  369    HE   ARG  44           HE       ARG  44  -4.780  -9.288  11.023
  370   HH11  ARG  44          1HH1      ARG  44  -2.380 -11.281   9.463
  371   HH12  ARG  44          2HH1      ARG  44  -3.292 -12.718   9.884
  372   HH21  ARG  44          1HH2      ARG  44  -5.839 -10.924  11.506
  373   HH22  ARG  44          2HH2      ARG  44  -5.265 -12.516  11.048
  374    H    LEU  45           H        LEU  45  -0.489  -4.421   7.838
  375    HA   LEU  45           HA       LEU  45   2.135  -4.018   8.988
  376    HB2  LEU  45           1HB      LEU  45   0.754  -3.170   6.535
  377    HB3  LEU  45           2HB      LEU  45   2.469  -2.737   6.725
  378    HG   LEU  45           HG       LEU  45   1.347  -5.565   6.650
  379   HD11  LEU  45          1HD1      LEU  45   2.518  -5.713   4.436
  380   HD12  LEU  45          2HD1      LEU  45   1.273  -4.444   4.425
  381   HD13  LEU  45          3HD1      LEU  45   2.989  -4.004   4.588
  382   HD21  LEU  45          3HD2      LEU  45   3.316  -5.388   8.055
  383   HD22  LEU  45          1HD2      LEU  45   3.716  -6.262   6.556
  384   HD23  LEU  45          2HD2      LEU  45   4.206  -4.561   6.754
  385    H    HIS  46           H        HIS  46  -0.624  -1.903   8.374
  386    HA   HIS  46           HA       HIS  46   0.722   0.556   9.027
  387    HB2  HIS  46           1HB      HIS  46  -1.494   0.450   7.861
  388    HB3  HIS  46           2HB      HIS  46  -2.228  -0.141   9.370
  389    HD1  HIS  46           1HD      HIS  46  -0.186   2.881   8.226
  390    HD2  HIS  46           2HD      HIS  46  -3.369   1.960  10.830
  391    HE1  HIS  46           1HE      HIS  46  -0.860   4.999   9.243
  392    H    GLN  47           H        GLN  47  -1.049  -1.807  11.001
  393    HA   GLN  47           HA       GLN  47  -0.726  -0.360  13.478
  394    HB2  GLN  47           1HB      GLN  47  -1.141  -3.279  12.820
  395    HB3  GLN  47           2HB      GLN  47  -1.049  -2.655  14.483
  396    HG2  GLN  47           1HG      GLN  47  -3.247  -1.204  13.895
  397    HG3  GLN  47           2HG      GLN  47  -2.857  -1.965  12.335
  398   HE21  GLN  47          2HE2      GLN  47  -5.368  -2.142  13.645
  399   HE22  GLN  47          1HE2      GLN  47  -5.630  -3.798  14.082
  400    H    ARG  48           H        ARG  48   1.287  -2.688  11.746
  401    HA   ARG  48           HA       ARG  48   3.279  -2.934  13.830
  402    HB2  ARG  48           1HB      ARG  48   3.378  -3.435  10.894
  403    HB3  ARG  48           2HB      ARG  48   4.762  -3.654  11.992
  404    HG2  ARG  48           1HG      ARG  48   3.581  -5.354  13.235
  405    HG3  ARG  48           2HG      ARG  48   2.093  -5.058  12.303
  406    HD2  ARG  48           1HD      ARG  48   3.198  -5.860  10.301
  407    HD3  ARG  48           2HD      ARG  48   4.671  -6.174  11.246
  408    HE   ARG  48           HE       ARG  48   2.610  -7.788  12.423
  409   HH11  ARG  48          1HH1      ARG  48   4.127  -7.525   9.294
  410   HH12  ARG  48          2HH1      ARG  48   3.867  -9.237   9.018
  411   HH21  ARG  48          1HH2      ARG  48   2.298  -9.747  12.118
  412   HH22  ARG  48          2HH2      ARG  48   2.823 -10.505  10.626
  413    H    GLY  49           H        GLY  49   2.666  -0.570  11.321
  414    HA2  GLY  49           1HA      GLY  49   3.494   1.677  11.538
  415    HA3  GLY  49           2HA      GLY  49   4.886   1.058  12.456
  416    H    VAL  50           H        VAL  50   3.920  -0.709   9.646
  417    HA   VAL  50           HA       VAL  50   6.479   0.025   8.303
  418    HB   VAL  50           HB       VAL  50   4.363  -2.055   7.604
  419   HG11  VAL  50          1HG1      VAL  50   6.095  -2.933   6.074
  420   HG12  VAL  50          2HG1      VAL  50   5.648  -1.265   5.645
  421   HG13  VAL  50          3HG1      VAL  50   7.169  -1.585   6.514
  422   HG21  VAL  50          3HG2      VAL  50   5.458  -2.578   9.702
  423   HG22  VAL  50          1HG2      VAL  50   5.985  -3.692   8.418
  424   HG23  VAL  50          2HG2      VAL  50   7.055  -2.371   8.943
  425    H    ILE  51           H        ILE  51   3.042  -0.203   7.360
  426    HA   ILE  51           HA       ILE  51   3.656   1.807   5.209
  427    HB   ILE  51           HB       ILE  51   1.380  -0.216   5.452
  428   HG12  ILE  51          1HG1      ILE  51   3.655  -0.086   3.489
  429   HG13  ILE  51          2HG1      ILE  51   3.575  -1.160   4.905
  430   HG21  ILE  51          1HG2      ILE  51   0.748   0.564   3.193
  431   HG22  ILE  51          2HG2      ILE  51   0.663   1.890   4.375
  432   HG23  ILE  51          3HG2      ILE  51   2.040   1.786   3.252
  433   HD11  ILE  51          3HD1      ILE  51   1.644  -1.166   2.560
  434   HD12  ILE  51          1HD1      ILE  51   2.936  -2.355   2.848
  435   HD13  ILE  51          2HD1      ILE  51   1.564  -2.238   3.977
  436    H    TYR  52           H        TYR  52   2.791   3.707   5.142
  437    HA   TYR  52           HA       TYR  52   0.475   4.235   6.978
  438    HB2  TYR  52           1HB      TYR  52   2.658   6.134   6.097
  439    HB3  TYR  52           2HB      TYR  52   1.255   6.539   7.114
  440    HD1  TYR  52           1HD      TYR  52   4.483   4.744   7.005
  441    HD2  TYR  52           2HD      TYR  52   1.204   5.937   9.454
  442    HE1  TYR  52           1HE      TYR  52   5.775   4.117   9.024
  443    HE2  TYR  52           2HE      TYR  52   2.477   5.318  11.480
  444    HH   TYR  52           HH       TYR  52   5.777   3.964  11.291
  445    H    ARG  53           H        ARG  53  -0.890   6.068   6.302
  446    HA   ARG  53           HA       ARG  53  -1.212   6.145   3.339
  447    HB2  ARG  53           1HB      ARG  53  -3.445   5.451   3.371
  448    HB3  ARG  53           2HB      ARG  53  -2.382   4.179   4.023
  449    HG2  ARG  53           1HG      ARG  53  -3.069   4.848   6.320
  450    HG3  ARG  53           2HG      ARG  53  -4.207   6.014   5.607
  451    HD2  ARG  53           1HD      ARG  53  -5.370   4.170   4.517
  452    HD3  ARG  53           2HD      ARG  53  -4.261   3.029   5.314
  453    HE   ARG  53           HE       ARG  53  -5.666   4.557   7.361
  454   HH11  ARG  53          1HH1      ARG  53  -6.292   2.086   4.980
  455   HH12  ARG  53          2HH1      ARG  53  -7.571   1.433   5.986
  456   HH21  ARG  53          1HH2      ARG  53  -7.132   3.825   8.519
  457   HH22  ARG  53          2HH2      ARG  53  -8.052   2.424   8.004
  458    H    LYS  54           H        LYS  54  -2.299   7.867   2.530
  459    HA   LYS  54           HA       LYS  54  -3.562   9.713   4.532
  460    HB2  LYS  54           1HB      LYS  54  -1.960  10.368   2.058
  461    HB3  LYS  54           2HB      LYS  54  -3.001  11.534   2.907
  462    HG2  LYS  54           1HG      LYS  54  -1.627  11.182   4.965
  463    HG3  LYS  54           2HG      LYS  54  -0.542  10.138   4.016
  464    HD2  LYS  54           1HD      LYS  54  -0.031  12.009   2.515
  465    HD3  LYS  54           2HD      LYS  54  -1.146  13.057   3.427
  466    HE2  LYS  54           1HE      LYS  54   0.238  12.740   5.449
  467    HE3  LYS  54           2HE      LYS  54   1.365  11.738   4.507
  468    HZ1  LYS  54           3HZ      LYS  54   0.759  14.581   3.997
  469    HZ2  LYS  54           1HZ      LYS  54   2.136  14.005   4.701
  470    HZ3  LYS  54           2HZ      LYS  54   1.806  13.654   3.123
  471    H    TRP  55           H        TRP  55  -5.239  11.104   3.643
  472    HA   TRP  55           HA       TRP  55  -6.918   9.427   1.810
  473    HB2  TRP  55           1HB      TRP  55  -7.646  11.231   4.152
  474    HB3  TRP  55           2HB      TRP  55  -8.842  10.602   2.995
  475    HD1  TRP  55           HD       TRP  55  -9.623   8.301   3.275
  476    HE1  TRP  55           1HE      TRP  55  -9.260   6.343   5.104
  477    HE3  TRP  55           3HE      TRP  55  -5.660  10.321   5.736
  478    HZ2  TRP  55           2HZ      TRP  55  -7.503   5.901   7.190
  479    HZ3  TRP  55           3HZ      TRP  55  -4.667   9.152   7.606
  480    HH2  TRP  55           HH       TRP  55  -5.523   6.978   8.366
  481    H    ARG  56           H        ARG  56  -7.207  10.163  -0.126
  482    HA   ARG  56           HA       ARG  56  -7.042  13.113  -0.587
  483    HB2  ARG  56           1HB      ARG  56  -5.528  11.827  -1.881
  484    HB3  ARG  56           2HB      ARG  56  -6.866  10.842  -2.517
  485    HG2  ARG  56           1HG      ARG  56  -7.828  12.914  -3.532
  486    HG3  ARG  56           2HG      ARG  56  -6.374  13.794  -3.005
  487    HD2  ARG  56           1HD      ARG  56  -6.449  11.473  -4.906
  488    HD3  ARG  56           2HD      ARG  56  -6.295  13.190  -5.343
  489    HE   ARG  56           HE       ARG  56  -4.051  11.524  -4.326
  490   HH11  ARG  56          1HH1      ARG  56  -5.213  14.762  -4.900
  491   HH12  ARG  56          2HH1      ARG  56  -3.569  15.368  -4.843
  492   HH21  ARG  56          1HH2      ARG  56  -2.163  12.203  -4.266
  493   HH22  ARG  56          2HH2      ARG  56  -1.830  13.911  -4.483
  494    H    HIS  57           H        HIS  57  -8.654  14.305  -1.335
  495    HA   HIS  57           HA       HIS  57 -11.219  12.883  -1.967
  496    HB2  HIS  57           1HB      HIS  57 -10.834  15.670  -0.783
  497    HB3  HIS  57           2HB      HIS  57 -12.393  14.911  -1.185
  498    HD2  HIS  57           2HD      HIS  57  -9.920  15.112   1.840
  499    HE1  HIS  57           1HE      HIS  57 -12.783  12.065   2.588
  500    HE2  HIS  57           2HE      HIS  57 -10.857  13.562   3.565
  501    H    PHE  58           H        PHE  58 -10.433  12.649  -4.134
  502    HA   PHE  58           HA       PHE  58 -10.154  15.206  -5.650
  503    HB2  PHE  58           1HB      PHE  58  -8.341  13.555  -5.946
  504    HB3  PHE  58           2HB      PHE  58  -9.526  12.331  -6.449
  505    HD1  PHE  58           1HD      PHE  58  -8.238  15.707  -7.352
  506    HD2  PHE  58           2HD      PHE  58 -10.034  12.059  -8.664
  507    HE1  PHE  58           1HE      PHE  58  -7.988  16.432  -9.702
  508    HE2  PHE  58           2HE      PHE  58  -9.782  12.779 -11.016
  509    HZ   PHE  58           HZ       PHE  58  -8.760  14.967 -11.534
  510    H    SER  59           H        SER  59 -11.753  16.015  -6.725
  511    HA   SER  59           HA       SER  59 -13.773  16.154  -7.987
  512    HB2  SER  59           1HB      SER  59 -13.023  13.390  -8.730
  513    HB3  SER  59           2HB      SER  59 -14.267  14.418  -9.479
  514    HG   SER  59           HG       SER  59 -12.593  15.912  -9.960
  515    H    GLY  60           H        GLY  60 -13.817  15.268  -5.120
  516    HA2  GLY  60           1HA      GLY  60 -15.594  14.827  -3.686
  517    HA3  GLY  60           2HA      GLY  60 -16.630  14.538  -5.102
  518    H    ARG  61           H        ARG  61 -13.686  12.797  -5.117
  519    HA   ARG  61           HA       ARG  61 -15.105  10.339  -4.134
  520    HB2  ARG  61           1HB      ARG  61 -13.099  10.582  -6.330
  521    HB3  ARG  61           2HB      ARG  61 -13.672   9.059  -5.612
  522    HG2  ARG  61           1HG      ARG  61 -15.964   9.582  -6.338
  523    HG3  ARG  61           2HG      ARG  61 -15.385  11.103  -7.061
  524    HD2  ARG  61           1HD      ARG  61 -14.028   9.854  -8.615
  525    HD3  ARG  61           2HD      ARG  61 -14.583   8.329  -7.884
  526    HE   ARG  61           HE       ARG  61 -16.921   9.686  -8.897
  527   HH11  ARG  61          1HH1      ARG  61 -13.999   8.280 -10.180
  528   HH12  ARG  61          2HH1      ARG  61 -14.837   7.881 -11.668
  529   HH21  ARG  61          1HH2      ARG  61 -17.891   9.246 -10.598
  530   HH22  ARG  61          2HH2      ARG  61 -17.056   8.433 -11.908
  531    H    LYS  62           H        LYS  62 -14.083   8.925  -2.834
  532    HA   LYS  62           HA       LYS  62 -11.757  10.076  -1.386
  533    HB2  LYS  62           1HB      LYS  62 -13.611   7.761  -0.806
  534    HB3  LYS  62           2HB      LYS  62 -12.226   8.226   0.210
  535    HG2  LYS  62           1HG      LYS  62 -13.257  10.414   0.635
  536    HG3  LYS  62           2HG      LYS  62 -14.633   9.973  -0.405
  537    HD2  LYS  62           1HD      LYS  62 -15.183   8.110   1.109
  538    HD3  LYS  62           2HD      LYS  62 -13.807   8.551   2.148
  539    HE2  LYS  62           1HE      LYS  62 -14.821  10.742   2.579
  540    HE3  LYS  62           2HE      LYS  62 -16.189  10.322   1.522
  541    HZ1  LYS  62           3HZ      LYS  62 -15.465   8.932   4.021
  542    HZ2  LYS  62           1HZ      LYS  62 -16.720   9.987   3.839
  543    HZ3  LYS  62           2HZ      LYS  62 -16.735   8.544   3.041
  544    H    TYR  63           H        TYR  63  -9.769   9.454  -1.629
  545    HA   TYR  63           HA       TYR  63  -9.269   6.669  -2.626
  546    HB2  TYR  63           1HB      TYR  63  -7.718   9.173  -3.319
  547    HB3  TYR  63           2HB      TYR  63  -7.313   7.511  -3.809
  548    HD1  TYR  63           2HD      TYR  63  -8.685   6.346  -5.493
  549    HD2  TYR  63           1HD      TYR  63  -9.478  10.400  -4.438
  550    HE1  TYR  63           2HE      TYR  63 -10.090   6.585  -7.513
  551    HE2  TYR  63           1HE      TYR  63 -10.890  10.657  -6.457
  552    HH   TYR  63           HH       TYR  63 -11.404   7.974  -8.751
  553    H    ARG  64           H        ARG  64  -7.592   5.555  -1.774
  554    HA   ARG  64           HA       ARG  64  -6.295   6.827   0.615
  555    HB2  ARG  64           1HB      ARG  64  -7.014   3.971   0.142
  556    HB3  ARG  64           2HB      ARG  64  -5.977   4.568   1.460
  557    HG2  ARG  64           1HG      ARG  64  -7.809   5.851   2.386
  558    HG3  ARG  64           2HG      ARG  64  -8.852   5.421   1.009
  559    HD2  ARG  64           1HD      ARG  64  -8.984   3.185   1.700
  560    HD3  ARG  64           2HD      ARG  64  -7.706   3.415   2.915
  561    HE   ARG  64           HE       ARG  64  -9.447   4.339   4.403
  562   HH11  ARG  64          1HH1      ARG  64 -10.705   4.027   1.166
  563   HH12  ARG  64          2HH1      ARG  64 -12.328   4.305   1.764
  564   HH21  ARG  64          1HH2      ARG  64 -11.300   4.667   5.103
  565   HH22  ARG  64          2HH2      ARG  64 -12.669   4.671   4.008
  566    H    GLU  65           H        GLU  65  -4.334   7.459   0.211
  567    HA   GLU  65           HA       GLU  65  -2.684   5.916  -1.738
  568    HB2  GLU  65           1HB      GLU  65  -2.354   8.622  -0.436
  569    HB3  GLU  65           2HB      GLU  65  -1.126   7.852  -1.470
  570    HG2  GLU  65           1HG      GLU  65  -2.847   7.866  -3.378
  571    HG3  GLU  65           2HG      GLU  65  -3.902   8.679  -2.201
  572    H    TYR  66           H        TYR  66  -1.434   4.387  -1.055
  573    HA   TYR  66           HA       TYR  66  -0.453   4.492   1.770
  574    HB2  TYR  66           1HB      TYR  66  -0.692   2.238  -0.231
  575    HB3  TYR  66           2HB      TYR  66   0.095   2.094   1.360
  576    HD1  TYR  66           1HD      TYR  66  -3.155   2.723  -0.333
  577    HD2  TYR  66           2HD      TYR  66  -1.199   1.797   3.341
  578    HE1  TYR  66           1HE      TYR  66  -5.351   2.229   0.702
  579    HE2  TYR  66           2HE      TYR  66  -3.381   1.301   4.390
  580    HH   TYR  66           HH       TYR  66  -6.416   1.349   2.541
  581    H    CYS  67           H        CYS  67   1.647   4.340   2.323
  582    HA   CYS  67           HA       CYS  67   3.731   4.469   0.157
  583    HB2  CYS  67           1HB      CYS  67   2.661   6.706   0.408
  584    HB3  CYS  67           2HB      CYS  67   3.039   6.673   2.148
  585    HG   CYS  67           HG       CYS  67   4.513   8.353   0.922
  586    H    LEU  68           H        LEU  68   5.745   3.926   0.886
  587    HA   LEU  68           HA       LEU  68   5.999   3.120   3.740
  588    HB2  LEU  68           1HB      LEU  68   7.586   2.773   1.290
  589    HB3  LEU  68           2HB      LEU  68   8.273   2.203   2.829
  590    HG   LEU  68           HG       LEU  68   5.724   1.197   1.504
  591   HD11  LEU  68          1HD1      LEU  68   7.010  -0.940   1.248
  592   HD12  LEU  68          2HD1      LEU  68   7.807   0.400   0.392
  593   HD13  LEU  68          3HD1      LEU  68   8.434  -0.151   1.963
  594   HD21  LEU  68          3HD2      LEU  68   5.531   1.181   3.921
  595   HD22  LEU  68          1HD2      LEU  68   5.685  -0.484   3.313
  596   HD23  LEU  68          2HD2      LEU  68   7.082   0.322   4.067
  597    H    LYS  69           H        LYS  69   6.977   5.595   1.523
  598    HA   LYS  69           HA       LYS  69   9.353   6.446   2.924
  599    HB2  LYS  69           1HB      LYS  69   7.451   7.883   1.070
  600    HB3  LYS  69           2HB      LYS  69   8.958   8.588   1.700
  601    HG2  LYS  69           1HG      LYS  69  10.244   6.779   0.607
  602    HG3  LYS  69           2HG      LYS  69   8.729   6.116  -0.051
  603    HD2  LYS  69           1HD      LYS  69   8.341   8.172  -1.310
  604    HD3  LYS  69           2HD      LYS  69   9.798   8.906  -0.601
  605    HE2  LYS  69           1HE      LYS  69  11.181   7.158  -1.649
  606    HE3  LYS  69           2HE      LYS  69   9.722   6.444  -2.373
  607    HZ1  LYS  69           3HZ      LYS  69  10.754   9.155  -2.912
  608    HZ2  LYS  69           1HZ      LYS  69  10.885   7.859  -3.926
  609    HZ3  LYS  69           2HZ      LYS  69   9.400   8.493  -3.584
  610    H    HIS  70           H        HIS  70   5.982   6.843   3.557
  611    HA   HIS  70           HA       HIS  70   6.109   9.155   5.242
  612    HB2  HIS  70           1HB      HIS  70   4.276   6.723   5.226
  613    HB3  HIS  70           2HB      HIS  70   4.067   8.090   6.346
  614    HD2  HIS  70           2HD      HIS  70   4.913  10.078   3.341
  615    HE1  HIS  70           1HE      HIS  70   0.861   8.935   2.776
  616    HE2  HIS  70           2HE      HIS  70   2.821  10.525   2.044
  617    H    ARG  71           H        ARG  71   7.028   5.815   5.761
  618    HA   ARG  71           HA       ARG  71   7.233   5.926   8.625
  619    HB2  ARG  71           1HB      ARG  71   7.204   3.870   7.372
  620    HB3  ARG  71           2HB      ARG  71   8.811   4.260   6.714
  621    HG2  ARG  71           1HG      ARG  71   9.811   4.121   8.899
  622    HG3  ARG  71           2HG      ARG  71   8.217   3.948   9.669
  623    HD2  ARG  71           1HD      ARG  71   7.926   1.801   8.653
  624    HD3  ARG  71           2HD      ARG  71   9.469   1.976   7.787
  625    HE   ARG  71           HE       ARG  71  10.136   2.045  10.568
  626   HH11  ARG  71          1HH1      ARG  71   8.553  -0.220   8.440
  627   HH12  ARG  71          2HH1      ARG  71   9.149  -1.555   9.407
  628   HH21  ARG  71          1HH2      ARG  71  10.820   0.527  11.690
  629   HH22  ARG  71          2HH2      ARG  71  10.441  -1.130  11.262
  630    H    ASP  72           H        ASP  72   8.646   6.728   9.986
  631    HA   ASP  72           HA       ASP  72  10.388   8.812   9.018
  632    HB2  ASP  72           1HB      ASP  72  10.123   7.553  11.815
  633    HB3  ASP  72           2HB      ASP  72  11.193   8.867  11.267
  634    H    GLU  73           H        GLU  73  10.957   5.491  10.083
  635    HA   GLU  73           HA       GLU  73  13.847   5.749  10.134
  636    HB2  GLU  73           1HB      GLU  73  11.990   3.376   9.951
  637    HB3  GLU  73           2HB      GLU  73  13.763   3.248  10.061
  638    HG2  GLU  73           1HG      GLU  73  13.685   4.351  12.330
  639    HG3  GLU  73           2HG      GLU  73  11.942   4.556  12.041
  640    H    LEU  74           H        LEU  74  11.508   4.659   7.701
  641    HA   LEU  74           HA       LEU  74  13.568   3.959   5.768
  642    HB2  LEU  74           1HB      LEU  74  10.692   4.566   5.648
  643    HB3  LEU  74           2HB      LEU  74  11.517   4.039   4.163
  644    HG   LEU  74           HG       LEU  74  11.172   2.429   6.721
  645   HD11  LEU  74          1HD1      LEU  74   9.781   0.931   5.267
  646   HD12  LEU  74          2HD1      LEU  74   9.111   2.577   5.328
  647   HD13  LEU  74          3HD1      LEU  74  10.034   2.044   3.904
  648   HD21  LEU  74          3HD2      LEU  74  13.323   1.978   5.697
  649   HD22  LEU  74          1HD2      LEU  74  12.242   0.581   5.479
  650   HD23  LEU  74          2HD2      LEU  74  12.546   1.693   4.121
  651    H    ALA  75           H        ALA  75  11.749   6.867   6.539
  652    HA   ALA  75           HA       ALA  75  12.614   8.371   4.245
  653    HB1  ALA  75           1HB      ALA  75  11.973  10.344   5.578
  654    HB2  ALA  75           2HB      ALA  75  10.721   9.079   5.638
  655    HB3  ALA  75           3HB      ALA  75  11.815   9.315   7.020
  656    H    ASP  76           H        ASP  76  14.010   7.794   7.446
  657    HA   ASP  76           HA       ASP  76  16.245   9.609   7.074
  658    HB2  ASP  76           1HB      ASP  76  15.850   7.237   8.994
  659    HB3  ASP  76           2HB      ASP  76  17.269   8.295   8.796
  660    H    LEU  77           H        LEU  77  15.689   6.190   6.373
  661    HA   LEU  77           HA       LEU  77  18.414   5.685   5.514
  662    HB2  LEU  77           1HB      LEU  77  15.789   4.457   5.028
  663    HB3  LEU  77           2HB      LEU  77  17.228   3.673   4.337
  664    HG   LEU  77           HG       LEU  77  16.690   4.125   7.297
  665   HD11  LEU  77          1HD1      LEU  77  16.462   1.629   7.387
  666   HD12  LEU  77          2HD1      LEU  77  15.243   2.350   6.311
  667   HD13  LEU  77          3HD1      LEU  77  16.683   1.562   5.624
  668   HD21  LEU  77          3HD2      LEU  77  19.055   4.225   6.773
  669   HD22  LEU  77          1HD2      LEU  77  18.691   2.721   7.653
  670   HD23  LEU  77          2HD2      LEU  77  18.953   2.681   5.892
  671    H    GLU  78           H        GLU  78  15.503   6.878   3.939
  672    HA   GLU  78           HA       GLU  78  16.582   6.728   1.248
  673    HB2  GLU  78           1HB      GLU  78  14.185   6.848   1.742
  674    HB3  GLU  78           2HB      GLU  78  14.414   8.481   2.417
  675    HG2  GLU  78           1HG      GLU  78  15.155   9.265   0.098
  676    HG3  GLU  78           2HG      GLU  78  14.877   7.579  -0.395
  677    H    HIS  79           H        HIS  79  16.364   9.343   3.661
  678    HA   HIS  79           HA       HIS  79  18.124  10.982   1.873
  679    HB2  HIS  79           1HB      HIS  79  16.235  11.870   4.100
  680    HB3  HIS  79           2HB      HIS  79  17.242  12.942   3.099
  681    HD1  HIS  79           1HD      HIS  79  16.593  13.136   0.552
  682    HD2  HIS  79           2HD      HIS  79  13.752  11.085   2.896
  683    HE1  HIS  79           1HE      HIS  79  14.520  13.142  -0.742
  Start of MODEL   13
    1    H    LYS   3           H        LYS   3   4.738 -13.543  -9.592
    2    HA   LYS   3           HA       LYS   3   4.783 -11.367  -7.774
    3    HB2  LYS   3           1HB      LYS   3   2.445 -11.402  -9.686
    4    HB3  LYS   3           2HB      LYS   3   2.450 -10.558  -8.119
    5    HG2  LYS   3           1HG      LYS   3   4.302  -9.137  -8.878
    6    HG3  LYS   3           2HG      LYS   3   4.330  -9.992 -10.438
    7    HD2  LYS   3           1HD      LYS   3   2.078  -9.222 -10.946
    8    HD3  LYS   3           2HD      LYS   3   1.950  -8.455  -9.345
    9    HE2  LYS   3           1HE      LYS   3   3.693  -6.882  -9.890
   10    HE3  LYS   3           2HE      LYS   3   4.033  -7.721 -11.421
   11    HZ1  LYS   3           3HZ      LYS   3   1.523  -6.322 -10.754
   12    HZ2  LYS   3           1HZ      LYS   3   2.698  -5.755 -11.761
   13    HZ3  LYS   3           2HZ      LYS   3   1.838  -7.100 -12.174
   14    H    ALA   4           H        ALA   4   3.151 -14.148  -9.133
   15    HA   ALA   4           HA       ALA   4   1.361 -14.594  -6.935
   16    HB1  ALA   4           1HB      ALA   4   1.140 -16.866  -7.865
   17    HB2  ALA   4           2HB      ALA   4   1.027 -15.626  -9.137
   18    HB3  ALA   4           3HB      ALA   4   2.527 -16.561  -8.935
   19    H    LYS   5           H        LYS   5   4.726 -15.409  -7.493
   20    HA   LYS   5           HA       LYS   5   4.947 -17.338  -5.343
   21    HB2  LYS   5           1HB      LYS   5   6.965 -15.590  -6.753
   22    HB3  LYS   5           2HB      LYS   5   7.384 -16.798  -5.516
   23    HG2  LYS   5           1HG      LYS   5   6.453 -18.580  -6.933
   24    HG3  LYS   5           2HG      LYS   5   6.021 -17.375  -8.168
   25    HD2  LYS   5           1HD      LYS   5   8.398 -16.788  -8.430
   26    HD3  LYS   5           2HD      LYS   5   8.831 -17.991  -7.192
   27    HE2  LYS   5           1HE      LYS   5   7.913 -19.780  -8.594
   28    HE3  LYS   5           2HE      LYS   5   7.447 -18.586  -9.826
   29    HZ1  LYS   5           3HZ      LYS   5  10.207 -19.167  -8.963
   30    HZ2  LYS   5           1HZ      LYS   5   9.519 -19.666 -10.377
   31    HZ3  LYS   5           2HZ      LYS   5   9.774 -18.058 -10.104
   32    H    LEU   6           H        LEU   6   4.968 -13.853  -5.485
   33    HA   LEU   6           HA       LEU   6   5.949 -13.684  -2.683
   34    HB2  LEU   6           1HB      LEU   6   5.103 -11.675  -4.668
   35    HB3  LEU   6           2HB      LEU   6   5.839 -11.184  -3.124
   36    HG   LEU   6           HG       LEU   6   7.182 -12.705  -5.392
   37   HD11  LEU   6          1HD1      LEU   6   8.639 -10.667  -5.521
   38   HD12  LEU   6          2HD1      LEU   6   6.929 -10.259  -5.798
   39   HD13  LEU   6          3HD1      LEU   6   7.681  -9.919  -4.222
   40   HD21  LEU   6          3HD2      LEU   6   7.953 -13.525  -3.244
   41   HD22  LEU   6          1HD2      LEU   6   9.235 -12.572  -4.024
   42   HD23  LEU   6          2HD2      LEU   6   8.284 -11.865  -2.696
   43    H    SER   7           H        SER   7   4.828 -12.631  -1.035
   44    HA   SER   7           HA       SER   7   1.931 -13.129  -0.932
   45    HB2  SER   7           1HB      SER   7   1.985 -12.450   1.202
   46    HB3  SER   7           2HB      SER   7   3.474 -13.382   0.924
   47    HG   SER   7           HG       SER   7   4.079 -11.588   2.022
   48    H    LEU   8           H        LEU   8   0.389 -11.450  -0.382
   49    HA   LEU   8           HA       LEU   8   0.465  -9.145  -2.109
   50    HB2  LEU   8           1HB      LEU   8  -1.149 -10.272  -0.007
   51    HB3  LEU   8           2HB      LEU   8  -1.459  -8.531  -0.210
   52    HG   LEU   8           HG       LEU   8  -2.138  -8.855  -2.505
   53   HD11  LEU   8          1HD1      LEU   8  -2.218 -11.148  -3.518
   54   HD12  LEU   8          2HD1      LEU   8  -0.556 -10.697  -3.072
   55   HD13  LEU   8          3HD1      LEU   8  -1.484 -11.811  -2.040
   56   HD21  LEU   8          3HD2      LEU   8  -3.853  -9.176  -0.823
   57   HD22  LEU   8          1HD2      LEU   8  -4.144 -10.263  -2.200
   58   HD23  LEU   8          2HD2      LEU   8  -3.444 -10.903  -0.694
   59    H    THR   9           H        THR   9   1.394  -9.664   1.243
   60    HA   THR   9           HA       THR   9   1.795  -6.868   1.869
   61    HB   THR   9           HB       THR   9   3.106  -9.357   3.045
   62    HG1  THR   9           1HG      THR   9   1.500  -8.997   4.688
   63   HG21  THR   9          3HG2      THR   9   2.922  -6.506   4.096
   64   HG22  THR   9          1HG2      THR   9   3.610  -7.896   4.972
   65   HG23  THR   9          2HG2      THR   9   4.395  -7.298   3.490
   66    H    GLN  10           H        GLN  10   3.969  -9.423   0.674
   67    HA   GLN  10           HA       GLN  10   6.306  -7.747   0.599
   68    HB2  GLN  10           1HB      GLN  10   5.499 -10.242  -0.900
   69    HB3  GLN  10           2HB      GLN  10   7.080  -9.451  -1.103
   70    HG2  GLN  10           1HG      GLN  10   7.600 -10.024   1.434
   71    HG3  GLN  10           2HG      GLN  10   5.861 -10.386   1.344
   72   HE21  GLN  10          2HE2      GLN  10   8.325 -11.995   2.098
   73   HE22  GLN  10          1HE2      GLN  10   8.207 -13.434   1.141
   74    H    LEU  11           H        LEU  11   3.754  -8.414  -1.761
   75    HA   LEU  11           HA       LEU  11   5.001  -6.995  -3.936
   76    HB2  LEU  11           1HB      LEU  11   2.249  -7.685  -3.174
   77    HB3  LEU  11           2HB      LEU  11   2.500  -6.868  -4.735
   78    HG   LEU  11           HG       LEU  11   3.657  -9.564  -3.930
   79   HD11  LEU  11          1HD1      LEU  11   2.077 -10.485  -5.647
   80   HD12  LEU  11          2HD1      LEU  11   1.200  -9.657  -4.340
   81   HD13  LEU  11          3HD1      LEU  11   1.432  -8.847  -5.909
   82   HD21  LEU  11          3HD2      LEU  11   5.115  -8.350  -5.439
   83   HD22  LEU  11          1HD2      LEU  11   4.362  -9.717  -6.293
   84   HD23  LEU  11          2HD2      LEU  11   3.764  -8.062  -6.560
   85    H    ILE  12           H        ILE  12   2.716  -5.986  -1.407
   86    HA   ILE  12           HA       ILE  12   2.467  -3.254  -2.291
   87    HB   ILE  12           HB       ILE  12   2.238  -4.556   0.457
   88   HG12  ILE  12          1HG1      ILE  12   0.110  -3.375  -1.301
   89   HG13  ILE  12          2HG1      ILE  12   0.588  -5.089  -1.336
   90   HG21  ILE  12          1HG2      ILE  12   1.243  -2.425   1.215
   91   HG22  ILE  12          2HG2      ILE  12   2.933  -2.197   0.709
   92   HG23  ILE  12          3HG2      ILE  12   1.608  -1.691  -0.365
   93   HD11  ILE  12          3HD1      ILE  12  -0.518  -3.600   1.071
   94   HD12  ILE  12          1HD1      ILE  12  -1.415  -4.754   0.058
   95   HD13  ILE  12          2HD1      ILE  12  -0.038  -5.312   1.037
   96    H    LEU  13           H        LEU  13   4.796  -4.802  -0.107
   97    HA   LEU  13           HA       LEU  13   6.139  -2.369   0.601
   98    HB2  LEU  13           1HB      LEU  13   6.950  -5.189   0.386
   99    HB3  LEU  13           2HB      LEU  13   8.084  -4.027   1.115
  100    HG   LEU  13           HG       LEU  13   5.316  -4.727   2.172
  101   HD11  LEU  13          1HD1      LEU  13   6.577  -5.789   4.063
  102   HD12  LEU  13          2HD1      LEU  13   6.975  -6.557   2.509
  103   HD13  LEU  13          3HD1      LEU  13   8.107  -5.397   3.244
  104   HD21  LEU  13          3HD2      LEU  13   5.913  -2.421   2.629
  105   HD22  LEU  13          1HD2      LEU  13   5.962  -3.372   4.134
  106   HD23  LEU  13          2HD2      LEU  13   7.478  -2.931   3.310
  107    H    ILE  14           H        ILE  14   6.626  -4.651  -2.067
  108    HA   ILE  14           HA       ILE  14   8.903  -3.267  -3.204
  109    HB   ILE  14           HB       ILE  14   6.773  -5.068  -4.436
  110   HG12  ILE  14          1HG1      ILE  14   9.669  -5.632  -3.882
  111   HG13  ILE  14          2HG1      ILE  14   8.352  -5.997  -2.743
  112   HG21  ILE  14          1HG2      ILE  14   8.267  -5.195  -6.402
  113   HG22  ILE  14          2HG2      ILE  14   7.697  -3.532  -6.138
  114   HG23  ILE  14          3HG2      ILE  14   9.348  -3.992  -5.658
  115   HD11  ILE  14          3HD1      ILE  14   8.631  -7.110  -5.557
  116   HD12  ILE  14          1HD1      ILE  14   8.975  -7.990  -4.051
  117   HD13  ILE  14          2HD1      ILE  14   7.311  -7.476  -4.419
  118    H    ARG  15           H        ARG  15   5.410  -2.950  -3.727
  119    HA   ARG  15           HA       ARG  15   5.644  -0.928  -5.760
  120    HB2  ARG  15           1HB      ARG  15   3.647  -2.291  -5.271
  121    HB3  ARG  15           2HB      ARG  15   3.374  -1.245  -3.857
  122    HG2  ARG  15           1HG      ARG  15   2.003  -0.304  -5.495
  123    HG3  ARG  15           2HG      ARG  15   3.468   0.706  -5.547
  124    HD2  ARG  15           1HD      ARG  15   3.322  -1.617  -7.362
  125    HD3  ARG  15           2HD      ARG  15   2.283  -0.213  -7.705
  126    HE   ARG  15           HE       ARG  15   5.066   0.656  -7.424
  127   HH11  ARG  15          1HH1      ARG  15   2.951  -1.003  -9.645
  128   HH12  ARG  15          2HH1      ARG  15   3.926  -0.453 -10.994
  129   HH21  ARG  15          1HH2      ARG  15   6.199   1.286  -8.958
  130   HH22  ARG  15          2HH2      ARG  15   5.779   0.851 -10.603
  131    H    LEU  16           H        LEU  16   5.632  -0.792  -2.238
  132    HA   LEU  16           HA       LEU  16   5.509   2.108  -2.116
  133    HB2  LEU  16           1HB      LEU  16   6.407  -0.045  -0.328
  134    HB3  LEU  16           2HB      LEU  16   6.444   1.626   0.280
  135    HG   LEU  16           HG       LEU  16   3.971   0.095  -0.618
  136   HD11  LEU  16          1HD1      LEU  16   3.334   0.203   1.806
  137   HD12  LEU  16          2HD1      LEU  16   4.861  -0.678   1.579
  138   HD13  LEU  16          3HD1      LEU  16   4.883   1.002   2.163
  139   HD21  LEU  16          3HD2      LEU  16   3.795   2.463  -1.113
  140   HD22  LEU  16          1HD2      LEU  16   2.714   2.043   0.236
  141   HD23  LEU  16          2HD2      LEU  16   4.255   2.875   0.557
  142    H    SER  17           H        SER  17   8.079  -0.246  -2.493
  143    HA   SER  17           HA       SER  17  10.339   1.552  -2.101
  144    HB2  SER  17           1HB      SER  17  10.505  -0.805  -1.978
  145    HB3  SER  17           2HB      SER  17  10.162  -0.917  -3.720
  146    HG   SER  17           HG       SER  17  12.478  -0.662  -2.711
  147    H    ASN  18           H        ASN  18   8.256   0.676  -4.862
  148    HA   ASN  18           HA       ASN  18   9.941   2.228  -6.734
  149    HB2  ASN  18           1HB      ASN  18   7.354   0.642  -7.418
  150    HB3  ASN  18           2HB      ASN  18   8.496   1.695  -8.286
  151   HD21  ASN  18          2HD2      ASN  18   7.747  -1.208  -8.490
  152   HD22  ASN  18          1HD2      ASN  18   9.261  -2.049  -8.462
  153    H    ARG  19           H        ARG  19   7.052   2.636  -4.853
  154    HA   ARG  19           HA       ARG  19   6.645   5.309  -6.118
  155    HB2  ARG  19           1HB      ARG  19   4.495   3.274  -5.737
  156    HB3  ARG  19           2HB      ARG  19   4.248   4.998  -6.100
  157    HG2  ARG  19           1HG      ARG  19   5.803   3.096  -7.874
  158    HG3  ARG  19           2HG      ARG  19   4.073   3.460  -8.084
  159    HD2  ARG  19           1HD      ARG  19   4.648   5.817  -8.387
  160    HD3  ARG  19           2HD      ARG  19   6.369   5.381  -8.278
  161    HE   ARG  19           HE       ARG  19   4.671   4.886 -10.682
  162   HH11  ARG  19          1HH1      ARG  19   7.700   4.264  -9.068
  163   HH12  ARG  19          2HH1      ARG  19   8.407   3.740 -10.584
  164   HH21  ARG  19          1HH2      ARG  19   5.469   4.296 -12.427
  165   HH22  ARG  19          2HH2      ARG  19   7.135   3.759 -12.500
  166    H    GLY  20           H        GLY  20   5.793   6.882  -4.842
  167    HA2  GLY  20           1HA      GLY  20   6.580   6.675  -2.097
  168    HA3  GLY  20           2HA      GLY  20   5.689   8.026  -2.834
  169    H    CYS  21           H        CYS  21   3.416   6.596  -3.724
  170    HA   CYS  21           HA       CYS  21   2.167   5.275  -1.353
  171    HB2  CYS  21           1HB      CYS  21   0.559   7.135  -1.135
  172    HB3  CYS  21           2HB      CYS  21   2.221   7.723  -0.885
  173    HG   CYS  21           HG       CYS  21   0.807   9.511  -2.000
  174    H    GLN  22           H        GLN  22   0.257   4.241  -1.876
  175    HA   GLN  22           HA       GLN  22  -0.770   4.535  -4.662
  176    HB2  GLN  22           1HB      GLN  22  -0.026   1.953  -3.273
  177    HB3  GLN  22           2HB      GLN  22  -1.001   2.059  -4.758
  178    HG2  GLN  22           1HG      GLN  22   1.994   3.023  -4.705
  179    HG3  GLN  22           2HG      GLN  22   1.223   1.442  -4.971
  180   HE21  GLN  22          2HE2      GLN  22   0.905   4.868  -6.011
  181   HE22  GLN  22          1HE2      GLN  22   0.609   4.508  -7.680
  182    H    THR  23           H        THR  23  -2.887   3.705  -5.007
  183    HA   THR  23           HA       THR  23  -4.549   3.814  -2.537
  184    HB   THR  23           HB       THR  23  -6.449   4.078  -4.005
  185    HG1  THR  23           1HG      THR  23  -5.768   4.167  -6.406
  186   HG21  THR  23          3HG2      THR  23  -4.106   5.703  -5.071
  187   HG22  THR  23          1HG2      THR  23  -5.828   6.113  -5.259
  188   HG23  THR  23          2HG2      THR  23  -5.085   6.106  -3.641
  189    H    LEU  24           H        LEU  24  -6.503   2.356  -2.546
  190    HA   LEU  24           HA       LEU  24  -5.667  -0.399  -2.543
  191    HB2  LEU  24           1HB      LEU  24  -8.221   1.042  -2.464
  192    HB3  LEU  24           2HB      LEU  24  -8.283  -0.734  -2.370
  193    HG   LEU  24           HG       LEU  24  -6.867   1.109  -0.403
  194   HD11  LEU  24          1HD1      LEU  24  -8.659   0.379   1.194
  195   HD12  LEU  24          2HD1      LEU  24  -9.351   1.218  -0.213
  196   HD13  LEU  24          3HD1      LEU  24  -9.421  -0.558  -0.112
  197   HD21  LEU  24          3HD2      LEU  24  -5.741  -1.026  -0.635
  198   HD22  LEU  24          1HD2      LEU  24  -6.552  -0.936   0.947
  199   HD23  LEU  24          2HD2      LEU  24  -7.270  -1.895  -0.371
  200    H    GLU  25           H        GLU  25  -7.343   1.603  -4.913
  201    HA   GLU  25           HA       GLU  25  -7.993  -0.589  -6.695
  202    HB2  GLU  25           1HB      GLU  25  -9.119   1.590  -6.740
  203    HB3  GLU  25           2HB      GLU  25  -7.597   2.354  -7.255
  204    HG2  GLU  25           1HG      GLU  25  -7.689   1.004  -9.402
  205    HG3  GLU  25           2HG      GLU  25  -9.156   0.266  -8.720
  206    H    GLU  26           H        GLU  26  -5.268   1.686  -6.490
  207    HA   GLU  26           HA       GLU  26  -3.978   0.718  -8.891
  208    HB2  GLU  26           1HB      GLU  26  -2.974   2.206  -6.465
  209    HB3  GLU  26           2HB      GLU  26  -1.958   1.810  -7.873
  210    HG2  GLU  26           1HG      GLU  26  -3.277   3.304  -9.319
  211    HG3  GLU  26           2HG      GLU  26  -4.519   3.325  -8.047
  212    H    LEU  27           H        LEU  27  -3.654  -0.107  -5.453
  213    HA   LEU  27           HA       LEU  27  -1.571  -2.076  -5.913
  214    HB2  LEU  27           1HB      LEU  27  -3.547  -1.545  -3.804
  215    HB3  LEU  27           2HB      LEU  27  -2.384  -2.866  -3.551
  216    HG   LEU  27           HG       LEU  27  -1.695   0.073  -3.929
  217   HD11  LEU  27          1HD1      LEU  27  -0.985  -0.038  -1.526
  218   HD12  LEU  27          2HD1      LEU  27  -2.716  -0.406  -1.707
  219   HD13  LEU  27          3HD1      LEU  27  -1.547  -1.724  -1.455
  220   HD21  LEU  27          3HD2      LEU  27   0.009  -1.389  -4.846
  221   HD22  LEU  27          1HD2      LEU  27   0.607  -0.618  -3.358
  222   HD23  LEU  27          2HD2      LEU  27   0.072  -2.314  -3.327
  223    H    GLU  28           H        GLU  28  -5.096  -2.167  -5.846
  224    HA   GLU  28           HA       GLU  28  -5.457  -4.982  -5.966
  225    HB2  GLU  28           1HB      GLU  28  -7.285  -3.414  -5.686
  226    HB3  GLU  28           2HB      GLU  28  -6.994  -2.758  -7.315
  227    HG2  GLU  28           1HG      GLU  28  -7.604  -5.078  -8.256
  228    HG3  GLU  28           2HG      GLU  28  -7.914  -5.497  -6.556
  229    H    GLU  29           H        GLU  29  -4.891  -2.659  -8.609
  230    HA   GLU  29           HA       GLU  29  -4.973  -4.725 -10.655
  231    HB2  GLU  29           1HB      GLU  29  -3.933  -1.891 -10.629
  232    HB3  GLU  29           2HB      GLU  29  -3.955  -2.935 -12.070
  233    HG2  GLU  29           1HG      GLU  29  -6.479  -3.024 -11.942
  234    HG3  GLU  29           2HG      GLU  29  -6.313  -2.088 -10.439
  235    H    PHE  30           H        PHE  30  -2.420  -3.185  -8.765
  236    HA   PHE  30           HA       PHE  30  -0.214  -4.260 -10.265
  237    HB2  PHE  30           1HB      PHE  30   0.092  -2.406  -8.679
  238    HB3  PHE  30           2HB      PHE  30  -0.401  -3.454  -7.329
  239    HD1  PHE  30           1HD      PHE  30   2.148  -3.152 -10.027
  240    HD2  PHE  30           2HD      PHE  30   1.170  -4.613  -6.134
  241    HE1  PHE  30           1HE      PHE  30   4.504  -3.823  -9.689
  242    HE2  PHE  30           2HE      PHE  30   3.525  -5.284  -5.792
  243    HZ   PHE  30           HZ       PHE  30   5.192  -4.889  -7.571
  244    H    THR  31           H        THR  31  -1.953  -5.473  -7.400
  245    HA   THR  31           HA       THR  31  -0.253  -7.909  -7.432
  246    HB   THR  31           HB       THR  31  -1.338  -8.471  -5.322
  247    HG1  THR  31           1HG      THR  31  -2.938  -6.146  -5.796
  248   HG21  THR  31          3HG2      THR  31  -0.622  -5.514  -5.427
  249   HG22  THR  31          1HG2      THR  31  -0.669  -6.521  -3.961
  250   HG23  THR  31          2HG2      THR  31   0.531  -6.856  -5.233
  251    H    GLN  32           H        GLN  32  -3.164  -6.851  -8.771
  252    HA   GLN  32           HA       GLN  32  -5.076  -7.927  -9.539
  253    HB2  GLN  32           1HB      GLN  32  -3.045 -10.152  -9.811
  254    HB3  GLN  32           2HB      GLN  32  -4.694 -10.207 -10.476
  255    HG2  GLN  32           1HG      GLN  32  -2.550  -8.138 -11.490
  256    HG3  GLN  32           2HG      GLN  32  -3.050  -9.771 -11.986
  257   HE21  GLN  32          2HE2      GLN  32  -3.700  -6.407 -12.136
  258   HE22  GLN  32          1HE2      GLN  32  -5.185  -6.490 -13.023
  259    H    ALA  33           H        ALA  33  -5.390  -7.705  -7.004
  260    HA   ALA  33           HA       ALA  33  -6.511 -10.278  -6.114
  261    HB1  ALA  33           1HB      ALA  33  -5.306 -10.235  -3.965
  262    HB2  ALA  33           2HB      ALA  33  -4.189 -10.429  -5.338
  263    HB3  ALA  33           3HB      ALA  33  -4.347  -8.850  -4.532
  264    H    LYS  34           H        LYS  34  -7.789 -10.096  -4.156
  265    HA   LYS  34           HA       LYS  34  -9.629  -7.944  -4.370
  266    HB2  LYS  34           1HB      LYS  34 -10.104 -10.148  -3.374
  267    HB3  LYS  34           2HB      LYS  34  -9.079  -9.717  -1.985
  268    HG2  LYS  34           1HG      LYS  34 -11.422  -9.421  -1.398
  269    HG3  LYS  34           2HG      LYS  34 -10.608  -7.840  -1.465
  270    HD2  LYS  34           1HD      LYS  34 -11.498  -7.489  -3.744
  271    HD3  LYS  34           2HD      LYS  34 -12.335  -9.056  -3.647
  272    HE2  LYS  34           1HE      LYS  34 -13.651  -8.260  -1.747
  273    HE3  LYS  34           2HE      LYS  34 -12.790  -6.705  -1.785
  274    HZ1  LYS  34           3HZ      LYS  34 -14.504  -7.768  -3.939
  275    HZ2  LYS  34           1HZ      LYS  34 -14.919  -6.569  -2.885
  276    HZ3  LYS  34           2HZ      LYS  34 -13.705  -6.326  -3.975
  277    H    ARG  35           H        ARG  35  -9.676  -5.947  -3.730
  278    HA   ARG  35           HA       ARG  35  -7.372  -4.762  -2.458
  279    HB2  ARG  35           1HB      ARG  35  -8.446  -2.724  -2.569
  280    HB3  ARG  35           2HB      ARG  35  -8.756  -3.613  -4.078
  281    HG2  ARG  35           1HG      ARG  35 -11.017  -4.104  -3.392
  282    HG3  ARG  35           2HG      ARG  35 -10.724  -3.405  -1.781
  283    HD2  ARG  35           1HD      ARG  35 -12.021  -1.910  -3.094
  284    HD3  ARG  35           2HD      ARG  35 -10.403  -1.223  -2.828
  285    HE   ARG  35           HE       ARG  35 -10.418  -2.420  -5.462
  286   HH11  ARG  35          1HH1      ARG  35 -11.972   0.220  -3.800
  287   HH12  ARG  35          2HH1      ARG  35 -12.090   1.108  -5.306
  288   HH21  ARG  35          1HH2      ARG  35 -10.553  -1.421  -7.197
  289   HH22  ARG  35          2HH2      ARG  35 -11.281   0.173  -7.246
  290    H    GLU  36           H        GLU  36 -10.356  -6.086  -1.244
  291    HA   GLU  36           HA       GLU  36 -10.289  -4.913   1.374
  292    HB2  GLU  36           1HB      GLU  36 -12.192  -6.159   0.433
  293    HB3  GLU  36           2HB      GLU  36 -11.227  -7.654   0.513
  294    HG2  GLU  36           1HG      GLU  36 -11.151  -7.413   3.046
  295    HG3  GLU  36           2HG      GLU  36 -12.077  -5.915   2.793
  296    H    VAL  37           H        VAL  37  -8.872  -7.945   0.137
  297    HA   VAL  37           HA       VAL  37  -7.527  -8.627   2.614
  298    HB   VAL  37           HB       VAL  37  -6.908  -9.359  -0.278
  299   HG11  VAL  37          1HG1      VAL  37  -5.524 -11.160   0.700
  300   HG12  VAL  37          2HG1      VAL  37  -4.911  -9.557   1.166
  301   HG13  VAL  37          3HG1      VAL  37  -5.848 -10.524   2.329
  302   HG21  VAL  37          3HG2      VAL  37  -9.076 -10.153   0.455
  303   HG22  VAL  37          1HG2      VAL  37  -7.931 -11.504   0.288
  304   HG23  VAL  37          2HG2      VAL  37  -8.342 -10.880   1.904
  305    H    LEU  38           H        LEU  38  -6.520  -6.740  -0.214
  306    HA   LEU  38           HA       LEU  38  -3.858  -6.226   0.691
  307    HB2  LEU  38           1HB      LEU  38  -5.829  -4.725  -0.892
  308    HB3  LEU  38           2HB      LEU  38  -4.175  -4.081  -0.769
  309    HG   LEU  38           HG       LEU  38  -4.944  -6.775  -1.957
  310   HD11  LEU  38          1HD1      LEU  38  -4.297  -5.733  -4.146
  311   HD12  LEU  38          2HD1      LEU  38  -5.658  -4.867  -3.394
  312   HD13  LEU  38          3HD1      LEU  38  -4.015  -4.189  -3.309
  313   HD21  LEU  38          3HD2      LEU  38  -2.744  -6.796  -0.938
  314   HD22  LEU  38          1HD2      LEU  38  -2.592  -6.855  -2.711
  315   HD23  LEU  38          2HD2      LEU  38  -2.279  -5.334  -1.839
  316    H    LEU  39           H        LEU  39  -6.902  -4.494   1.305
  317    HA   LEU  39           HA       LEU  39  -5.820  -2.379   2.857
  318    HB2  LEU  39           1HB      LEU  39  -8.069  -2.786   1.973
  319    HB3  LEU  39           2HB      LEU  39  -8.502  -3.746   3.407
  320    HG   LEU  39           HG       LEU  39  -7.596  -0.840   3.386
  321   HD11  LEU  39          1HD1      LEU  39  -9.933  -0.378   4.174
  322   HD12  LEU  39          2HD1      LEU  39  -9.932  -1.161   2.575
  323   HD13  LEU  39          3HD1      LEU  39 -10.307  -2.111   4.033
  324   HD21  LEU  39          3HD2      LEU  39  -6.805  -2.003   5.361
  325   HD22  LEU  39          1HD2      LEU  39  -8.109  -0.874   5.803
  326   HD23  LEU  39          2HD2      LEU  39  -8.441  -2.619   5.690
  327    H    VAL  40           H        VAL  40  -6.753  -5.665   3.821
  328    HA   VAL  40           HA       VAL  40  -6.297  -5.344   6.644
  329    HB   VAL  40           HB       VAL  40  -6.032  -7.782   4.837
  330   HG11  VAL  40          1HG1      VAL  40  -6.116  -9.094   6.931
  331   HG12  VAL  40          2HG1      VAL  40  -4.682  -8.040   6.893
  332   HG13  VAL  40          3HG1      VAL  40  -6.095  -7.586   7.877
  333   HG21  VAL  40          3HG2      VAL  40  -8.276  -6.873   4.908
  334   HG22  VAL  40          1HG2      VAL  40  -8.192  -8.418   5.783
  335   HG23  VAL  40          2HG2      VAL  40  -8.246  -6.887   6.688
  336    H    THR  41           H        THR  41  -4.078  -6.320   4.043
  337    HA   THR  41           HA       THR  41  -1.861  -6.640   5.920
  338    HB   THR  41           HB       THR  41  -0.476  -6.899   3.895
  339    HG1  THR  41           1HG      THR  41  -2.889  -6.265   2.496
  340   HG21  THR  41          3HG2      THR  41  -3.141  -8.358   3.689
  341   HG22  THR  41          1HG2      THR  41  -1.614  -8.870   2.933
  342   HG23  THR  41          2HG2      THR  41  -1.764  -8.846   4.707
  343    H    LEU  42           H        LEU  42  -3.176  -4.027   4.019
  344    HA   LEU  42           HA       LEU  42  -0.900  -2.261   4.342
  345    HB2  LEU  42           1HB      LEU  42  -3.782  -1.946   3.872
  346    HB3  LEU  42           2HB      LEU  42  -2.785  -0.474   3.926
  347    HG   LEU  42           HG       LEU  42  -2.385  -2.771   1.972
  348   HD11  LEU  42          1HD1      LEU  42  -3.338  -1.207   0.258
  349   HD12  LEU  42          2HD1      LEU  42  -4.527  -1.572   1.532
  350   HD13  LEU  42          3HD1      LEU  42  -3.657  -0.018   1.542
  351   HD21  LEU  42          3HD2      LEU  42  -0.355  -1.535   2.455
  352   HD22  LEU  42          1HD2      LEU  42  -0.903  -1.181   0.798
  353   HD23  LEU  42          2HD2      LEU  42  -1.173   0.004   2.099
  354    H    THR  43           H        THR  43  -3.839  -2.871   6.237
  355    HA   THR  43           HA       THR  43  -3.218  -0.914   8.278
  356    HB   THR  43           HB       THR  43  -4.902  -3.449   8.407
  357    HG1  THR  43           1HG      THR  43  -6.613  -1.971   8.101
  358   HG21  THR  43          3HG2      THR  43  -4.753  -1.061  10.288
  359   HG22  THR  43          1HG2      THR  43  -5.901  -2.414  10.414
  360   HG23  THR  43          2HG2      THR  43  -4.158  -2.701  10.641
  361    H    ARG  44           H        ARG  44  -2.437  -4.342   7.850
  362    HA   ARG  44           HA       ARG  44  -1.185  -4.737  10.392
  363    HB2  ARG  44           1HB      ARG  44  -0.764  -6.041   7.748
  364    HB3  ARG  44           2HB      ARG  44   0.129  -6.481   9.223
  365    HG2  ARG  44           1HG      ARG  44  -1.935  -7.105  10.335
  366    HG3  ARG  44           2HG      ARG  44  -2.890  -6.550   8.939
  367    HD2  ARG  44           1HD      ARG  44  -1.915  -8.287   7.576
  368    HD3  ARG  44           2HD      ARG  44  -0.946  -8.837   8.963
  369    HE   ARG  44           HE       ARG  44  -3.726  -9.084   9.709
  370   HH11  ARG  44          1HH1      ARG  44  -1.543 -10.475   7.374
  371   HH12  ARG  44          2HH1      ARG  44  -2.449 -11.975   7.411
  372   HH21  ARG  44          1HH2      ARG  44  -4.780 -10.792   9.757
  373   HH22  ARG  44          2HH2      ARG  44  -4.296 -12.156   8.769
  374    H    LEU  45           H        LEU  45   0.151  -3.594   7.293
  375    HA   LEU  45           HA       LEU  45   2.807  -3.170   8.376
  376    HB2  LEU  45           1HB      LEU  45   1.280  -2.181   6.068
  377    HB3  LEU  45           2HB      LEU  45   2.973  -1.661   6.237
  378    HG   LEU  45           HG       LEU  45   2.000  -4.525   5.906
  379   HD11  LEU  45          1HD1      LEU  45   3.146  -4.390   3.678
  380   HD12  LEU  45          2HD1      LEU  45   1.842  -3.186   3.809
  381   HD13  LEU  45          3HD1      LEU  45   3.539  -2.686   4.002
  382   HD21  LEU  45          3HD2      LEU  45   3.977  -4.402   7.303
  383   HD22  LEU  45          1HD2      LEU  45   4.396  -5.097   5.719
  384   HD23  LEU  45          2HD2      LEU  45   4.810  -3.404   6.087
  385    H    HIS  46           H        HIS  46  -0.089  -1.175   8.081
  386    HA   HIS  46           HA       HIS  46   1.053   1.310   8.874
  387    HB2  HIS  46           1HB      HIS  46  -1.229   1.263   8.062
  388    HB3  HIS  46           2HB      HIS  46  -1.720   0.137   9.350
  389    HD1  HIS  46           1HD      HIS  46  -0.360   3.689   9.018
  390    HD2  HIS  46           2HD      HIS  46  -2.910   1.456  11.524
  391    HE1  HIS  46           1HE      HIS  46  -1.212   5.259  10.686
  392    H    GLN  47           H        GLN  47  -0.225  -1.361  10.850
  393    HA   GLN  47           HA       GLN  47   0.289  -0.016  13.362
  394    HB2  GLN  47           1HB      GLN  47  -0.094  -2.922  12.620
  395    HB3  GLN  47           2HB      GLN  47   0.093  -2.338  14.291
  396    HG2  GLN  47           1HG      GLN  47  -2.191  -0.939  13.870
  397    HG3  GLN  47           2HG      GLN  47  -1.896  -1.703  12.291
  398   HE21  GLN  47          2HE2      GLN  47  -4.306  -2.005  13.641
  399   HE22  GLN  47          1HE2      GLN  47  -4.463  -3.647  14.170
  400    H    ARG  48           H        ARG  48   2.269  -1.772  11.136
  401    HA   ARG  48           HA       ARG  48   4.402  -2.232  13.128
  402    HB2  ARG  48           1HB      ARG  48   4.278  -2.708  10.186
  403    HB3  ARG  48           2HB      ARG  48   5.709  -2.990  11.208
  404    HG2  ARG  48           1HG      ARG  48   4.515  -4.662  12.496
  405    HG3  ARG  48           2HG      ARG  48   3.013  -4.321  11.602
  406    HD2  ARG  48           1HD      ARG  48   4.058  -5.130   9.567
  407    HD3  ARG  48           2HD      ARG  48   5.536  -5.501  10.485
  408    HE   ARG  48           HE       ARG  48   3.442  -7.061  11.679
  409   HH11  ARG  48          1HH1      ARG  48   4.927  -6.818   8.533
  410   HH12  ARG  48          2HH1      ARG  48   4.610  -8.518   8.245
  411   HH21  ARG  48          1HH2      ARG  48   3.066  -9.006  11.360
  412   HH22  ARG  48          2HH2      ARG  48   3.548  -9.765   9.858
  413    H    GLY  49           H        GLY  49   3.286   0.410  11.446
  414    HA2  GLY  49           1HA      GLY  49   4.194   2.566  11.496
  415    HA3  GLY  49           2HA      GLY  49   5.715   1.897  12.131
  416    H    VAL  50           H        VAL  50   4.270   0.474   9.302
  417    HA   VAL  50           HA       VAL  50   6.547   1.494   7.637
  418    HB   VAL  50           HB       VAL  50   4.531  -0.740   7.153
  419   HG11  VAL  50          1HG1      VAL  50   5.967  -1.293   5.217
  420   HG12  VAL  50          2HG1      VAL  50   5.282   0.342   5.061
  421   HG13  VAL  50          3HG1      VAL  50   6.977   0.131   5.561
  422   HG21  VAL  50          3HG2      VAL  50   6.096  -1.298   8.916
  423   HG22  VAL  50          1HG2      VAL  50   6.438  -2.241   7.446
  424   HG23  VAL  50          2HG2      VAL  50   7.464  -0.850   7.869
  425    H    ILE  51           H        ILE  51   3.036   1.532   7.841
  426    HA   ILE  51           HA       ILE  51   3.022   3.405   5.488
  427    HB   ILE  51           HB       ILE  51   1.000   1.204   6.116
  428   HG12  ILE  51          1HG1      ILE  51   2.888   1.492   3.792
  429   HG13  ILE  51          2HG1      ILE  51   3.097   0.391   5.173
  430   HG21  ILE  51          1HG2      ILE  51  -0.087   1.937   4.022
  431   HG22  ILE  51          2HG2      ILE  51  -0.044   3.255   5.215
  432   HG23  ILE  51          3HG2      ILE  51   1.107   3.246   3.859
  433   HD11  ILE  51          3HD1      ILE  51   0.809   0.319   3.176
  434   HD12  ILE  51          1HD1      ILE  51   2.190  -0.800   3.219
  435   HD13  ILE  51          2HD1      ILE  51   1.020  -0.780   4.559
  436    H    TYR  52           H        TYR  52   1.708   5.106   5.507
  437    HA   TYR  52           HA       TYR  52  -0.260   5.280   7.754
  438    HB2  TYR  52           1HB      TYR  52   0.257   7.540   8.173
  439    HB3  TYR  52           2HB      TYR  52   1.786   6.629   8.239
  440    HD1  TYR  52           2HD      TYR  52   3.466   6.894   6.460
  441    HD2  TYR  52           1HD      TYR  52  -0.127   9.193   6.445
  442    HE1  TYR  52           2HE      TYR  52   4.462   8.422   4.790
  443    HE2  TYR  52           1HE      TYR  52   0.856  10.733   4.772
  444    HH   TYR  52           HH       TYR  52   2.670  11.230   3.498
  445    H    ARG  53           H        ARG  53  -1.912   6.962   7.387
  446    HA   ARG  53           HA       ARG  53  -2.799   6.688   4.544
  447    HB2  ARG  53           1HB      ARG  53  -4.375   7.099   7.043
  448    HB3  ARG  53           2HB      ARG  53  -5.031   7.139   5.390
  449    HG2  ARG  53           1HG      ARG  53  -4.326   4.805   5.058
  450    HG3  ARG  53           2HG      ARG  53  -3.681   4.767   6.717
  451    HD2  ARG  53           1HD      ARG  53  -5.833   4.950   7.641
  452    HD3  ARG  53           2HD      ARG  53  -6.555   5.297   6.052
  453    HE   ARG  53           HE       ARG  53  -6.451   2.849   5.593
  454   HH11  ARG  53          1HH1      ARG  53  -4.940   3.624   8.639
  455   HH12  ARG  53          2HH1      ARG  53  -4.991   1.935   9.101
  456   HH21  ARG  53          1HH2      ARG  53  -6.508   0.909   6.106
  457   HH22  ARG  53          2HH2      ARG  53  -5.885   0.385   7.658
  458    H    LYS  54           H        LYS  54  -3.235   8.342   3.275
  459    HA   LYS  54           HA       LYS  54  -3.591  11.033   4.509
  460    HB2  LYS  54           1HB      LYS  54  -1.228  10.790   3.799
  461    HB3  LYS  54           2HB      LYS  54  -1.798  10.466   2.145
  462    HG2  LYS  54           1HG      LYS  54  -2.743  12.691   1.977
  463    HG3  LYS  54           2HG      LYS  54  -2.355  13.023   3.682
  464    HD2  LYS  54           1HD      LYS  54   0.029  12.874   3.208
  465    HD3  LYS  54           2HD      LYS  54  -0.309  12.423   1.520
  466    HE2  LYS  54           1HE      LYS  54  -1.395  14.596   1.156
  467    HE3  LYS  54           2HE      LYS  54  -1.063  15.048   2.844
  468    HZ1  LYS  54           3HZ      LYS  54   0.975  14.469   0.790
  469    HZ2  LYS  54           1HZ      LYS  54   0.567  15.969   1.338
  470    HZ3  LYS  54           2HZ      LYS  54   1.285  14.886   2.356
  471    H    TRP  55           H        TRP  55  -5.123  12.239   3.643
  472    HA   TRP  55           HA       TRP  55  -6.667  10.930   1.434
  473    HB2  TRP  55           1HB      TRP  55  -7.502  12.690   3.769
  474    HB3  TRP  55           2HB      TRP  55  -8.569  12.359   2.387
  475    HD1  TRP  55           HD       TRP  55  -9.696  10.177   2.284
  476    HE1  TRP  55           1HE      TRP  55  -9.978   8.077   3.964
  477    HE3  TRP  55           3HE      TRP  55  -6.043  11.396   5.601
  478    HZ2  TRP  55           2HZ      TRP  55  -8.740   7.238   6.287
  479    HZ3  TRP  55           3HZ      TRP  55  -5.609   9.973   7.507
  480    HH2  TRP  55           HH       TRP  55  -6.896   7.918   7.897
  481    H    ARG  56           H        ARG  56  -6.603  11.789  -0.471
  482    HA   ARG  56           HA       ARG  56  -6.097  14.739  -0.684
  483    HB2  ARG  56           1HB      ARG  56  -4.371  13.300  -1.629
  484    HB3  ARG  56           2HB      ARG  56  -5.584  12.663  -2.763
  485    HG2  ARG  56           1HG      ARG  56  -5.904  14.904  -3.699
  486    HG3  ARG  56           2HG      ARG  56  -4.716  15.562  -2.548
  487    HD2  ARG  56           1HD      ARG  56  -2.987  14.215  -3.569
  488    HD3  ARG  56           2HD      ARG  56  -4.175  13.564  -4.720
  489    HE   ARG  56           HE       ARG  56  -4.019  16.464  -5.034
  490   HH11  ARG  56          1HH1      ARG  56  -2.157  13.588  -5.681
  491   HH12  ARG  56          2HH1      ARG  56  -1.402  14.378  -7.052
  492   HH21  ARG  56          1HH2      ARG  56  -3.158  17.384  -6.595
  493   HH22  ARG  56          2HH2      ARG  56  -1.972  16.543  -7.573
  494    H    HIS  57           H        HIS  57  -7.659  15.987  -1.305
  495    HA   HIS  57           HA       HIS  57 -10.074  14.688  -2.511
  496    HB2  HIS  57           1HB      HIS  57 -10.433  15.825  -0.316
  497    HB3  HIS  57           2HB      HIS  57  -9.842  17.345  -1.027
  498    HD2  HIS  57           2HD      HIS  57 -11.811  18.822  -2.481
  499    HE1  HIS  57           1HE      HIS  57 -14.812  15.842  -2.077
  500    HE2  HIS  57           2HE      HIS  57 -14.226  18.287  -2.846
  501    H    PHE  58           H        PHE  58 -10.400  14.926  -4.561
  502    HA   PHE  58           HA       PHE  58 -10.223  17.593  -5.773
  503    HB2  PHE  58           1HB      PHE  58  -8.705  16.910  -7.600
  504    HB3  PHE  58           2HB      PHE  58  -7.879  16.806  -6.029
  505    HD1  PHE  58           2HD      PHE  58  -7.336  14.661  -5.046
  506    HD2  PHE  58           1HD      PHE  58  -9.168  14.967  -8.893
  507    HE1  PHE  58           2HE      PHE  58  -6.704  12.322  -5.530
  508    HE2  PHE  58           1HE      PHE  58  -8.541  12.626  -9.380
  509    HZ   PHE  58           HZ       PHE  58  -7.308  11.303  -7.697
  510    H    SER  59           H        SER  59 -11.171  17.732  -7.846
  511    HA   SER  59           HA       SER  59 -12.967  17.231  -9.334
  512    HB2  SER  59           1HB      SER  59 -12.103  14.446  -8.841
  513    HB3  SER  59           2HB      SER  59 -13.210  15.040 -10.099
  514    HG   SER  59           HG       SER  59 -11.055  14.819 -10.842
  515    H    GLY  60           H        GLY  60 -13.315  17.339  -6.278
  516    HA2  GLY  60           1HA      GLY  60 -15.234  17.342  -4.968
  517    HA3  GLY  60           2HA      GLY  60 -16.136  16.658  -6.341
  518    H    ARG  61           H        ARG  61 -13.247  15.013  -5.444
  519    HA   ARG  61           HA       ARG  61 -14.788  12.989  -3.874
  520    HB2  ARG  61           1HB      ARG  61 -13.143  12.380  -6.290
  521    HB3  ARG  61           2HB      ARG  61 -13.755  11.193  -5.115
  522    HG2  ARG  61           1HG      ARG  61 -15.521  13.046  -6.741
  523    HG3  ARG  61           2HG      ARG  61 -15.110  11.381  -7.224
  524    HD2  ARG  61           1HD      ARG  61 -16.143  10.568  -5.168
  525    HD3  ARG  61           2HD      ARG  61 -16.616  12.237  -4.772
  526    HE   ARG  61           HE       ARG  61 -17.995  10.552  -6.813
  527   HH11  ARG  61          1HH1      ARG  61 -17.576  13.740  -5.463
  528   HH12  ARG  61          2HH1      ARG  61 -19.083  14.253  -6.194
  529   HH21  ARG  61          1HH2      ARG  61 -19.726  11.123  -7.651
  530   HH22  ARG  61          2HH2      ARG  61 -20.312  12.763  -7.442
  531    H    LYS  62           H        LYS  62 -13.836  12.491  -2.079
  532    HA   LYS  62           HA       LYS  62 -10.954  13.064  -1.715
  533    HB2  LYS  62           1HB      LYS  62 -12.676  13.589   0.010
  534    HB3  LYS  62           2HB      LYS  62 -12.953  11.839   0.189
  535    HG2  LYS  62           1HG      LYS  62 -10.629  11.533   0.914
  536    HG3  LYS  62           2HG      LYS  62 -10.327  13.275   0.709
  537    HD2  LYS  62           1HD      LYS  62 -12.455  12.160   2.557
  538    HD3  LYS  62           2HD      LYS  62 -10.790  12.497   3.086
  539    HE2  LYS  62           1HE      LYS  62 -11.062  14.848   2.346
  540    HE3  LYS  62           2HE      LYS  62 -12.751  14.493   1.913
  541    HZ1  LYS  62           3HZ      LYS  62 -11.596  14.292   4.620
  542    HZ2  LYS  62           1HZ      LYS  62 -12.582  15.501   4.086
  543    HZ3  LYS  62           2HZ      LYS  62 -13.161  13.962   4.220
  544    H    TYR  63           H        TYR  63  -9.377  11.706  -1.959
  545    HA   TYR  63           HA       TYR  63 -10.067   8.791  -2.182
  546    HB2  TYR  63           1HB      TYR  63  -7.885  10.408  -3.512
  547    HB3  TYR  63           2HB      TYR  63  -8.046   8.637  -3.598
  548    HD1  TYR  63           1HD      TYR  63  -9.449  11.856  -4.718
  549    HD2  TYR  63           2HD      TYR  63  -9.783   7.611  -4.960
  550    HE1  TYR  63           1HE      TYR  63 -10.965  12.093  -6.664
  551    HE2  TYR  63           2HE      TYR  63 -11.297   7.830  -6.902
  552    HH   TYR  63           HH       TYR  63 -12.357   9.260  -8.322
  553    H    ARG  64           H        ARG  64  -9.187   7.402  -0.866
  554    HA   ARG  64           HA       ARG  64  -7.203   8.355   1.110
  555    HB2  ARG  64           1HB      ARG  64  -9.030   7.082   1.913
  556    HB3  ARG  64           2HB      ARG  64  -8.602   5.733   0.836
  557    HG2  ARG  64           1HG      ARG  64  -6.431   5.521   2.034
  558    HG3  ARG  64           2HG      ARG  64  -6.968   6.790   3.162
  559    HD2  ARG  64           1HD      ARG  64  -8.263   4.116   2.745
  560    HD3  ARG  64           2HD      ARG  64  -7.208   4.582   4.098
  561    HE   ARG  64           HE       ARG  64  -9.540   6.319   4.113
  562   HH11  ARG  64          1HH1      ARG  64  -8.728   2.976   4.688
  563   HH12  ARG  64          2HH1      ARG  64 -10.049   2.847   5.833
  564   HH21  ARG  64          1HH2      ARG  64 -11.061   6.183   5.416
  565   HH22  ARG  64          2HH2      ARG  64 -11.380   4.674   6.248
  566    H    GLU  65           H        GLU  65  -5.138   8.312   0.793
  567    HA   GLU  65           HA       GLU  65  -4.022   6.207  -1.032
  568    HB2  GLU  65           1HB      GLU  65  -2.946   8.912  -0.222
  569    HB3  GLU  65           2HB      GLU  65  -2.064   7.709  -1.193
  570    HG2  GLU  65           1HG      GLU  65  -3.889   7.917  -2.979
  571    HG3  GLU  65           2HG      GLU  65  -4.615   9.109  -1.876
  572    H    TYR  66           H        TYR  66  -2.627   4.766  -0.340
  573    HA   TYR  66           HA       TYR  66  -1.727   4.946   2.501
  574    HB2  TYR  66           1HB      TYR  66  -1.807   2.717   0.468
  575    HB3  TYR  66           2HB      TYR  66  -0.928   2.594   2.011
  576    HD1  TYR  66           1HD      TYR  66  -4.287   2.929   0.478
  577    HD2  TYR  66           2HD      TYR  66  -2.103   2.237   4.074
  578    HE1  TYR  66           1HE      TYR  66  -6.381   2.242   1.610
  579    HE2  TYR  66           2HE      TYR  66  -4.182   1.549   5.219
  580    HH   TYR  66           HH       TYR  66  -7.323   1.448   3.522
  581    H    CYS  67           H        CYS  67   0.178   5.687   2.997
  582    HA   CYS  67           HA       CYS  67   2.170   6.067   0.741
  583    HB2  CYS  67           1HB      CYS  67   1.472   7.683   3.233
  584    HB3  CYS  67           2HB      CYS  67   2.624   8.153   1.959
  585    HG   CYS  67           HG       CYS  67   0.556   9.621   1.868
  586    H    LEU  68           H        LEU  68   4.277   5.573   1.104
  587    HA   LEU  68           HA       LEU  68   5.032   3.894   3.331
  588    HB2  LEU  68           1HB      LEU  68   5.991   3.760   1.232
  589    HB3  LEU  68           2HB      LEU  68   6.725   5.379   1.249
  590    HG   LEU  68           HG       LEU  68   8.035   4.622   3.296
  591   HD11  LEU  68          1HD1      LEU  68   8.324   2.143   3.549
  592   HD12  LEU  68          2HD1      LEU  68   6.636   2.629   3.833
  593   HD13  LEU  68          3HD1      LEU  68   7.101   1.887   2.283
  594   HD21  LEU  68          3HD2      LEU  68   9.067   4.854   1.113
  595   HD22  LEU  68          1HD2      LEU  68   9.742   3.439   1.956
  596   HD23  LEU  68          2HD2      LEU  68   8.543   3.216   0.659
  597    H    LYS  69           H        LYS  69   5.753   4.308   5.267
  598    HA   LYS  69           HA       LYS  69   5.846   7.158   6.086
  599    HB2  LYS  69           1HB      LYS  69   4.523   5.459   7.330
  600    HB3  LYS  69           2HB      LYS  69   6.048   4.637   7.738
  601    HG2  LYS  69           1HG      LYS  69   6.807   6.603   8.972
  602    HG3  LYS  69           2HG      LYS  69   5.330   7.483   8.516
  603    HD2  LYS  69           1HD      LYS  69   3.979   5.778   9.710
  604    HD3  LYS  69           2HD      LYS  69   5.482   4.970  10.216
  605    HE2  LYS  69           1HE      LYS  69   6.175   6.926  11.461
  606    HE3  LYS  69           2HE      LYS  69   4.780   7.850  10.858
  607    HZ1  LYS  69           3HZ      LYS  69   4.640   5.471  12.598
  608    HZ2  LYS  69           1HZ      LYS  69   4.410   7.030  13.085
  609    HZ3  LYS  69           2HZ      LYS  69   3.345   6.327  12.039
  610    H    HIS  70           H        HIS  70   7.892   4.253   6.518
  611    HA   HIS  70           HA       HIS  70  10.245   6.112   6.598
  612    HB2  HIS  70           1HB      HIS  70   9.811   3.558   8.216
  613    HB3  HIS  70           2HB      HIS  70  11.322   4.497   8.162
  614    HD1  HIS  70           1HD      HIS  70  10.955   7.133   8.944
  615    HD2  HIS  70           2HD      HIS  70   8.128   4.331  10.329
  616    HE1  HIS  70           1HE      HIS  70   9.936   8.128  10.930
  617    H    ARG  71           H        ARG  71  11.321   5.941   4.802
  618    HA   ARG  71           HA       ARG  71  11.385   3.542   3.178
  619    HB2  ARG  71           1HB      ARG  71  12.897   4.594   1.806
  620    HB3  ARG  71           2HB      ARG  71  11.677   5.791   2.301
  621    HG2  ARG  71           1HG      ARG  71  13.289   6.699   3.955
  622    HG3  ARG  71           2HG      ARG  71  14.511   5.548   3.360
  623    HD2  ARG  71           1HD      ARG  71  14.448   6.592   1.188
  624    HD3  ARG  71           2HD      ARG  71  13.205   7.728   1.763
  625    HE   ARG  71           HE       ARG  71  15.608   8.079   3.371
  626   HH11  ARG  71          1HH1      ARG  71  14.471   8.655   0.125
  627   HH12  ARG  71          2HH1      ARG  71  15.556  10.024  -0.018
  628   HH21  ARG  71          1HH2      ARG  71  16.862   9.638   3.220
  629   HH22  ARG  71          2HH2      ARG  71  16.921  10.585   1.745
  630    H    ASP  72           H        ASP  72  13.182   4.632   5.935
  631    HA   ASP  72           HA       ASP  72  15.438   2.834   5.565
  632    HB2  ASP  72           1HB      ASP  72  14.355   4.242   8.080
  633    HB3  ASP  72           2HB      ASP  72  15.737   3.129   7.917
  634    H    GLU  73           H        GLU  73  12.328   2.613   7.259
  635    HA   GLU  73           HA       GLU  73  12.821  -0.032   8.329
  636    HB2  GLU  73           1HB      GLU  73  10.295   1.507   7.728
  637    HB3  GLU  73           2HB      GLU  73  10.323  -0.095   8.503
  638    HG2  GLU  73           1HG      GLU  73  11.511   2.490   9.678
  639    HG3  GLU  73           2HG      GLU  73  10.039   1.596  10.119
  640    H    LEU  74           H        LEU  74  11.328   1.156   5.337
  641    HA   LEU  74           HA       LEU  74  10.608  -1.446   4.335
  642    HB2  LEU  74           1HB      LEU  74   9.690   0.496   3.537
  643    HB3  LEU  74           2HB      LEU  74  11.196   1.202   2.906
  644    HG   LEU  74           HG       LEU  74  11.359  -0.720   1.311
  645   HD11  LEU  74          1HD1      LEU  74   9.292  -2.090   0.928
  646   HD12  LEU  74          2HD1      LEU  74   9.923  -2.319   2.576
  647   HD13  LEU  74          3HD1      LEU  74   8.512  -1.269   2.300
  648   HD21  LEU  74          3HD2      LEU  74  10.478   1.418   0.582
  649   HD22  LEU  74          1HD2      LEU  74   9.612   0.094  -0.235
  650   HD23  LEU  74          2HD2      LEU  74   8.843   0.960   1.118
  651    H    ALA  75           H        ALA  75  13.551   0.519   4.023
  652    HA   ALA  75           HA       ALA  75  14.968  -1.234   2.301
  653    HB1  ALA  75           1HB      ALA  75  16.998  -0.197   3.237
  654    HB2  ALA  75           2HB      ALA  75  15.757   1.020   2.858
  655    HB3  ALA  75           3HB      ALA  75  16.028   0.519   4.544
  656    H    ASP  76           H        ASP  76  14.640  -1.241   5.842
  657    HA   ASP  76           HA       ASP  76  16.362  -3.512   6.279
  658    HB2  ASP  76           1HB      ASP  76  14.063  -2.374   7.980
  659    HB3  ASP  76           2HB      ASP  76  15.116  -3.773   8.305
  660    H    LEU  77           H        LEU  77  12.928  -3.199   5.512
  661    HA   LEU  77           HA       LEU  77  12.338  -6.016   5.808
  662    HB2  LEU  77           1HB      LEU  77  11.193  -3.784   4.273
  663    HB3  LEU  77           2HB      LEU  77  10.352  -5.351   4.247
  664    HG   LEU  77           HG       LEU  77  10.868  -3.650   6.717
  665   HD11  LEU  77          1HD1      LEU  77   8.386  -3.288   6.693
  666   HD12  LEU  77          2HD1      LEU  77   9.145  -2.658   5.212
  667   HD13  LEU  77          3HD1      LEU  77   8.281  -4.214   5.178
  668   HD21  LEU  77          3HD2      LEU  77  10.854  -6.021   7.217
  669   HD22  LEU  77          1HD2      LEU  77   9.380  -5.256   7.861
  670   HD23  LEU  77          2HD2      LEU  77   9.302  -6.221   6.366
  671    H    GLU  78           H        GLU  78  13.542  -4.033   3.146
  672    HA   GLU  78           HA       GLU  78  13.482  -6.184   1.197
  673    HB2  GLU  78           1HB      GLU  78  15.026  -3.600   1.400
  674    HB3  GLU  78           2HB      GLU  78  15.180  -4.731   0.034
  675    HG2  GLU  78           1HG      GLU  78  12.712  -4.388  -0.473
  676    HG3  GLU  78           2HG      GLU  78  12.704  -3.336   0.960
  677    H    HIS  79           H        HIS  79  15.722  -5.190   3.699
  678    HA   HIS  79           HA       HIS  79  17.899  -6.878   2.725
  679    HB2  HIS  79           1HB      HIS  79  17.415  -5.556   5.433
  680    HB3  HIS  79           2HB      HIS  79  18.913  -6.390   4.954
  681    HD2  HIS  79           2HD      HIS  79  18.567  -4.634   1.780
  682    HE1  HIS  79           1HE      HIS  79  19.788  -1.586   4.477
  683    HE2  HIS  79           2HE      HIS  79  19.509  -2.324   1.969
  Start of MODEL   14
    1    H    LYS   3           H        LYS   3   4.721 -13.835  -8.873
    2    HA   LYS   3           HA       LYS   3   5.090 -11.494  -7.316
    3    HB2  LYS   3           1HB      LYS   3   2.568 -11.544  -8.980
    4    HB3  LYS   3           2HB      LYS   3   2.814 -10.526  -7.539
    5    HG2  LYS   3           1HG      LYS   3   4.759  -9.459  -8.698
    6    HG3  LYS   3           2HG      LYS   3   4.347 -10.392 -10.158
    7    HD2  LYS   3           1HD      LYS   3   2.389  -8.544  -8.764
    8    HD3  LYS   3           2HD      LYS   3   3.472  -8.000 -10.067
    9    HE2  LYS   3           1HE      LYS   3   2.524  -9.801 -11.522
   10    HE3  LYS   3           2HE      LYS   3   1.354 -10.162 -10.231
   11    HZ1  LYS   3           3HZ      LYS   3   1.613  -7.581 -11.637
   12    HZ2  LYS   3           1HZ      LYS   3   0.424  -8.696 -11.892
   13    HZ3  LYS   3           2HZ      LYS   3   0.528  -7.917 -10.441
   14    H    ALA   4           H        ALA   4   2.943 -14.139  -8.243
   15    HA   ALA   4           HA       ALA   4   1.477 -14.196  -5.780
   16    HB1  ALA   4           1HB      ALA   4   0.773 -16.445  -6.504
   17    HB2  ALA   4           2HB      ALA   4   0.650 -15.263  -7.828
   18    HB3  ALA   4           3HB      ALA   4   2.006 -16.414  -7.786
   19    H    LYS   5           H        LYS   5   4.612 -15.383  -6.690
   20    HA   LYS   5           HA       LYS   5   4.929 -17.300  -4.552
   21    HB2  LYS   5           1HB      LYS   5   6.904 -15.668  -6.151
   22    HB3  LYS   5           2HB      LYS   5   7.367 -16.901  -4.954
   23    HG2  LYS   5           1HG      LYS   5   6.210 -18.624  -6.272
   24    HG3  LYS   5           2HG      LYS   5   5.730 -17.395  -7.466
   25    HD2  LYS   5           1HD      LYS   5   8.100 -16.940  -7.955
   26    HD3  LYS   5           2HD      LYS   5   8.582 -18.165  -6.756
   27    HE2  LYS   5           1HE      LYS   5   7.442 -19.902  -8.056
   28    HE3  LYS   5           2HE      LYS   5   6.924 -18.684  -9.244
   29    HZ1  LYS   5           3HZ      LYS   5   9.719 -19.414  -8.642
   30    HZ2  LYS   5           1HZ      LYS   5   8.875 -19.876  -9.982
   31    HZ3  LYS   5           2HZ      LYS   5   9.241 -18.285  -9.745
   32    H    LEU   6           H        LEU   6   5.105 -13.825  -4.703
   33    HA   LEU   6           HA       LEU   6   6.349 -13.711  -2.005
   34    HB2  LEU   6           1HB      LEU   6   5.418 -11.644  -3.890
   35    HB3  LEU   6           2HB      LEU   6   6.346 -11.215  -2.435
   36    HG   LEU   6           HG       LEU   6   7.339 -12.775  -4.851
   37   HD11  LEU   6          1HD1      LEU   6   8.895 -10.825  -5.115
   38   HD12  LEU   6          2HD1      LEU   6   7.194 -10.310  -5.196
   39   HD13  LEU   6          3HD1      LEU   6   8.135 -10.047  -3.707
   40   HD21  LEU   6          3HD2      LEU   6   8.288 -13.683  -2.814
   41   HD22  LEU   6          1HD2      LEU   6   9.534 -12.792  -3.719
   42   HD23  LEU   6          2HD2      LEU   6   8.780 -12.056  -2.283
   43    H    SER   7           H        SER   7   5.439 -12.529  -0.287
   44    HA   SER   7           HA       SER   7   2.599 -13.025   0.187
   45    HB2  SER   7           1HB      SER   7   2.881 -12.157   2.228
   46    HB3  SER   7           2HB      SER   7   4.365 -13.060   1.853
   47    HG   SER   7           HG       SER   7   4.934 -11.111   2.758
   48    H    LEU   8           H        LEU   8   1.057 -11.359   0.740
   49    HA   LEU   8           HA       LEU   8   0.845  -9.231  -1.184
   50    HB2  LEU   8           1HB      LEU   8  -0.411  -9.802   1.415
   51    HB3  LEU   8           2HB      LEU   8  -1.036  -8.454   0.436
   52    HG   LEU   8           HG       LEU   8  -1.036 -11.404  -0.315
   53   HD11  LEU   8          1HD1      LEU   8  -3.530 -11.154  -0.204
   54   HD12  LEU   8          2HD1      LEU   8  -2.773 -10.784   1.363
   55   HD13  LEU   8          3HD1      LEU   8  -3.322  -9.461   0.308
   56   HD21  LEU   8          3HD2      LEU   8  -0.652 -10.011  -2.262
   57   HD22  LEU   8          1HD2      LEU   8  -2.294 -10.697  -2.322
   58   HD23  LEU   8          2HD2      LEU   8  -2.054  -8.995  -1.850
   59    H    THR   9           H        THR   9   2.123  -9.381   2.095
   60    HA   THR   9           HA       THR   9   2.502  -6.546   2.431
   61    HB   THR   9           HB       THR   9   4.086  -8.889   3.568
   62    HG1  THR   9           1HG      THR   9   2.739  -8.438   5.411
   63   HG21  THR   9          3HG2      THR   9   3.960  -5.968   4.419
   64   HG22  THR   9          1HG2      THR   9   4.825  -7.266   5.277
   65   HG23  THR   9          2HG2      THR   9   5.352  -6.768   3.651
   66    H    GLN  10           H        GLN  10   4.669  -9.089   1.182
   67    HA   GLN  10           HA       GLN  10   6.850  -7.327   0.598
   68    HB2  GLN  10           1HB      GLN  10   5.961  -9.955  -0.597
   69    HB3  GLN  10           2HB      GLN  10   7.455  -9.117  -1.077
   70    HG2  GLN  10           1HG      GLN  10   8.294  -9.448   1.454
   71    HG3  GLN  10           2HG      GLN  10   6.616 -10.033   1.534
   72   HE21  GLN  10          2HE2      GLN  10   9.903 -10.717   0.511
   73   HE22  GLN  10          1HE2      GLN  10   9.668 -12.403   0.188
   74    H    LEU  11           H        LEU  11   4.049  -8.330  -1.333
   75    HA   LEU  11           HA       LEU  11   4.931  -7.048  -3.758
   76    HB2  LEU  11           1HB      LEU  11   2.323  -7.813  -2.633
   77    HB3  LEU  11           2HB      LEU  11   2.379  -7.197  -4.301
   78    HG   LEU  11           HG       LEU  11   3.751  -9.709  -3.268
   79   HD11  LEU  11          1HD1      LEU  11   2.114 -10.906  -4.744
   80   HD12  LEU  11          2HD1      LEU  11   1.281  -9.959  -3.489
   81   HD13  LEU  11          3HD1      LEU  11   1.369  -9.345  -5.156
   82   HD21  LEU  11          3HD2      LEU  11   5.044  -8.630  -5.012
   83   HD22  LEU  11          1HD2      LEU  11   4.310 -10.126  -5.638
   84   HD23  LEU  11          2HD2      LEU  11   3.608  -8.545  -6.062
   85    H    ILE  12           H        ILE  12   2.891  -5.956  -1.064
   86    HA   ILE  12           HA       ILE  12   2.333  -3.345  -2.179
   87    HB   ILE  12           HB       ILE  12   2.433  -4.380   0.687
   88   HG12  ILE  12          1HG1      ILE  12   0.066  -3.565  -0.970
   89   HG13  ILE  12          2HG1      ILE  12   0.701  -5.226  -0.906
   90   HG21  ILE  12          1HG2      ILE  12   1.310  -2.270   1.315
   91   HG22  ILE  12          2HG2      ILE  12   2.926  -1.959   0.641
   92   HG23  ILE  12          3HG2      ILE  12   1.480  -1.681  -0.356
   93   HD11  ILE  12          3HD1      ILE  12  -0.333  -3.626   1.460
   94   HD12  ILE  12          1HD1      ILE  12  -1.200  -4.940   0.634
   95   HD13  ILE  12          2HD1      ILE  12   0.302  -5.286   1.524
   96    H    LEU  13           H        LEU  13   4.980  -4.565  -0.178
   97    HA   LEU  13           HA       LEU  13   6.214  -1.987   0.189
   98    HB2  LEU  13           1HB      LEU  13   7.134  -4.776   0.184
   99    HB3  LEU  13           2HB      LEU  13   8.311  -3.512   0.606
  100    HG   LEU  13           HG       LEU  13   5.741  -4.144   2.108
  101   HD11  LEU  13          1HD1      LEU  13   7.292  -4.905   3.929
  102   HD12  LEU  13          2HD1      LEU  13   7.521  -5.858   2.445
  103   HD13  LEU  13          3HD1      LEU  13   8.678  -4.572   2.865
  104   HD21  LEU  13          3HD2      LEU  13   6.275  -1.780   2.187
  105   HD22  LEU  13          1HD2      LEU  13   6.568  -2.521   3.778
  106   HD23  LEU  13          2HD2      LEU  13   7.938  -2.142   2.705
  107    H    ILE  14           H        ILE  14   6.410  -4.413  -2.358
  108    HA   ILE  14           HA       ILE  14   8.589  -3.194  -3.809
  109    HB   ILE  14           HB       ILE  14   6.246  -4.936  -4.685
  110   HG12  ILE  14          1HG1      ILE  14   9.176  -5.573  -4.519
  111   HG13  ILE  14          2HG1      ILE  14   8.015  -5.871  -3.204
  112   HG21  ILE  14          1HG2      ILE  14   7.434  -5.182  -6.838
  113   HG22  ILE  14          2HG2      ILE  14   6.958  -3.490  -6.561
  114   HG23  ILE  14          3HG2      ILE  14   8.646  -3.993  -6.307
  115   HD11  ILE  14          3HD1      ILE  14   7.885  -7.065  -5.996
  116   HD12  ILE  14          1HD1      ILE  14   8.408  -7.915  -4.523
  117   HD13  ILE  14          2HD1      ILE  14   6.724  -7.362  -4.682
  118    H    ARG  15           H        ARG  15   5.083  -2.688  -3.948
  119    HA   ARG  15           HA       ARG  15   5.258  -0.654  -6.004
  120    HB2  ARG  15           1HB      ARG  15   3.147  -1.407  -4.053
  121    HB3  ARG  15           2HB      ARG  15   3.017   0.018  -5.108
  122    HG2  ARG  15           1HG      ARG  15   3.240  -2.887  -5.943
  123    HG3  ARG  15           2HG      ARG  15   1.842  -1.806  -6.146
  124    HD2  ARG  15           1HD      ARG  15   4.506  -1.585  -7.509
  125    HD3  ARG  15           2HD      ARG  15   2.974  -2.139  -8.225
  126    HE   ARG  15           HE       ARG  15   2.623   0.609  -7.361
  127   HH11  ARG  15          1HH1      ARG  15   4.408  -1.187  -9.757
  128   HH12  ARG  15          2HH1      ARG  15   4.362   0.193 -10.836
  129   HH21  ARG  15          1HH2      ARG  15   2.570   2.202  -8.581
  130   HH22  ARG  15          2HH2      ARG  15   3.315   2.128 -10.166
  131    H    LEU  16           H        LEU  16   5.474  -0.616  -2.488
  132    HA   LEU  16           HA       LEU  16   5.411   2.299  -2.324
  133    HB2  LEU  16           1HB      LEU  16   6.223   0.095  -0.553
  134    HB3  LEU  16           2HB      LEU  16   6.307   1.759   0.071
  135    HG   LEU  16           HG       LEU  16   3.793   0.316  -0.861
  136   HD11  LEU  16          1HD1      LEU  16   3.144   0.413   1.562
  137   HD12  LEU  16          2HD1      LEU  16   4.645  -0.515   1.331
  138   HD13  LEU  16          3HD1      LEU  16   4.717   1.156   1.937
  139   HD21  LEU  16          3HD2      LEU  16   3.696   2.695  -1.323
  140   HD22  LEU  16          1HD2      LEU  16   2.593   2.291   0.014
  141   HD23  LEU  16          2HD2      LEU  16   4.158   3.070   0.354
  142    H    SER  17           H        SER  17   7.828  -0.095  -2.965
  143    HA   SER  17           HA       SER  17  10.163   1.629  -2.418
  144    HB2  SER  17           1HB      SER  17  11.447  -0.017  -3.267
  145    HB3  SER  17           2HB      SER  17  10.187  -0.776  -2.266
  146    HG   SER  17           HG       SER  17  10.191  -0.588  -5.098
  147    H    ASN  18           H        ASN  18   7.893   1.081  -5.046
  148    HA   ASN  18           HA       ASN  18   9.578   2.495  -7.018
  149    HB2  ASN  18           1HB      ASN  18   6.639   1.528  -7.369
  150    HB3  ASN  18           2HB      ASN  18   7.795   2.490  -8.324
  151   HD21  ASN  18          2HD2      ASN  18   6.489  -0.145  -8.774
  152   HD22  ASN  18          1HD2      ASN  18   7.790  -1.239  -9.107
  153    H    ARG  19           H        ARG  19   6.511   3.134  -5.296
  154    HA   ARG  19           HA       ARG  19   7.205   6.040  -5.441
  155    HB2  ARG  19           1HB      ARG  19   4.535   4.866  -6.074
  156    HB3  ARG  19           2HB      ARG  19   4.860   6.584  -5.749
  157    HG2  ARG  19           1HG      ARG  19   6.156   4.999  -7.984
  158    HG3  ARG  19           2HG      ARG  19   4.691   5.992  -8.183
  159    HD2  ARG  19           1HD      ARG  19   5.975   7.949  -7.468
  160    HD3  ARG  19           2HD      ARG  19   7.432   6.931  -7.401
  161    HE   ARG  19           HE       ARG  19   6.214   7.936  -9.932
  162   HH11  ARG  19          1HH1      ARG  19   8.501   5.751  -8.466
  163   HH12  ARG  19          2HH1      ARG  19   9.323   5.571 -10.004
  164   HH21  ARG  19          1HH2      ARG  19   7.148   7.746 -11.698
  165   HH22  ARG  19          2HH2      ARG  19   8.553   6.709 -11.847
  166    H    GLY  20           H        GLY  20   6.801   7.230  -3.688
  167    HA2  GLY  20           1HA      GLY  20   6.946   5.899  -1.218
  168    HA3  GLY  20           2HA      GLY  20   6.521   7.614  -1.424
  169    H    CYS  21           H        CYS  21   4.131   7.212  -2.940
  170    HA   CYS  21           HA       CYS  21   2.302   6.040  -0.817
  171    HB2  CYS  21           1HB      CYS  21   2.578   8.512  -0.766
  172    HB3  CYS  21           2HB      CYS  21   2.119   8.588  -2.485
  173    HG   CYS  21           HG       CYS  21   0.265   9.528  -1.027
  174    H    GLN  22           H        GLN  22   0.840   4.645  -1.574
  175    HA   GLN  22           HA       GLN  22   0.157   4.713  -4.486
  176    HB2  GLN  22           1HB      GLN  22   0.868   2.340  -2.760
  177    HB3  GLN  22           2HB      GLN  22  -0.008   2.200  -4.302
  178    HG2  GLN  22           1HG      GLN  22   2.948   3.265  -4.127
  179    HG3  GLN  22           2HG      GLN  22   2.186   1.685  -4.426
  180   HE21  GLN  22          2HE2      GLN  22   1.875   5.101  -5.509
  181   HE22  GLN  22          1HE2      GLN  22   1.714   4.727  -7.192
  182    H    THR  23           H        THR  23  -1.845   3.708  -5.052
  183    HA   THR  23           HA       THR  23  -3.876   4.105  -2.910
  184    HB   THR  23           HB       THR  23  -5.522   4.048  -4.715
  185    HG1  THR  23           1HG      THR  23  -3.299   3.573  -6.452
  186   HG21  THR  23          3HG2      THR  23  -3.114   5.751  -5.467
  187   HG22  THR  23          1HG2      THR  23  -4.787   6.017  -6.012
  188   HG23  THR  23          2HG2      THR  23  -4.372   6.194  -4.291
  189    H    LEU  24           H        LEU  24  -5.707   2.627  -2.795
  190    HA   LEU  24           HA       LEU  24  -4.822  -0.112  -2.476
  191    HB2  LEU  24           1HB      LEU  24  -6.425   0.942  -1.144
  192    HB3  LEU  24           2HB      LEU  24  -7.642   1.096  -2.431
  193    HG   LEU  24           HG       LEU  24  -7.638  -1.411  -2.629
  194   HD11  LEU  24          1HD1      LEU  24  -6.702  -2.707  -0.694
  195   HD12  LEU  24          2HD1      LEU  24  -5.425  -1.816  -1.555
  196   HD13  LEU  24          3HD1      LEU  24  -6.060  -1.194  -0.013
  197   HD21  LEU  24          3HD2      LEU  24  -9.398  -0.252  -1.430
  198   HD22  LEU  24          1HD2      LEU  24  -9.022  -1.790  -0.617
  199   HD23  LEU  24          2HD2      LEU  24  -8.424  -0.256   0.061
  200    H    GLU  25           H        GLU  25  -6.509   1.644  -5.009
  201    HA   GLU  25           HA       GLU  25  -7.354  -0.707  -6.475
  202    HB2  GLU  25           1HB      GLU  25  -6.884   2.165  -7.284
  203    HB3  GLU  25           2HB      GLU  25  -7.525   0.914  -8.376
  204    HG2  GLU  25           1HG      GLU  25  -9.536   0.658  -6.865
  205    HG3  GLU  25           2HG      GLU  25  -8.729   1.828  -5.797
  206    H    GLU  26           H        GLU  26  -4.474   1.368  -6.623
  207    HA   GLU  26           HA       GLU  26  -3.207  -0.020  -8.796
  208    HB2  GLU  26           1HB      GLU  26  -2.211   1.602  -6.467
  209    HB3  GLU  26           2HB      GLU  26  -1.094   0.811  -7.606
  210    HG2  GLU  26           1HG      GLU  26  -1.988   2.189  -9.481
  211    HG3  GLU  26           2HG      GLU  26  -3.264   2.718  -8.361
  212    H    LEU  27           H        LEU  27  -3.142  -0.555  -5.280
  213    HA   LEU  27           HA       LEU  27  -1.351  -2.831  -5.464
  214    HB2  LEU  27           1HB      LEU  27  -3.309  -1.871  -3.488
  215    HB3  LEU  27           2HB      LEU  27  -2.272  -3.254  -3.071
  216    HG   LEU  27           HG       LEU  27  -1.342  -0.423  -3.693
  217   HD11  LEU  27          1HD1      LEU  27  -0.651  -0.398  -1.281
  218   HD12  LEU  27          2HD1      LEU  27  -2.403  -0.649  -1.448
  219   HD13  LEU  27          3HD1      LEU  27  -1.337  -2.028  -1.084
  220   HD21  LEU  27          3HD2      LEU  27   0.250  -2.075  -4.477
  221   HD22  LEU  27          1HD2      LEU  27   0.900  -1.236  -3.049
  222   HD23  LEU  27          2HD2      LEU  27   0.240  -2.882  -2.891
  223    H    GLU  28           H        GLU  28  -4.827  -2.401  -5.667
  224    HA   GLU  28           HA       GLU  28  -5.597  -5.136  -5.351
  225    HB2  GLU  28           1HB      GLU  28  -7.166  -3.265  -5.357
  226    HB3  GLU  28           2HB      GLU  28  -6.797  -2.957  -7.071
  227    HG2  GLU  28           1HG      GLU  28  -7.734  -5.316  -7.578
  228    HG3  GLU  28           2HG      GLU  28  -8.122  -5.334  -5.843
  229    H    GLU  29           H        GLU  29  -4.741  -3.312  -8.298
  230    HA   GLU  29           HA       GLU  29  -5.106  -5.671  -9.985
  231    HB2  GLU  29           1HB      GLU  29  -3.862  -2.961 -10.470
  232    HB3  GLU  29           2HB      GLU  29  -4.051  -4.220 -11.714
  233    HG2  GLU  29           1HG      GLU  29  -6.567  -4.070 -11.439
  234    HG3  GLU  29           2HG      GLU  29  -6.226  -2.900 -10.144
  235    H    PHE  30           H        PHE  30  -2.385  -4.057  -8.428
  236    HA   PHE  30           HA       PHE  30  -0.321  -5.503  -9.829
  237    HB2  PHE  30           1HB      PHE  30   0.113  -3.416  -8.542
  238    HB3  PHE  30           2HB      PHE  30  -0.266  -4.280  -7.036
  239    HD1  PHE  30           1HD      PHE  30   2.053  -4.255  -9.935
  240    HD2  PHE  30           2HD      PHE  30   1.362  -5.444  -5.890
  241    HE1  PHE  30           1HE      PHE  30   4.420  -4.941  -9.734
  242    HE2  PHE  30           2HE      PHE  30   3.727  -6.130  -5.684
  243    HZ   PHE  30           HZ       PHE  30   5.256  -5.879  -7.608
  244    H    THR  31           H        THR  31  -2.020  -6.123  -6.761
  245    HA   THR  31           HA       THR  31  -0.424  -8.598  -6.396
  246    HB   THR  31           HB       THR  31  -1.491  -8.743  -4.209
  247    HG1  THR  31           1HG      THR  31  -3.565  -7.934  -4.860
  248   HG21  THR  31          3HG2      THR  31  -0.678  -5.877  -4.834
  249   HG22  THR  31          1HG2      THR  31  -0.735  -6.612  -3.214
  250   HG23  THR  31          2HG2      THR  31   0.432  -7.205  -4.422
  251    H    GLN  32           H        GLN  32  -3.328  -7.667  -7.851
  252    HA   GLN  32           HA       GLN  32  -5.273  -8.800  -8.435
  253    HB2  GLN  32           1HB      GLN  32  -3.306 -11.097  -8.341
  254    HB3  GLN  32           2HB      GLN  32  -4.963 -11.215  -8.980
  255    HG2  GLN  32           1HG      GLN  32  -2.774  -9.402 -10.332
  256    HG3  GLN  32           2HG      GLN  32  -3.318 -11.082 -10.547
  257   HE21  GLN  32          2HE2      GLN  32  -3.911  -7.756 -11.206
  258   HE22  GLN  32          1HE2      GLN  32  -5.396  -7.953 -12.081
  259    H    ALA  33           H        ALA  33  -5.530  -8.153  -5.955
  260    HA   ALA  33           HA       ALA  33  -6.624 -10.594  -4.654
  261    HB1  ALA  33           1HB      ALA  33  -5.691  -9.891  -2.484
  262    HB2  ALA  33           2HB      ALA  33  -4.406 -10.240  -3.664
  263    HB3  ALA  33           3HB      ALA  33  -4.836  -8.556  -3.285
  264    H    LYS  34           H        LYS  34  -8.091 -10.110  -2.857
  265    HA   LYS  34           HA       LYS  34 -10.038  -8.143  -3.696
  266    HB2  LYS  34           1HB      LYS  34  -9.757  -9.763  -1.163
  267    HB3  LYS  34           2HB      LYS  34 -11.157  -8.740  -1.562
  268    HG2  LYS  34           1HG      LYS  34 -11.586 -10.128  -3.561
  269    HG3  LYS  34           2HG      LYS  34 -10.206 -11.164  -3.127
  270    HD2  LYS  34           1HD      LYS  34 -11.310 -11.746  -1.003
  271    HD3  LYS  34           2HD      LYS  34 -12.692 -10.713  -1.441
  272    HE2  LYS  34           1HE      LYS  34 -13.100 -12.114  -3.427
  273    HE3  LYS  34           2HE      LYS  34 -11.734 -13.155  -2.965
  274    HZ1  LYS  34           3HZ      LYS  34 -14.184 -12.734  -1.375
  275    HZ2  LYS  34           1HZ      LYS  34 -13.836 -14.081  -2.261
  276    HZ3  LYS  34           2HZ      LYS  34 -12.918 -13.700  -0.946
  277    H    ARG  35           H        ARG  35 -10.778  -6.301  -2.692
  278    HA   ARG  35           HA       ARG  35  -8.709  -4.551  -1.747
  279    HB2  ARG  35           1HB      ARG  35 -11.676  -4.285  -1.777
  280    HB3  ARG  35           2HB      ARG  35 -10.569  -3.035  -1.159
  281    HG2  ARG  35           1HG      ARG  35  -9.511  -2.854  -3.349
  282    HG3  ARG  35           2HG      ARG  35 -10.551  -4.156  -3.979
  283    HD2  ARG  35           1HD      ARG  35 -12.501  -2.749  -3.595
  284    HD3  ARG  35           2HD      ARG  35 -11.426  -1.444  -3.039
  285    HE   ARG  35           HE       ARG  35 -10.661  -2.062  -5.749
  286   HH11  ARG  35          1HH1      ARG  35 -13.471  -0.828  -4.094
  287   HH12  ARG  35          2HH1      ARG  35 -13.903   0.107  -5.512
  288   HH21  ARG  35          1HH2      ARG  35 -11.147  -1.003  -7.383
  289   HH22  ARG  35          2HH2      ARG  35 -12.580   0.007  -7.389
  290    H    GLU  36           H        GLU  36 -11.271  -6.331  -0.048
  291    HA   GLU  36           HA       GLU  36 -10.717  -5.207   2.543
  292    HB2  GLU  36           1HB      GLU  36 -11.955  -7.818   1.671
  293    HB3  GLU  36           2HB      GLU  36 -11.852  -7.283   3.366
  294    HG2  GLU  36           1HG      GLU  36 -13.316  -5.306   2.822
  295    HG3  GLU  36           2HG      GLU  36 -13.209  -5.839   1.128
  296    H    VAL  37           H        VAL  37  -9.462  -8.061   0.852
  297    HA   VAL  37           HA       VAL  37  -7.912  -9.063   3.090
  298    HB   VAL  37           HB       VAL  37  -7.584  -9.412   0.083
  299   HG11  VAL  37          1HG1      VAL  37  -6.097 -11.298   0.667
  300   HG12  VAL  37          2HG1      VAL  37  -5.441  -9.756   1.265
  301   HG13  VAL  37          3HG1      VAL  37  -6.243 -10.879   2.390
  302   HG21  VAL  37          3HG2      VAL  37  -9.657 -10.328   0.938
  303   HG22  VAL  37          1HG2      VAL  37  -8.534 -11.628   0.478
  304   HG23  VAL  37          2HG2      VAL  37  -8.767 -11.220   2.195
  305    H    LEU  38           H        LEU  38  -7.142  -6.821   0.455
  306    HA   LEU  38           HA       LEU  38  -4.387  -6.486   1.291
  307    HB2  LEU  38           1HB      LEU  38  -6.315  -4.938  -0.297
  308    HB3  LEU  38           2HB      LEU  38  -4.650  -4.322  -0.163
  309    HG   LEU  38           HG       LEU  38  -5.479  -6.989  -1.373
  310   HD11  LEU  38          1HD1      LEU  38  -4.741  -5.958  -3.538
  311   HD12  LEU  38          2HD1      LEU  38  -6.083  -5.043  -2.810
  312   HD13  LEU  38          3HD1      LEU  38  -4.417  -4.432  -2.682
  313   HD21  LEU  38          3HD2      LEU  38  -3.306  -7.107  -0.305
  314   HD22  LEU  38          1HD2      LEU  38  -3.116  -7.159  -2.074
  315   HD23  LEU  38          2HD2      LEU  38  -2.763  -5.657  -1.184
  316    H    LEU  39           H        LEU  39  -7.424  -4.895   2.112
  317    HA   LEU  39           HA       LEU  39  -6.239  -2.708   3.566
  318    HB2  LEU  39           1HB      LEU  39  -8.796  -4.142   3.581
  319    HB3  LEU  39           2HB      LEU  39  -8.618  -2.803   4.738
  320    HG   LEU  39           HG       LEU  39  -8.400  -2.576   1.711
  321   HD11  LEU  39          1HD1      LEU  39 -10.563  -1.316   1.887
  322   HD12  LEU  39          2HD1      LEU  39 -10.737  -2.988   2.473
  323   HD13  LEU  39          3HD1      LEU  39 -10.595  -1.648   3.636
  324   HD21  LEU  39          3HD2      LEU  39  -6.990  -0.976   2.865
  325   HD22  LEU  39          1HD2      LEU  39  -8.375  -0.139   2.121
  326   HD23  LEU  39          2HD2      LEU  39  -8.359  -0.453   3.874
  327    H    VAL  40           H        VAL  40  -7.121  -6.007   4.470
  328    HA   VAL  40           HA       VAL  40  -6.565  -5.780   7.291
  329    HB   VAL  40           HB       VAL  40  -6.295  -8.114   5.354
  330   HG11  VAL  40          1HG1      VAL  40  -6.150  -9.532   7.373
  331   HG12  VAL  40          2HG1      VAL  40  -4.778  -8.404   7.284
  332   HG13  VAL  40          3HG1      VAL  40  -6.129  -8.077   8.395
  333   HG21  VAL  40          3HG2      VAL  40  -8.569  -7.329   5.644
  334   HG22  VAL  40          1HG2      VAL  40  -8.341  -8.910   6.426
  335   HG23  VAL  40          2HG2      VAL  40  -8.398  -7.431   7.414
  336    H    THR  41           H        THR  41  -4.420  -6.640   4.579
  337    HA   THR  41           HA       THR  41  -2.072  -6.858   6.234
  338    HB   THR  41           HB       THR  41  -2.329  -6.204   3.268
  339    HG1  THR  41           1HG      THR  41  -1.837  -8.470   3.090
  340   HG21  THR  41          3HG2      THR  41   0.055  -7.162   4.901
  341   HG22  THR  41          1HG2      THR  41   0.020  -6.956   3.136
  342   HG23  THR  41          2HG2      THR  41  -0.140  -5.538   4.200
  343    H    LEU  42           H        LEU  42  -3.497  -4.156   4.428
  344    HA   LEU  42           HA       LEU  42  -1.285  -2.363   4.888
  345    HB2  LEU  42           1HB      LEU  42  -4.142  -2.069   4.272
  346    HB3  LEU  42           2HB      LEU  42  -3.151  -0.595   4.342
  347    HG   LEU  42           HG       LEU  42  -2.679  -2.931   2.452
  348   HD11  LEU  42          1HD1      LEU  42  -3.518  -1.378   0.669
  349   HD12  LEU  42          2HD1      LEU  42  -4.771  -1.701   1.889
  350   HD13  LEU  42          3HD1      LEU  42  -3.877  -0.163   1.918
  351   HD21  LEU  42          3HD2      LEU  42  -0.652  -1.724   3.013
  352   HD22  LEU  42          1HD2      LEU  42  -1.111  -1.387   1.328
  353   HD23  LEU  42          2HD2      LEU  42  -1.423  -0.175   2.596
  354    H    THR  43           H        THR  43  -4.289  -2.999   6.653
  355    HA   THR  43           HA       THR  43  -3.890  -0.890   8.592
  356    HB   THR  43           HB       THR  43  -5.491  -3.477   8.756
  357    HG1  THR  43           1HG      THR  43  -6.259  -2.008   7.187
  358   HG21  THR  43          3HG2      THR  43  -5.542  -1.006  10.531
  359   HG22  THR  43          1HG2      THR  43  -6.653  -2.389  10.644
  360   HG23  THR  43          2HG2      THR  43  -4.921  -2.606  10.996
  361    H    ARG  44           H        ARG  44  -2.981  -4.315   8.485
  362    HA   ARG  44           HA       ARG  44  -1.891  -4.410  11.148
  363    HB2  ARG  44           1HB      ARG  44  -1.424  -6.060   8.717
  364    HB3  ARG  44           2HB      ARG  44  -0.547  -6.306  10.246
  365    HG2  ARG  44           1HG      ARG  44  -2.670  -6.698  11.410
  366    HG3  ARG  44           2HG      ARG  44  -3.558  -6.432   9.890
  367    HD2  ARG  44           1HD      ARG  44  -2.561  -8.382   8.931
  368    HD3  ARG  44           2HD      ARG  44  -1.567  -8.623  10.385
  369    HE   ARG  44           HE       ARG  44  -4.367  -8.802  11.148
  370   HH11  ARG  44          1HH1      ARG  44  -2.011 -10.585   9.297
  371   HH12  ARG  44          2HH1      ARG  44  -2.834 -12.085   9.680
  372   HH21  ARG  44          1HH2      ARG  44  -5.327 -10.510  11.586
  373   HH22  ARG  44          2HH2      ARG  44  -4.727 -12.042  10.984
  374    H    LEU  45           H        LEU  45  -0.449  -3.608   7.998
  375    HA   LEU  45           HA       LEU  45   2.186  -3.087   9.043
  376    HB2  LEU  45           1HB      LEU  45   0.620  -2.123   6.747
  377    HB3  LEU  45           2HB      LEU  45   2.324  -1.629   6.877
  378    HG   LEU  45           HG       LEU  45   1.301  -4.483   6.606
  379   HD11  LEU  45          1HD1      LEU  45   2.391  -4.394   4.348
  380   HD12  LEU  45          2HD1      LEU  45   1.107  -3.170   4.495
  381   HD13  LEU  45          3HD1      LEU  45   2.815  -2.690   4.637
  382   HD21  LEU  45          3HD2      LEU  45   3.315  -4.366   7.951
  383   HD22  LEU  45          1HD2      LEU  45   3.684  -5.088   6.366
  384   HD23  LEU  45          2HD2      LEU  45   4.129  -3.396   6.699
  385    H    HIS  46           H        HIS  46  -0.700  -1.071   8.658
  386    HA   HIS  46           HA       HIS  46   0.507   1.403   9.438
  387    HB2  HIS  46           1HB      HIS  46  -1.751   1.287   8.421
  388    HB3  HIS  46           2HB      HIS  46  -2.358   0.438   9.862
  389    HD2  HIS  46           2HD      HIS  46  -3.369   2.172  11.845
  390    HE1  HIS  46           1HE      HIS  46  -1.612   5.684  10.226
  391    HE2  HIS  46           2HE      HIS  46  -3.205   4.659  12.048
  392    H    GLN  47           H        GLN  47  -1.023  -1.163  11.368
  393    HA   GLN  47           HA       GLN  47  -0.634   0.230  13.882
  394    HB2  GLN  47           1HB      GLN  47  -1.145  -2.659  13.161
  395    HB3  GLN  47           2HB      GLN  47  -1.003  -2.074  14.836
  396    HG2  GLN  47           1HG      GLN  47  -3.172  -0.550  14.318
  397    HG3  GLN  47           2HG      GLN  47  -2.839  -1.302  12.740
  398   HE21  GLN  47          2HE2      GLN  47  -5.322  -1.430  14.109
  399   HE22  GLN  47          1HE2      GLN  47  -5.617  -3.084  14.534
  400    H    ARG  48           H        ARG  48   1.275  -2.057  12.001
  401    HA   ARG  48           HA       ARG  48   3.247  -2.533  14.067
  402    HB2  ARG  48           1HB      ARG  48   3.270  -2.917  11.116
  403    HB3  ARG  48           2HB      ARG  48   4.686  -3.215  12.152
  404    HG2  ARG  48           1HG      ARG  48   3.489  -4.916  13.388
  405    HG3  ARG  48           2HG      ARG  48   1.987  -4.549  12.506
  406    HD2  ARG  48           1HD      ARG  48   3.005  -5.327  10.455
  407    HD3  ARG  48           2HD      ARG  48   4.504  -5.698  11.341
  408    HE   ARG  48           HE       ARG  48   2.442  -7.298  12.541
  409   HH11  ARG  48          1HH1      ARG  48   3.889  -6.991   9.382
  410   HH12  ARG  48          2HH1      ARG  48   3.590  -8.690   9.074
  411   HH21  ARG  48          1HH2      ARG  48   2.086  -9.244  12.199
  412   HH22  ARG  48          2HH2      ARG  48   2.561  -9.977  10.679
  413    H    GLY  49           H        GLY  49   2.774  -0.012  11.687
  414    HA2  GLY  49           1HA      GLY  49   3.718   2.169  12.015
  415    HA3  GLY  49           2HA      GLY  49   5.062   1.436  12.921
  416    H    VAL  50           H        VAL  50   3.963  -0.017   9.947
  417    HA   VAL  50           HA       VAL  50   6.564   0.647   8.642
  418    HB   VAL  50           HB       VAL  50   4.283  -1.182   7.780
  419   HG11  VAL  50          1HG1      VAL  50   5.908  -2.007   6.109
  420   HG12  VAL  50          2HG1      VAL  50   5.577  -0.274   5.879
  421   HG13  VAL  50          3HG1      VAL  50   7.090  -0.796   6.658
  422   HG21  VAL  50          3HG2      VAL  50   5.384  -2.012   9.772
  423   HG22  VAL  50          1HG2      VAL  50   5.796  -3.012   8.359
  424   HG23  VAL  50          2HG2      VAL  50   6.973  -1.836   8.991
  425    H    ILE  51           H        ILE  51   3.080   0.983   7.986
  426    HA   ILE  51           HA       ILE  51   3.806   3.277   6.184
  427    HB   ILE  51           HB       ILE  51   1.880   2.699   4.767
  428   HG12  ILE  51          1HG1      ILE  51   1.583   0.259   6.499
  429   HG13  ILE  51          2HG1      ILE  51   0.548   1.704   6.559
  430   HG21  ILE  51          1HG2      ILE  51   2.736   0.617   3.747
  431   HG22  ILE  51          2HG2      ILE  51   4.069   1.713   4.178
  432   HG23  ILE  51          3HG2      ILE  51   3.710   0.303   5.202
  433   HD11  ILE  51          3HD1      ILE  51   0.890  -0.140   4.169
  434   HD12  ILE  51          1HD1      ILE  51  -0.516  -0.098   5.258
  435   HD13  ILE  51          2HD1      ILE  51  -0.145   1.307   4.228
  436    H    TYR  52           H        TYR  52   1.997   4.767   5.790
  437    HA   TYR  52           HA       TYR  52   0.008   4.797   8.019
  438    HB2  TYR  52           1HB      TYR  52   0.326   7.063   8.481
  439    HB3  TYR  52           2HB      TYR  52   1.956   6.346   8.464
  440    HD1  TYR  52           2HD      TYR  52   3.489   6.808   6.572
  441    HD2  TYR  52           1HD      TYR  52  -0.310   8.723   6.855
  442    HE1  TYR  52           2HE      TYR  52   4.216   8.473   4.897
  443    HE2  TYR  52           1HE      TYR  52   0.402  10.400   5.177
  444    HH   TYR  52           HH       TYR  52   2.070  11.114   3.813
  445    H    ARG  53           H        ARG  53  -1.733   6.444   7.590
  446    HA   ARG  53           HA       ARG  53  -2.421   6.476   4.686
  447    HB2  ARG  53           1HB      ARG  53  -4.568   5.556   5.047
  448    HB3  ARG  53           2HB      ARG  53  -3.269   4.407   5.443
  449    HG2  ARG  53           1HG      ARG  53  -3.628   5.106   7.882
  450    HG3  ARG  53           2HG      ARG  53  -5.138   5.862   7.320
  451    HD2  ARG  53           1HD      ARG  53  -5.913   3.719   6.519
  452    HD3  ARG  53           2HD      ARG  53  -4.401   2.962   7.073
  453    HE   ARG  53           HE       ARG  53  -5.901   4.182   9.311
  454   HH11  ARG  53          1HH1      ARG  53  -5.675   1.336   7.308
  455   HH12  ARG  53          2HH1      ARG  53  -6.372   0.369   8.593
  456   HH21  ARG  53          1HH2      ARG  53  -6.706   3.089  10.789
  457   HH22  ARG  53          2HH2      ARG  53  -6.961   1.367  10.578
  458    H    LYS  54           H        LYS  54  -3.987   7.934   4.062
  459    HA   LYS  54           HA       LYS  54  -5.248   9.707   6.012
  460    HB2  LYS  54           1HB      LYS  54  -4.160  11.730   5.367
  461    HB3  LYS  54           2HB      LYS  54  -2.950  10.580   5.982
  462    HG2  LYS  54           1HG      LYS  54  -2.261  10.053   3.688
  463    HG3  LYS  54           2HG      LYS  54  -3.492  11.170   3.053
  464    HD2  LYS  54           1HD      LYS  54  -2.385  13.050   4.180
  465    HD3  LYS  54           2HD      LYS  54  -1.165  11.940   4.847
  466    HE2  LYS  54           1HE      LYS  54  -0.436  11.363   2.577
  467    HE3  LYS  54           2HE      LYS  54  -1.668  12.452   1.898
  468    HZ1  LYS  54           3HZ      LYS  54   0.592  13.273   3.609
  469    HZ2  LYS  54           1HZ      LYS  54   0.495  13.493   1.976
  470    HZ3  LYS  54           2HZ      LYS  54  -0.550  14.283   2.980
  471    H    TRP  55           H        TRP  55  -6.611  11.308   5.056
  472    HA   TRP  55           HA       TRP  55  -7.679  10.295   2.461
  473    HB2  TRP  55           1HB      TRP  55  -8.889  12.033   4.655
  474    HB3  TRP  55           2HB      TRP  55  -9.695  11.673   3.109
  475    HD1  TRP  55           HD       TRP  55  -8.636  10.143   6.316
  476    HE1  TRP  55           1HE      TRP  55  -9.982   7.829   6.695
  477    HE3  TRP  55           3HE      TRP  55 -10.868   9.838   1.758
  478    HZ2  TRP  55           2HZ      TRP  55 -11.684   6.273   5.174
  479    HZ3  TRP  55           3HZ      TRP  55 -12.318   7.974   1.241
  480    HH2  TRP  55           HH       TRP  55 -12.762   6.194   2.875
  481    H    ARG  56           H        ARG  56  -6.993  11.220   0.707
  482    HA   ARG  56           HA       ARG  56  -6.403  14.157   0.776
  483    HB2  ARG  56           1HB      ARG  56  -4.541  12.852   0.130
  484    HB3  ARG  56           2HB      ARG  56  -5.498  12.054  -1.141
  485    HG2  ARG  56           1HG      ARG  56  -5.711  14.139  -2.354
  486    HG3  ARG  56           2HG      ARG  56  -4.897  15.026  -1.042
  487    HD2  ARG  56           1HD      ARG  56  -3.403  14.726  -2.861
  488    HD3  ARG  56           2HD      ARG  56  -2.868  13.737  -1.481
  489    HE   ARG  56           HE       ARG  56  -3.278  11.747  -2.896
  490   HH11  ARG  56          1HH1      ARG  56  -4.554  14.600  -4.443
  491   HH12  ARG  56          2HH1      ARG  56  -4.735  13.713  -5.943
  492   HH21  ARG  56          1HH2      ARG  56  -3.487  10.715  -4.604
  493   HH22  ARG  56          2HH2      ARG  56  -4.127  11.497  -6.037
  494    H    HIS  57           H        HIS  57  -7.647  15.553  -0.177
  495    HA   HIS  57           HA       HIS  57 -10.065  14.712  -1.545
  496    HB2  HIS  57           1HB      HIS  57  -9.804  16.853  -0.185
  497    HB3  HIS  57           2HB      HIS  57  -8.834  17.496  -1.531
  498    HD1  HIS  57           1HD      HIS  57 -10.088  17.832  -3.831
  499    HD2  HIS  57           2HD      HIS  57 -12.636  16.963  -0.590
  500    HE1  HIS  57           1HE      HIS  57 -12.324  18.526  -4.528
  501    H    PHE  58           H        PHE  58 -10.554  14.492  -3.601
  502    HA   PHE  58           HA       PHE  58  -8.812  15.524  -5.726
  503    HB2  PHE  58           1HB      PHE  58  -7.581  13.467  -5.029
  504    HB3  PHE  58           2HB      PHE  58  -9.051  12.511  -5.322
  505    HD1  PHE  58           1HD      PHE  58  -6.671  14.819  -7.018
  506    HD2  PHE  58           2HD      PHE  58  -9.427  11.575  -7.376
  507    HE1  PHE  58           1HE      PHE  58  -6.000  14.511  -9.376
  508    HE2  PHE  58           2HE      PHE  58  -8.756  11.262  -9.735
  509    HZ   PHE  58           HZ       PHE  58  -7.043  12.733 -10.736
  510    H    SER  59           H        SER  59 -10.117  16.259  -7.184
  511    HA   SER  59           HA       SER  59 -11.900  16.312  -8.768
  512    HB2  SER  59           1HB      SER  59 -11.870  13.390  -8.314
  513    HB3  SER  59           2HB      SER  59 -12.724  14.283  -9.595
  514    HG   SER  59           HG       SER  59 -10.674  15.058 -10.274
  515    H    GLY  60           H        GLY  60 -12.405  16.597  -5.790
  516    HA2  GLY  60           1HA      GLY  60 -14.471  17.502  -5.015
  517    HA3  GLY  60           2HA      GLY  60 -15.347  16.441  -6.143
  518    H    ARG  61           H        ARG  61 -13.173  14.390  -4.997
  519    HA   ARG  61           HA       ARG  61 -14.739  13.681  -2.543
  520    HB2  ARG  61           1HB      ARG  61 -14.068  11.831  -4.786
  521    HB3  ARG  61           2HB      ARG  61 -14.653  11.346  -3.177
  522    HG2  ARG  61           1HG      ARG  61 -16.737  12.585  -3.555
  523    HG3  ARG  61           2HG      ARG  61 -16.151  13.089  -5.159
  524    HD2  ARG  61           1HD      ARG  61 -16.126  10.775  -5.869
  525    HD3  ARG  61           2HD      ARG  61 -16.722  10.279  -4.268
  526    HE   ARG  61           HE       ARG  61 -18.704  12.047  -5.403
  527   HH11  ARG  61          1HH1      ARG  61 -17.326   8.922  -6.113
  528   HH12  ARG  61          2HH1      ARG  61 -18.839   8.416  -6.841
  529   HH21  ARG  61          1HH2      ARG  61 -20.437  11.485  -6.242
  530   HH22  ARG  61          2HH2      ARG  61 -20.613   9.876  -6.916
  531    H    LYS  62           H        LYS  62 -13.678  12.705  -0.914
  532    HA   LYS  62           HA       LYS  62 -10.718  12.820  -1.065
  533    HB2  LYS  62           1HB      LYS  62 -12.664  12.328   1.191
  534    HB3  LYS  62           2HB      LYS  62 -10.893  12.267   1.364
  535    HG2  LYS  62           1HG      LYS  62 -10.740  14.628   0.699
  536    HG3  LYS  62           2HG      LYS  62 -12.508  14.692   0.506
  537    HD2  LYS  62           1HD      LYS  62 -12.779  14.142   2.900
  538    HD3  LYS  62           2HD      LYS  62 -11.010  14.117   3.085
  539    HE2  LYS  62           1HE      LYS  62 -10.899  16.475   2.415
  540    HE3  LYS  62           2HE      LYS  62 -12.664  16.505   2.207
  541    HZ1  LYS  62           3HZ      LYS  62 -11.245  16.009   4.745
  542    HZ2  LYS  62           1HZ      LYS  62 -12.002  17.413   4.329
  543    HZ3  LYS  62           2HZ      LYS  62 -12.884  16.036   4.553
  544    H    TYR  63           H        TYR  63  -9.364  11.175  -1.060
  545    HA   TYR  63           HA       TYR  63 -10.521   8.423  -0.766
  546    HB2  TYR  63           1HB      TYR  63 -10.177   8.892  -3.126
  547    HB3  TYR  63           2HB      TYR  63  -8.502   9.397  -2.795
  548    HD1  TYR  63           1HD      TYR  63 -10.808   6.467  -2.684
  549    HD2  TYR  63           2HD      TYR  63  -6.757   7.799  -2.732
  550    HE1  TYR  63           1HE      TYR  63 -10.051   4.128  -2.984
  551    HE2  TYR  63           2HE      TYR  63  -5.984   5.471  -3.031
  552    HH   TYR  63           HH       TYR  63  -8.274   2.736  -3.241
  553    H    ARG  64           H        ARG  64  -9.431   6.996   0.395
  554    HA   ARG  64           HA       ARG  64  -7.215   8.043   2.026
  555    HB2  ARG  64           1HB      ARG  64  -9.145   6.665   2.861
  556    HB3  ARG  64           2HB      ARG  64  -8.295   5.278   2.140
  557    HG2  ARG  64           1HG      ARG  64  -6.392   5.612   3.567
  558    HG3  ARG  64           2HG      ARG  64  -7.053   7.150   4.174
  559    HD2  ARG  64           1HD      ARG  64  -7.340   5.548   5.851
  560    HD3  ARG  64           2HD      ARG  64  -8.939   5.844   5.127
  561    HE   ARG  64           HE       ARG  64  -7.677   3.391   4.056
  562   HH11  ARG  64          1HH1      ARG  64  -9.556   4.661   6.705
  563   HH12  ARG  64          2HH1      ARG  64 -10.235   3.071   6.992
  564   HH21  ARG  64          1HH2      ARG  64  -8.440   1.563   4.378
  565   HH22  ARG  64          2HH2      ARG  64  -9.600   1.303   5.666
  566    H    GLU  65           H        GLU  65  -5.192   7.958   1.513
  567    HA   GLU  65           HA       GLU  65  -4.283   5.754  -0.313
  568    HB2  GLU  65           1HB      GLU  65  -3.102   8.498   0.143
  569    HB3  GLU  65           2HB      GLU  65  -2.459   7.241  -0.942
  570    HG2  GLU  65           1HG      GLU  65  -4.609   7.434  -2.323
  571    HG3  GLU  65           2HG      GLU  65  -5.069   8.683  -1.143
  572    H    TYR  66           H        TYR  66  -2.179   4.904  -0.011
  573    HA   TYR  66           HA       TYR  66  -1.332   4.999   2.869
  574    HB2  TYR  66           1HB      TYR  66  -1.413   2.661   0.952
  575    HB3  TYR  66           2HB      TYR  66  -0.640   2.641   2.555
  576    HD1  TYR  66           1HD      TYR  66  -3.920   3.066   0.833
  577    HD2  TYR  66           2HD      TYR  66  -1.919   2.213   4.501
  578    HE1  TYR  66           1HE      TYR  66  -6.088   2.449   1.862
  579    HE2  TYR  66           2HE      TYR  66  -4.072   1.593   5.544
  580    HH   TYR  66           HH       TYR  66  -6.316   1.329   5.241
  581    H    CYS  67           H        CYS  67   0.762   5.139   3.359
  582    HA   CYS  67           HA       CYS  67   2.728   5.425   1.076
  583    HB2  CYS  67           1HB      CYS  67   1.559   7.561   1.548
  584    HB3  CYS  67           2HB      CYS  67   2.008   7.423   3.264
  585    HG   CYS  67           HG       CYS  67   4.546   7.479   2.870
  586    H    LEU  68           H        LEU  68   4.796   4.914   1.618
  587    HA   LEU  68           HA       LEU  68   5.159   3.351   4.057
  588    HB2  LEU  68           1HB      LEU  68   6.020   2.837   1.897
  589    HB3  LEU  68           2HB      LEU  68   7.215   4.152   1.923
  590    HG   LEU  68           HG       LEU  68   8.154   3.115   4.035
  591   HD11  LEU  68          1HD1      LEU  68   7.619   0.694   4.418
  592   HD12  LEU  68          2HD1      LEU  68   6.173   1.712   4.602
  593   HD13  LEU  68          3HD1      LEU  68   6.414   0.769   3.112
  594   HD21  LEU  68          3HD2      LEU  68   9.264   2.874   1.892
  595   HD22  LEU  68          1HD2      LEU  68   9.423   1.370   2.832
  596   HD23  LEU  68          2HD2      LEU  68   8.251   1.466   1.493
  597    H    LYS  69           H        LYS  69   6.179   3.792   5.880
  598    HA   LYS  69           HA       LYS  69   6.626   6.662   6.412
  599    HB2  LYS  69           1HB      LYS  69   6.643   4.200   8.159
  600    HB3  LYS  69           2HB      LYS  69   6.965   5.849   8.745
  601    HG2  LYS  69           1HG      LYS  69   4.721   6.553   8.145
  602    HG3  LYS  69           2HG      LYS  69   4.389   4.973   7.397
  603    HD2  LYS  69           1HD      LYS  69   3.353   4.992   9.568
  604    HD3  LYS  69           2HD      LYS  69   4.765   3.911   9.639
  605    HE2  LYS  69           1HE      LYS  69   6.095   5.675  10.677
  606    HE3  LYS  69           2HE      LYS  69   4.729   6.804  10.550
  607    HZ1  LYS  69           3HZ      LYS  69   4.762   4.326  12.151
  608    HZ2  LYS  69           1HZ      LYS  69   4.898   5.856  12.750
  609    HZ3  LYS  69           2HZ      LYS  69   3.493   5.374  12.034
  610    H    HIS  70           H        HIS  70   8.512   4.107   5.338
  611    HA   HIS  70           HA       HIS  70  10.945   5.180   6.727
  612    HB2  HIS  70           1HB      HIS  70  10.394   2.286   5.929
  613    HB3  HIS  70           2HB      HIS  70  11.841   2.902   6.765
  614    HD2  HIS  70           2HD      HIS  70   8.210   1.641   7.651
  615    HE1  HIS  70           1HE      HIS  70  10.118   3.095  11.156
  616    HE2  HIS  70           2HE      HIS  70   8.069   1.796  10.142
  617    H    ARG  71           H        ARG  71  11.489   6.574   5.090
  618    HA   ARG  71           HA       ARG  71  11.777   5.755   2.339
  619    HB2  ARG  71           1HB      ARG  71  12.974   8.013   3.871
  620    HB3  ARG  71           2HB      ARG  71  13.248   7.714   2.139
  621    HG2  ARG  71           1HG      ARG  71  10.889   7.998   1.669
  622    HG3  ARG  71           2HG      ARG  71  10.528   8.156   3.405
  623    HD2  ARG  71           1HD      ARG  71  10.456  10.289   2.372
  624    HD3  ARG  71           2HD      ARG  71  11.864  10.201   3.458
  625    HE   ARG  71           HE       ARG  71  12.682   9.737   0.673
  626   HH11  ARG  71          1HH1      ARG  71  11.770  12.277   2.880
  627   HH12  ARG  71          2HH1      ARG  71  12.740  13.421   1.973
  628   HH21  ARG  71          1HH2      ARG  71  13.789  11.036  -0.382
  629   HH22  ARG  71          2HH2      ARG  71  13.891  12.715   0.112
  630    H    ASP  72           H        ASP  72  13.852   5.508   5.155
  631    HA   ASP  72           HA       ASP  72  16.264   4.799   3.746
  632    HB2  ASP  72           1HB      ASP  72  15.330   4.109   6.596
  633    HB3  ASP  72           2HB      ASP  72  16.850   3.679   5.774
  634    H    GLU  73           H        GLU  73  13.575   2.852   5.023
  635    HA   GLU  73           HA       GLU  73  14.701   0.358   3.996
  636    HB2  GLU  73           1HB      GLU  73  11.940   1.130   4.944
  637    HB3  GLU  73           2HB      GLU  73  12.419  -0.514   4.460
  638    HG2  GLU  73           1HG      GLU  73  14.115  -0.523   6.364
  639    HG3  GLU  73           2HG      GLU  73  13.545   1.129   6.690
  640    H    LEU  74           H        LEU  74  12.538   2.846   2.784
  641    HA   LEU  74           HA       LEU  74  11.565   1.516   0.475
  642    HB2  LEU  74           1HB      LEU  74  11.056   3.708   1.433
  643    HB3  LEU  74           2HB      LEU  74  12.423   4.453   0.572
  644    HG   LEU  74           HG       LEU  74  10.224   2.889  -0.817
  645   HD11  LEU  74          1HD1      LEU  74   9.265   5.116  -1.462
  646   HD12  LEU  74          2HD1      LEU  74   9.242   4.890   0.302
  647   HD13  LEU  74          3HD1      LEU  74  10.485   5.919  -0.447
  648   HD21  LEU  74          3HD2      LEU  74  12.310   3.060  -2.041
  649   HD22  LEU  74          1HD2      LEU  74  11.060   4.052  -2.830
  650   HD23  LEU  74          2HD2      LEU  74  12.318   4.828  -1.838
  651    H    ALA  75           H        ALA  75  14.608   3.324   0.910
  652    HA   ALA  75           HA       ALA  75  15.564   2.820  -1.743
  653    HB1  ALA  75           1HB      ALA  75  17.767   3.451  -0.835
  654    HB2  ALA  75           2HB      ALA  75  16.498   4.586  -0.318
  655    HB3  ALA  75           3HB      ALA  75  17.110   3.359   0.816
  656    H    ASP  76           H        ASP  76  15.853   1.023   1.294
  657    HA   ASP  76           HA       ASP  76  17.682  -0.971   0.298
  658    HB2  ASP  76           1HB      ASP  76  15.639  -1.091   2.598
  659    HB3  ASP  76           2HB      ASP  76  16.781  -2.337   2.038
  660    H    LEU  77           H        LEU  77  14.155  -0.694   0.253
  661    HA   LEU  77           HA       LEU  77  13.727  -3.323  -0.891
  662    HB2  LEU  77           1HB      LEU  77  12.226  -0.796  -0.812
  663    HB3  LEU  77           2HB      LEU  77  11.451  -2.220  -1.542
  664    HG   LEU  77           HG       LEU  77  12.417  -2.050   1.336
  665   HD11  LEU  77          1HD1      LEU  77   9.982  -1.927   1.927
  666   HD12  LEU  77          2HD1      LEU  77  10.479  -0.534   0.938
  667   HD13  LEU  77          3HD1      LEU  77   9.580  -1.879   0.195
  668   HD21  LEU  77          3HD2      LEU  77  12.426  -4.302   0.439
  669   HD22  LEU  77          1HD2      LEU  77  11.118  -4.130   1.632
  670   HD23  LEU  77          2HD2      LEU  77  10.743  -4.123  -0.109
  671    H    GLU  78           H        GLU  78  14.188  -0.084  -2.254
  672    HA   GLU  78           HA       GLU  78  13.697  -0.859  -4.987
  673    HB2  GLU  78           1HB      GLU  78  13.661   1.457  -4.196
  674    HB3  GLU  78           2HB      GLU  78  15.404   1.360  -3.847
  675    HG2  GLU  78           1HG      GLU  78  15.822   1.011  -6.344
  676    HG3  GLU  78           2HG      GLU  78  14.053   1.124  -6.503
  677    H    HIS  79           H        HIS  79  16.651  -0.722  -3.017
  678    HA   HIS  79           HA       HIS  79  18.308  -1.532  -5.308
  679    HB2  HIS  79           1HB      HIS  79  18.991  -1.217  -2.348
  680    HB3  HIS  79           2HB      HIS  79  20.160  -1.492  -3.662
  681    HD1  HIS  79           1HD      HIS  79  20.925   0.853  -2.290
  682    HD2  HIS  79           2HD      HIS  79  17.834   1.118  -5.142
  683    HE1  HIS  79           1HE      HIS  79  20.740   3.221  -2.865
  Start of MODEL   15
    1    H    LYS   3           H        LYS   3   6.488 -12.527  -9.633
    2    HA   LYS   3           HA       LYS   3   6.151 -10.391  -7.800
    3    HB2  LYS   3           1HB      LYS   3   4.592 -10.121 -10.374
    4    HB3  LYS   3           2HB      LYS   3   4.220  -9.262  -8.861
    5    HG2  LYS   3           1HG      LYS   3   6.418  -8.148  -8.958
    6    HG3  LYS   3           2HG      LYS   3   6.777  -8.999 -10.479
    7    HD2  LYS   3           1HD      LYS   3   4.821  -7.913 -11.534
    8    HD3  LYS   3           2HD      LYS   3   4.502  -7.038 -10.016
    9    HE2  LYS   3           1HE      LYS   3   6.643  -5.902 -10.174
   10    HE3  LYS   3           2HE      LYS   3   7.070  -6.845 -11.620
   11    HZ1  LYS   3           3HZ      LYS   3   4.841  -4.922 -11.424
   12    HZ2  LYS   3           1HZ      LYS   3   6.276  -4.651 -12.191
   13    HZ3  LYS   3           2HZ      LYS   3   5.237  -5.798 -12.766
   14    H    ALA   4           H        ALA   4   4.622 -12.802  -9.873
   15    HA   ALA   4           HA       ALA   4   2.390 -13.192  -8.039
   16    HB1  ALA   4           1HB      ALA   4   1.852 -15.114  -9.486
   17    HB2  ALA   4           2HB      ALA   4   2.139 -13.637 -10.438
   18    HB3  ALA   4           3HB      ALA   4   3.394 -14.894 -10.345
   19    H    LYS   5           H        LYS   5   5.619 -14.431  -8.374
   20    HA   LYS   5           HA       LYS   5   5.250 -16.833  -6.800
   21    HB2  LYS   5           1HB      LYS   5   7.657 -15.115  -7.403
   22    HB3  LYS   5           2HB      LYS   5   7.727 -16.629  -6.471
   23    HG2  LYS   5           1HG      LYS   5   6.870 -17.869  -8.418
   24    HG3  LYS   5           2HG      LYS   5   6.798 -16.356  -9.351
   25    HD2  LYS   5           1HD      LYS   5   9.235 -16.085  -9.097
   26    HD3  LYS   5           2HD      LYS   5   9.305 -17.605  -8.172
   27    HE2  LYS   5           1HE      LYS   5   8.463 -18.839 -10.115
   28    HE3  LYS   5           2HE      LYS   5   8.357 -17.324 -11.042
   29    HZ1  LYS   5           3HZ      LYS   5  10.838 -18.509  -9.972
   30    HZ2  LYS   5           1HZ      LYS   5  10.364 -18.541 -11.551
   31    HZ3  LYS   5           2HZ      LYS   5  10.740 -17.103 -10.831
   32    H    LEU   6           H        LEU   6   5.863 -13.461  -6.010
   33    HA   LEU   6           HA       LEU   6   6.181 -14.082  -3.146
   34    HB2  LEU   6           1HB      LEU   6   5.772 -11.588  -4.664
   35    HB3  LEU   6           2HB      LEU   6   6.200 -11.541  -2.937
   36    HG   LEU   6           HG       LEU   6   7.931 -12.544  -5.231
   37   HD11  LEU   6          1HD1      LEU   6   9.430 -10.651  -4.550
   38   HD12  LEU   6          2HD1      LEU   6   7.819 -10.061  -5.022
   39   HD13  LEU   6          3HD1      LEU   6   8.253 -10.188  -3.301
   40   HD21  LEU   6          3HD2      LEU   6   8.243 -13.934  -3.269
   41   HD22  LEU   6          1HD2      LEU   6   9.676 -12.911  -3.521
   42   HD23  LEU   6          2HD2      LEU   6   8.498 -12.495  -2.254
   43    H    SER   7           H        SER   7   4.811 -13.372  -1.492
   44    HA   SER   7           HA       SER   7   1.966 -13.819  -1.908
   45    HB2  SER   7           1HB      SER   7   1.676 -13.426   0.280
   46    HB3  SER   7           2HB      SER   7   3.221 -14.292   0.111
   47    HG   SER   7           HG       SER   7   3.466 -12.603   1.558
   48    H    LEU   8           H        LEU   8   0.316 -12.228  -1.271
   49    HA   LEU   8           HA       LEU   8   0.502  -9.798  -2.808
   50    HB2  LEU   8           1HB      LEU   8  -1.295 -10.798  -0.705
   51    HB3  LEU   8           2HB      LEU   8  -1.707  -9.273  -1.523
   52    HG   LEU   8           HG       LEU   8  -1.494 -12.026  -2.804
   53   HD11  LEU   8          1HD1      LEU   8  -3.954 -11.731  -3.202
   54   HD12  LEU   8          2HD1      LEU   8  -3.570 -11.687  -1.467
   55   HD13  LEU   8          3HD1      LEU   8  -3.890 -10.173  -2.346
   56   HD21  LEU   8          3HD2      LEU   8  -0.705 -10.301  -4.316
   57   HD22  LEU   8          1HD2      LEU   8  -2.282 -10.917  -4.867
   58   HD23  LEU   8          2HD2      LEU   8  -2.180  -9.343  -4.039
   59    H    THR   9           H        THR   9   0.896 -10.511   0.635
   60    HA   THR   9           HA       THR   9   1.290  -7.797   1.486
   61    HB   THR   9           HB       THR   9   2.460 -10.396   2.563
   62    HG1  THR   9           1HG      THR   9   0.173  -8.823   3.224
   63   HG21  THR   9          3HG2      THR   9   2.330  -7.623   3.810
   64   HG22  THR   9          1HG2      THR   9   2.897  -9.102   4.619
   65   HG23  THR   9          2HG2      THR   9   3.806  -8.438   3.239
   66    H    GLN  10           H        GLN  10   3.625 -10.270   0.403
   67    HA   GLN  10           HA       GLN  10   5.918  -8.557   0.591
   68    HB2  GLN  10           1HB      GLN  10   5.301 -10.967  -1.125
   69    HB3  GLN  10           2HB      GLN  10   6.884 -10.157  -1.094
   70    HG2  GLN  10           1HG      GLN  10   7.047 -10.862   1.490
   71    HG3  GLN  10           2HG      GLN  10   5.388 -11.349   1.073
   72   HE21  GLN  10          2HE2      GLN  10   8.800 -12.112   0.847
   73   HE22  GLN  10          1HE2      GLN  10   8.610 -13.720   0.234
   74    H    LEU  11           H        LEU  11   3.566  -9.101  -1.990
   75    HA   LEU  11           HA       LEU  11   5.037  -7.678  -4.018
   76    HB2  LEU  11           1HB      LEU  11   3.348  -9.227  -4.429
   77    HB3  LEU  11           2HB      LEU  11   2.031  -8.238  -3.756
   78    HG   LEU  11           HG       LEU  11   2.498  -6.511  -5.492
   79   HD11  LEU  11          1HD1      LEU  11   3.918  -7.166  -7.452
   80   HD12  LEU  11          2HD1      LEU  11   4.869  -7.131  -5.948
   81   HD13  LEU  11          3HD1      LEU  11   4.331  -8.686  -6.627
   82   HD21  LEU  11          3HD2      LEU  11   0.716  -8.123  -5.822
   83   HD22  LEU  11          1HD2      LEU  11   1.495  -7.751  -7.379
   84   HD23  LEU  11          2HD2      LEU  11   1.858  -9.281  -6.544
   85    H    ILE  12           H        ILE  12   2.584  -6.654  -1.665
   86    HA   ILE  12           HA       ILE  12   2.511  -3.888  -2.469
   87    HB   ILE  12           HB       ILE  12   2.074  -5.246   0.226
   88   HG12  ILE  12          1HG1      ILE  12   0.103  -3.995  -1.664
   89   HG13  ILE  12          2HG1      ILE  12   0.512  -5.727  -1.633
   90   HG21  ILE  12          1HG2      ILE  12   1.096  -3.099   0.962
   91   HG22  ILE  12          2HG2      ILE  12   2.818  -2.911   0.560
   92   HG23  ILE  12          3HG2      ILE  12   1.573  -2.352  -0.581
   93   HD11  ILE  12          3HD1      ILE  12  -0.692  -4.141   0.664
   94   HD12  ILE  12          1HD1      ILE  12  -1.566  -5.280  -0.386
   95   HD13  ILE  12          2HD1      ILE  12  -0.282  -5.873   0.696
   96    H    LEU  13           H        LEU  13   4.649  -5.624  -0.238
   97    HA   LEU  13           HA       LEU  13   6.076  -3.285   0.619
   98    HB2  LEU  13           1HB      LEU  13   6.822  -6.119   0.326
   99    HB3  LEU  13           2HB      LEU  13   7.881  -5.018   1.235
  100    HG   LEU  13           HG       LEU  13   5.026  -5.777   1.964
  101   HD11  LEU  13          1HD1      LEU  13   6.101  -6.928   3.918
  102   HD12  LEU  13          2HD1      LEU  13   6.667  -7.609   2.375
  103   HD13  LEU  13          3HD1      LEU  13   7.701  -6.478   3.281
  104   HD21  LEU  13          3HD2      LEU  13   5.539  -3.495   2.602
  105   HD22  LEU  13          1HD2      LEU  13   5.448  -4.523   4.051
  106   HD23  LEU  13          2HD2      LEU  13   7.032  -4.026   3.411
  107    H    ILE  14           H        ILE  14   6.503  -5.464  -2.130
  108    HA   ILE  14           HA       ILE  14   8.967  -4.260  -3.070
  109    HB   ILE  14           HB       ILE  14   6.755  -5.780  -4.520
  110   HG12  ILE  14          1HG1      ILE  14   7.910  -7.085  -2.877
  111   HG13  ILE  14          2HG1      ILE  14   8.295  -7.621  -4.529
  112   HG21  ILE  14          1HG2      ILE  14   8.372  -5.991  -6.377
  113   HG22  ILE  14          2HG2      ILE  14   7.965  -4.287  -6.076
  114   HG23  ILE  14          3HG2      ILE  14   9.513  -4.946  -5.503
  115   HD11  ILE  14          3HD1      ILE  14  10.072  -5.909  -2.755
  116   HD12  ILE  14          1HD1      ILE  14  10.300  -7.638  -3.098
  117   HD13  ILE  14          2HD1      ILE  14  10.456  -6.443  -4.408
  118    H    ARG  15           H        ARG  15   5.558  -3.544  -3.685
  119    HA   ARG  15           HA       ARG  15   6.110  -1.510  -5.663
  120    HB2  ARG  15           1HB      ARG  15   3.978  -2.667  -5.421
  121    HB3  ARG  15           2HB      ARG  15   3.699  -1.751  -3.922
  122    HG2  ARG  15           1HG      ARG  15   2.503  -0.695  -5.746
  123    HG3  ARG  15           2HG      ARG  15   3.840   0.356  -5.218
  124    HD2  ARG  15           1HD      ARG  15   5.160  -0.380  -7.103
  125    HD3  ARG  15           2HD      ARG  15   3.827  -1.434  -7.628
  126    HE   ARG  15           HE       ARG  15   2.789   1.243  -7.650
  127   HH11  ARG  15          1HH1      ARG  15   5.361  -0.481  -9.254
  128   HH12  ARG  15          2HH1      ARG  15   5.178   0.545 -10.663
  129   HH21  ARG  15          1HH2      ARG  15   2.572   2.432  -9.251
  130   HH22  ARG  15          2HH2      ARG  15   3.589   2.208 -10.662
  131    H    LEU  16           H        LEU  16   5.877  -1.486  -2.148
  132    HA   LEU  16           HA       LEU  16   5.967   1.378  -1.850
  133    HB2  LEU  16           1HB      LEU  16   6.791  -0.929  -0.229
  134    HB3  LEU  16           2HB      LEU  16   6.948   0.691   0.487
  135    HG   LEU  16           HG       LEU  16   4.354  -0.589  -0.457
  136   HD11  LEU  16          1HD1      LEU  16   3.788  -0.683   1.987
  137   HD12  LEU  16          2HD1      LEU  16   5.240  -1.644   1.621
  138   HD13  LEU  16          3HD1      LEU  16   5.402  -0.036   2.367
  139   HD21  LEU  16          3HD2      LEU  16   4.341   1.821  -0.709
  140   HD22  LEU  16          1HD2      LEU  16   3.266   1.346   0.627
  141   HD23  LEU  16          2HD2      LEU  16   4.873   2.030   0.977
  142    H    SER  17           H        SER  17   8.468  -1.084  -2.244
  143    HA   SER  17           HA       SER  17  10.761   0.686  -1.871
  144    HB2  SER  17           1HB      SER  17  10.475  -1.929  -3.222
  145    HB3  SER  17           2HB      SER  17  11.989  -1.028  -2.977
  146    HG   SER  17           HG       SER  17  11.576  -2.564  -1.321
  147    H    ASN  18           H        ASN  18   8.774  -0.364  -4.649
  148    HA   ASN  18           HA       ASN  18  10.498   0.870  -6.638
  149    HB2  ASN  18           1HB      ASN  18   7.589  -0.167  -7.017
  150    HB3  ASN  18           2HB      ASN  18   8.779   0.672  -8.039
  151   HD21  ASN  18          2HD2      ASN  18   7.537  -2.023  -8.182
  152   HD22  ASN  18          1HD2      ASN  18   8.868  -3.128  -8.289
  153    H    ARG  19           H        ARG  19   7.597   1.881  -4.885
  154    HA   ARG  19           HA       ARG  19   7.979   4.622  -6.014
  155    HB2  ARG  19           1HB      ARG  19   5.384   3.148  -5.944
  156    HB3  ARG  19           2HB      ARG  19   5.586   4.892  -6.236
  157    HG2  ARG  19           1HG      ARG  19   6.811   2.717  -7.958
  158    HG3  ARG  19           2HG      ARG  19   5.262   3.517  -8.311
  159    HD2  ARG  19           1HD      ARG  19   6.429   5.655  -8.435
  160    HD3  ARG  19           2HD      ARG  19   7.968   4.804  -8.166
  161    HE   ARG  19           HE       ARG  19   6.497   4.806 -10.761
  162   HH11  ARG  19          1HH1      ARG  19   9.062   3.401  -8.863
  163   HH12  ARG  19          2HH1      ARG  19   9.791   2.750 -10.319
  164   HH21  ARG  19          1HH2      ARG  19   7.323   4.075 -12.438
  165   HH22  ARG  19          2HH2      ARG  19   8.801   3.136 -12.358
  166    H    GLY  20           H        GLY  20   7.839   6.214  -4.625
  167    HA2  GLY  20           1HA      GLY  20   7.963   5.683  -1.850
  168    HA3  GLY  20           2HA      GLY  20   7.685   7.280  -2.580
  169    H    CYS  21           H        CYS  21   5.259   6.884  -3.855
  170    HA   CYS  21           HA       CYS  21   3.324   6.161  -1.640
  171    HB2  CYS  21           1HB      CYS  21   3.988   8.537  -1.504
  172    HB3  CYS  21           2HB      CYS  21   3.591   8.754  -3.227
  173    HG   CYS  21           HG       CYS  21   1.897   9.955  -1.764
  174    H    GLN  22           H        GLN  22   1.440   5.320  -2.362
  175    HA   GLN  22           HA       GLN  22   0.759   5.548  -5.252
  176    HB2  GLN  22           1HB      GLN  22   0.950   2.971  -3.677
  177    HB3  GLN  22           2HB      GLN  22   0.191   3.137  -5.278
  178    HG2  GLN  22           1HG      GLN  22   3.270   3.634  -4.872
  179    HG3  GLN  22           2HG      GLN  22   2.293   2.184  -5.197
  180   HE21  GLN  22          2HE2      GLN  22   3.291   5.358  -6.403
  181   HE22  GLN  22          1HE2      GLN  22   2.908   5.060  -8.066
  182    H    THR  23           H        THR  23  -1.378   5.376  -5.767
  183    HA   THR  23           HA       THR  23  -3.251   5.848  -3.545
  184    HB   THR  23           HB       THR  23  -3.793   5.547  -6.529
  185    HG1  THR  23           1HG      THR  23  -3.835   7.871  -6.431
  186   HG21  THR  23          3HG2      THR  23  -5.450   6.738  -4.268
  187   HG22  THR  23          1HG2      THR  23  -5.895   6.730  -5.991
  188   HG23  THR  23          2HG2      THR  23  -5.775   5.196  -5.094
  189    H    LEU  24           H        LEU  24  -4.837   4.587  -2.803
  190    HA   LEU  24           HA       LEU  24  -4.447   1.833  -2.624
  191    HB2  LEU  24           1HB      LEU  24  -5.824   3.026  -1.238
  192    HB3  LEU  24           2HB      LEU  24  -7.059   3.429  -2.453
  193    HG   LEU  24           HG       LEU  24  -7.521   0.973  -2.698
  194   HD11  LEU  24          1HD1      LEU  24  -6.715  -0.538  -0.863
  195   HD12  LEU  24          2HD1      LEU  24  -5.354   0.142  -1.787
  196   HD13  LEU  24          3HD1      LEU  24  -5.770   0.811  -0.190
  197   HD21  LEU  24          3HD2      LEU  24  -8.965   2.384  -1.354
  198   HD22  LEU  24          1HD2      LEU  24  -8.821   0.775  -0.607
  199   HD23  LEU  24          2HD2      LEU  24  -7.916   2.153   0.066
  200    H    GLU  25           H        GLU  25  -6.490   3.535  -4.993
  201    HA   GLU  25           HA       GLU  25  -7.423   1.122  -6.270
  202    HB2  GLU  25           1HB      GLU  25  -7.201   3.987  -7.193
  203    HB3  GLU  25           2HB      GLU  25  -7.925   2.687  -8.170
  204    HG2  GLU  25           1HG      GLU  25  -9.688   2.364  -6.375
  205    HG3  GLU  25           2HG      GLU  25  -8.806   3.614  -5.468
  206    H    GLU  26           H        GLU  26  -4.600   3.181  -6.758
  207    HA   GLU  26           HA       GLU  26  -3.720   1.918  -9.199
  208    HB2  GLU  26           1HB      GLU  26  -2.293   3.424  -7.008
  209    HB3  GLU  26           2HB      GLU  26  -1.470   2.790  -8.454
  210    HG2  GLU  26           1HG      GLU  26  -2.823   4.294  -9.914
  211    HG3  GLU  26           2HG      GLU  26  -3.791   4.668  -8.470
  212    H    LEU  27           H        LEU  27  -3.114   1.233  -5.768
  213    HA   LEU  27           HA       LEU  27  -1.332  -0.982  -6.249
  214    HB2  LEU  27           1HB      LEU  27  -1.484   0.145  -4.235
  215    HB3  LEU  27           2HB      LEU  27  -3.157  -0.335  -3.869
  216    HG   LEU  27           HG       LEU  27  -2.367  -2.735  -3.878
  217   HD11  LEU  27          1HD1      LEU  27   0.095  -3.107  -3.561
  218   HD12  LEU  27          2HD1      LEU  27  -0.249  -2.367  -5.141
  219   HD13  LEU  27          3HD1      LEU  27   0.373  -1.368  -3.806
  220   HD21  LEU  27          3HD2      LEU  27  -2.792  -1.547  -1.808
  221   HD22  LEU  27          1HD2      LEU  27  -1.388  -2.625  -1.612
  222   HD23  LEU  27          2HD2      LEU  27  -1.144  -0.874  -1.822
  223    H    GLU  28           H        GLU  28  -4.857  -0.757  -5.895
  224    HA   GLU  28           HA       GLU  28  -5.434  -3.538  -6.030
  225    HB2  GLU  28           1HB      GLU  28  -7.070  -1.793  -5.497
  226    HB3  GLU  28           2HB      GLU  28  -6.980  -1.209  -7.177
  227    HG2  GLU  28           1HG      GLU  28  -7.908  -3.464  -7.944
  228    HG3  GLU  28           2HG      GLU  28  -7.921  -3.877  -6.214
  229    H    GLU  29           H        GLU  29  -4.943  -1.176  -8.645
  230    HA   GLU  29           HA       GLU  29  -5.379  -3.143 -10.745
  231    HB2  GLU  29           1HB      GLU  29  -4.068  -0.424 -10.702
  232    HB3  GLU  29           2HB      GLU  29  -4.288  -1.404 -12.172
  233    HG2  GLU  29           1HG      GLU  29  -6.791  -1.256 -11.878
  234    HG3  GLU  29           2HG      GLU  29  -6.442  -0.415 -10.350
  235    H    PHE  30           H        PHE  30  -2.561  -1.943  -8.994
  236    HA   PHE  30           HA       PHE  30  -0.581  -3.173 -10.679
  237    HB2  PHE  30           1HB      PHE  30   0.036  -1.439  -9.060
  238    HB3  PHE  30           2HB      PHE  30  -0.506  -2.466  -7.714
  239    HD1  PHE  30           1HD      PHE  30   1.944  -2.301 -10.504
  240    HD2  PHE  30           2HD      PHE  30   0.950  -3.912  -6.674
  241    HE1  PHE  30           1HE      PHE  30   4.217  -3.253 -10.318
  242    HE2  PHE  30           2HE      PHE  30   3.224  -4.863  -6.482
  243    HZ   PHE  30           HZ       PHE  30   4.858  -4.535  -8.305
  244    H    THR  31           H        THR  31  -2.267  -4.328  -7.760
  245    HA   THR  31           HA       THR  31  -0.824  -6.911  -7.954
  246    HB   THR  31           HB       THR  31  -1.926  -7.468  -5.850
  247    HG1  THR  31           1HG      THR  31  -3.294  -4.973  -6.150
  248   HG21  THR  31          3HG2      THR  31  -0.940  -4.588  -5.838
  249   HG22  THR  31          1HG2      THR  31  -1.058  -5.652  -4.418
  250   HG23  THR  31          2HG2      THR  31   0.085  -6.037  -5.727
  251    H    GLN  32           H        GLN  32  -3.837  -5.522  -8.907
  252    HA   GLN  32           HA       GLN  32  -5.872  -6.440  -9.548
  253    HB2  GLN  32           1HB      GLN  32  -4.089  -8.768 -10.298
  254    HB3  GLN  32           2HB      GLN  32  -5.767  -8.520 -10.835
  255    HG2  GLN  32           1HG      GLN  32  -4.808  -6.285 -12.081
  256    HG3  GLN  32           2HG      GLN  32  -3.367  -6.989 -11.310
  257   HE21  GLN  32          2HE2      GLN  32  -3.252  -6.516 -13.961
  258   HE22  GLN  32          1HE2      GLN  32  -3.340  -7.992 -14.861
  259    H    ALA  33           H        ALA  33  -4.973  -6.841  -6.808
  260    HA   ALA  33           HA       ALA  33  -6.320  -9.438  -6.206
  261    HB1  ALA  33           1HB      ALA  33  -5.229  -9.283  -4.002
  262    HB2  ALA  33           2HB      ALA  33  -4.038  -9.248  -5.324
  263    HB3  ALA  33           3HB      ALA  33  -4.480  -7.744  -4.482
  264    H    LYS  34           H        LYS  34  -7.609  -9.496  -4.196
  265    HA   LYS  34           HA       LYS  34  -9.762  -7.646  -4.289
  266    HB2  LYS  34           1HB      LYS  34  -9.896  -9.882  -3.310
  267    HB3  LYS  34           2HB      LYS  34  -8.813  -9.368  -1.994
  268    HG2  LYS  34           1HG      LYS  34 -11.071  -9.350  -1.156
  269    HG3  LYS  34           2HG      LYS  34 -10.526  -7.665  -1.334
  270    HD2  LYS  34           1HD      LYS  34 -11.710  -7.507  -3.487
  271    HD3  LYS  34           2HD      LYS  34 -12.250  -9.194  -3.312
  272    HE2  LYS  34           1HE      LYS  34 -13.474  -8.608  -1.276
  273    HE3  LYS  34           2HE      LYS  34 -12.911  -6.926  -1.408
  274    HZ1  LYS  34           3HZ      LYS  34 -14.628  -8.319  -3.363
  275    HZ2  LYS  34           1HZ      LYS  34 -15.137  -7.190  -2.272
  276    HZ3  LYS  34           2HZ      LYS  34 -14.105  -6.759  -3.486
  277    H    ARG  35           H        ARG  35 -10.084  -5.687  -3.607
  278    HA   ARG  35           HA       ARG  35  -8.002  -4.068  -2.569
  279    HB2  ARG  35           1HB      ARG  35  -9.951  -3.244  -3.755
  280    HB3  ARG  35           2HB      ARG  35 -10.933  -3.573  -2.308
  281    HG2  ARG  35           1HG      ARG  35  -9.537  -1.994  -1.020
  282    HG3  ARG  35           2HG      ARG  35  -8.602  -1.642  -2.493
  283    HD2  ARG  35           1HD      ARG  35 -11.521  -1.101  -2.057
  284    HD3  ARG  35           2HD      ARG  35 -10.199   0.089  -2.013
  285    HE   ARG  35           HE       ARG  35 -10.109  -0.913  -4.652
  286   HH11  ARG  35          1HH1      ARG  35 -12.675   0.423  -2.704
  287   HH12  ARG  35          2HH1      ARG  35 -13.442   1.063  -4.144
  288   HH21  ARG  35          1HH2      ARG  35 -10.981  -0.192  -6.311
  289   HH22  ARG  35          2HH2      ARG  35 -12.478   0.713  -6.200
  290    H    GLU  36           H        GLU  36 -10.627  -5.753  -0.866
  291    HA   GLU  36           HA       GLU  36 -10.083  -4.668   1.724
  292    HB2  GLU  36           1HB      GLU  36 -11.252  -7.306   0.832
  293    HB3  GLU  36           2HB      GLU  36 -11.166  -6.783   2.532
  294    HG2  GLU  36           1HG      GLU  36 -12.670  -4.829   1.991
  295    HG3  GLU  36           2HG      GLU  36 -12.558  -5.364   0.300
  296    H    VAL  37           H        VAL  37  -8.771  -7.522   0.065
  297    HA   VAL  37           HA       VAL  37  -7.133  -8.411   2.289
  298    HB   VAL  37           HB       VAL  37  -6.866  -8.819  -0.718
  299   HG11  VAL  37          1HG1      VAL  37  -5.284 -10.625  -0.130
  300   HG12  VAL  37          2HG1      VAL  37  -4.680  -9.042   0.414
  301   HG13  VAL  37          3HG1      VAL  37  -5.402 -10.171   1.587
  302   HG21  VAL  37          3HG2      VAL  37  -8.875  -9.801   0.214
  303   HG22  VAL  37          1HG2      VAL  37  -7.709 -11.063  -0.245
  304   HG23  VAL  37          2HG2      VAL  37  -7.914 -10.624   1.467
  305    H    LEU  38           H        LEU  38  -6.542  -6.167  -0.381
  306    HA   LEU  38           HA       LEU  38  -3.780  -5.700   0.280
  307    HB2  LEU  38           1HB      LEU  38  -5.878  -4.043  -0.958
  308    HB3  LEU  38           2HB      LEU  38  -4.178  -3.526  -1.040
  309    HG   LEU  38           HG       LEU  38  -5.336  -6.056  -2.272
  310   HD11  LEU  38          1HD1      LEU  38  -4.862  -4.915  -4.456
  311   HD12  LEU  38          2HD1      LEU  38  -6.025  -3.986  -3.481
  312   HD13  LEU  38          3HD1      LEU  38  -4.323  -3.471  -3.566
  313   HD21  LEU  38          3HD2      LEU  38  -3.042  -6.358  -1.552
  314   HD22  LEU  38          1HD2      LEU  38  -3.117  -6.296  -3.329
  315   HD23  LEU  38          2HD2      LEU  38  -2.546  -4.882  -2.411
  316    H    LEU  39           H        LEU  39  -6.800  -4.331   1.473
  317    HA   LEU  39           HA       LEU  39  -5.533  -2.152   2.909
  318    HB2  LEU  39           1HB      LEU  39  -8.101  -3.575   3.050
  319    HB3  LEU  39           2HB      LEU  39  -7.846  -2.203   4.154
  320    HG   LEU  39           HG       LEU  39  -7.817  -2.072   1.114
  321   HD11  LEU  39          1HD1      LEU  39  -9.948  -0.778   1.390
  322   HD12  LEU  39          2HD1      LEU  39 -10.105  -2.427   2.040
  323   HD13  LEU  39          3HD1      LEU  39  -9.869  -1.052   3.146
  324   HD21  LEU  39          3HD2      LEU  39  -6.315  -0.455   2.119
  325   HD22  LEU  39          1HD2      LEU  39  -7.735   0.376   1.442
  326   HD23  LEU  39          2HD2      LEU  39  -7.608   0.118   3.200
  327    H    VAL  40           H        VAL  40  -6.279  -5.498   3.673
  328    HA   VAL  40           HA       VAL  40  -5.808  -5.422   6.501
  329    HB   VAL  40           HB       VAL  40  -5.233  -7.586   4.436
  330   HG11  VAL  40          1HG1      VAL  40  -5.068  -9.117   6.370
  331   HG12  VAL  40          2HG1      VAL  40  -3.803  -7.867   6.432
  332   HG13  VAL  40          3HG1      VAL  40  -5.238  -7.735   7.479
  333   HG21  VAL  40          3HG2      VAL  40  -7.582  -7.027   4.637
  334   HG22  VAL  40          1HG2      VAL  40  -7.252  -8.630   5.332
  335   HG23  VAL  40          2HG2      VAL  40  -7.500  -7.230   6.402
  336    H    THR  41           H        THR  41  -3.481  -5.994   3.858
  337    HA   THR  41           HA       THR  41  -1.201  -6.049   5.620
  338    HB   THR  41           HB       THR  41  -1.392  -5.386   2.652
  339    HG1  THR  41           1HG      THR  41  -2.028  -7.530   3.229
  340   HG21  THR  41          3HG2      THR  41   1.014  -6.099   4.376
  341   HG22  THR  41          1HG2      THR  41   1.026  -5.887   2.609
  342   HG23  THR  41          2HG2      THR  41   0.678  -4.500   3.670
  343    H    LEU  42           H        LEU  42  -2.718  -3.443   3.738
  344    HA   LEU  42           HA       LEU  42  -0.718  -1.474   4.350
  345    HB2  LEU  42           1HB      LEU  42  -3.578  -1.385   3.669
  346    HB3  LEU  42           2HB      LEU  42  -2.676   0.146   3.754
  347    HG   LEU  42           HG       LEU  42  -2.087  -2.158   1.855
  348   HD11  LEU  42          1HD1      LEU  42  -2.918  -0.595   0.077
  349   HD12  LEU  42          2HD1      LEU  42  -4.189  -0.953   1.268
  350   HD13  LEU  42          3HD1      LEU  42  -3.319   0.598   1.335
  351   HD21  LEU  42          3HD2      LEU  42  -0.091  -0.927   2.471
  352   HD22  LEU  42          1HD2      LEU  42  -0.524  -0.573   0.781
  353   HD23  LEU  42          2HD2      LEU  42  -0.878   0.614   2.058
  354    H    THR  43           H        THR  43  -3.637  -2.513   6.036
  355    HA   THR  43           HA       THR  43  -3.539  -0.406   8.028
  356    HB   THR  43           HB       THR  43  -4.819  -3.170   8.114
  357    HG1  THR  43           1HG      THR  43  -5.673  -1.719   6.522
  358   HG21  THR  43          3HG2      THR  43  -5.219  -0.734   9.899
  359   HG22  THR  43          1HG2      THR  43  -6.154  -2.246   9.977
  360   HG23  THR  43          2HG2      THR  43  -4.419  -2.251  10.373
  361    H    ARG  44           H        ARG  44  -2.278  -3.723   7.886
  362    HA   ARG  44           HA       ARG  44  -1.222  -3.716  10.572
  363    HB2  ARG  44           1HB      ARG  44  -0.553  -5.340   8.166
  364    HB3  ARG  44           2HB      ARG  44   0.244  -5.523   9.746
  365    HG2  ARG  44           1HG      ARG  44  -1.887  -6.087  10.788
  366    HG3  ARG  44           2HG      ARG  44  -2.732  -5.827   9.243
  367    HD2  ARG  44           1HD      ARG  44  -1.563  -7.687   8.269
  368    HD3  ARG  44           2HD      ARG  44  -0.662  -7.931   9.784
  369    HE   ARG  44           HE       ARG  44  -3.470  -8.267  10.385
  370   HH11  ARG  44          1HH1      ARG  44  -1.019  -9.851   8.478
  371   HH12  ARG  44          2HH1      ARG  44  -1.821 -11.390   8.715
  372   HH21  ARG  44          1HH2      ARG  44  -4.405 -10.022  10.659
  373   HH22  ARG  44          2HH2      ARG  44  -3.753 -11.490   9.957
  374    H    LEU  45           H        LEU  45   0.096  -2.700   7.450
  375    HA   LEU  45           HA       LEU  45   2.752  -2.151   8.446
  376    HB2  LEU  45           1HB      LEU  45   1.098  -1.185   6.220
  377    HB3  LEU  45           2HB      LEU  45   2.776  -0.602   6.330
  378    HG   LEU  45           HG       LEU  45   1.895  -3.495   5.982
  379   HD11  LEU  45          1HD1      LEU  45   2.951  -3.277   3.717
  380   HD12  LEU  45          2HD1      LEU  45   1.611  -2.125   3.918
  381   HD13  LEU  45          3HD1      LEU  45   3.296  -1.565   4.060
  382   HD21  LEU  45          3HD2      LEU  45   3.916  -3.325   7.308
  383   HD22  LEU  45          1HD2      LEU  45   4.301  -3.975   5.697
  384   HD23  LEU  45          2HD2      LEU  45   4.667  -2.276   6.083
  385    H    HIS  46           H        HIS  46  -0.098  -0.068   7.946
  386    HA   HIS  46           HA       HIS  46   1.184   2.310   8.945
  387    HB2  HIS  46           1HB      HIS  46  -0.884   2.349   7.539
  388    HB3  HIS  46           2HB      HIS  46  -1.789   1.626   8.890
  389    HD1  HIS  46           1HD      HIS  46   0.425   4.702   8.361
  390    HD2  HIS  46           2HD      HIS  46  -3.137   3.608  10.331
  391    HE1  HIS  46           1HE      HIS  46  -0.374   6.721   9.479
  392    H    GLN  47           H        GLN  47  -0.601  -0.299  10.502
  393    HA   GLN  47           HA       GLN  47  -0.808   0.957  13.084
  394    HB2  GLN  47           1HB      GLN  47  -2.086  -1.034  12.350
  395    HB3  GLN  47           2HB      GLN  47  -0.576  -1.976  12.376
  396    HG2  GLN  47           1HG      GLN  47  -1.683  -2.436  14.674
  397    HG3  GLN  47           2HG      GLN  47  -0.292  -1.331  14.589
  398   HE21  GLN  47          2HE2      GLN  47  -0.860  -0.371  16.573
  399   HE22  GLN  47          1HE2      GLN  47  -2.195   0.725  16.704
  400    H    ARG  48           H        ARG  48   1.703  -1.036  11.575
  401    HA   ARG  48           HA       ARG  48   3.357  -0.983  14.007
  402    HB2  ARG  48           1HB      ARG  48   3.940  -1.948  11.244
  403    HB3  ARG  48           2HB      ARG  48   5.054  -2.027  12.629
  404    HG2  ARG  48           1HG      ARG  48   2.313  -3.316  12.614
  405    HG3  ARG  48           2HG      ARG  48   3.795  -4.161  12.105
  406    HD2  ARG  48           1HD      ARG  48   4.737  -3.843  14.302
  407    HD3  ARG  48           2HD      ARG  48   3.270  -2.977  14.813
  408    HE   ARG  48           HE       ARG  48   2.465  -5.643  14.046
  409   HH11  ARG  48          1HH1      ARG  48   4.451  -4.146  16.491
  410   HH12  ARG  48          2HH1      ARG  48   4.073  -5.447  17.603
  411   HH21  ARG  48          1HH2      ARG  48   2.029  -7.144  15.307
  412   HH22  ARG  48          2HH2      ARG  48   2.692  -7.157  16.928
  413    H    GLY  49           H        GLY  49   2.832   1.054  11.285
  414    HA2  GLY  49           1HA      GLY  49   3.470   3.349  11.421
  415    HA3  GLY  49           2HA      GLY  49   4.825   2.900  12.482
  416    H    VAL  50           H        VAL  50   4.295   0.935   9.692
  417    HA   VAL  50           HA       VAL  50   6.902   1.710   8.559
  418    HB   VAL  50           HB       VAL  50   4.740  -0.180   7.533
  419   HG11  VAL  50          1HG1      VAL  50   6.533  -1.044   6.066
  420   HG12  VAL  50          2HG1      VAL  50   6.210   0.675   5.737
  421   HG13  VAL  50          3HG1      VAL  50   7.641   0.205   6.685
  422   HG21  VAL  50          3HG2      VAL  50   5.644  -0.917   9.657
  423   HG22  VAL  50          1HG2      VAL  50   6.206  -1.963   8.332
  424   HG23  VAL  50          2HG2      VAL  50   7.303  -0.747   9.032
  425    H    ILE  51           H        ILE  51   3.502   2.136   7.653
  426    HA   ILE  51           HA       ILE  51   4.440   4.162   5.639
  427    HB   ILE  51           HB       ILE  51   2.541   3.522   4.206
  428   HG12  ILE  51          1HG1      ILE  51   2.051   1.297   6.169
  429   HG13  ILE  51          2HG1      ILE  51   1.099   2.797   6.056
  430   HG21  ILE  51          1HG2      ILE  51   3.330   1.300   3.466
  431   HG22  ILE  51          2HG2      ILE  51   4.698   2.376   3.833
  432   HG23  ILE  51          3HG2      ILE  51   4.227   1.110   4.992
  433   HD11  ILE  51          3HD1      ILE  51   1.403   0.712   3.865
  434   HD12  ILE  51          1HD1      ILE  51  -0.028   0.939   4.896
  435   HD13  ILE  51          2HD1      ILE  51   0.453   2.212   3.750
  436    H    TYR  52           H        TYR  52   2.863   5.756   5.037
  437    HA   TYR  52           HA       TYR  52   1.015   6.372   7.324
  438    HB2  TYR  52           1HB      TYR  52   2.871   7.900   7.359
  439    HB3  TYR  52           2HB      TYR  52   2.687   8.220   5.616
  440    HD1  TYR  52           1HD      TYR  52   0.927   8.584   8.894
  441    HD2  TYR  52           2HD      TYR  52   1.299   9.973   4.880
  442    HE1  TYR  52           1HE      TYR  52  -0.612  10.455   9.408
  443    HE2  TYR  52           2HE      TYR  52  -0.237  11.846   5.375
  444    HH   TYR  52           HH       TYR  52  -1.678  12.296   8.613
  445    H    ARG  53           H        ARG  53  -1.010   6.953   6.920
  446    HA   ARG  53           HA       ARG  53  -1.851   6.779   4.046
  447    HB2  ARG  53           1HB      ARG  53  -3.896   5.923   4.683
  448    HB3  ARG  53           2HB      ARG  53  -2.613   4.962   5.456
  449    HG2  ARG  53           1HG      ARG  53  -3.019   6.233   7.570
  450    HG3  ARG  53           2HG      ARG  53  -4.397   7.032   6.773
  451    HD2  ARG  53           1HD      ARG  53  -5.467   4.877   6.485
  452    HD3  ARG  53           2HD      ARG  53  -4.096   4.094   7.305
  453    HE   ARG  53           HE       ARG  53  -5.354   6.024   9.111
  454   HH11  ARG  53          1HH1      ARG  53  -5.890   2.875   7.711
  455   HH12  ARG  53          2HH1      ARG  53  -6.838   2.409   9.109
  456   HH21  ARG  53          1HH2      ARG  53  -6.445   5.506  10.715
  457   HH22  ARG  53          2HH2      ARG  53  -7.157   3.908  10.821
  458    H    LYS  54           H        LYS  54  -3.390   8.141   3.220
  459    HA   LYS  54           HA       LYS  54  -4.557  10.242   4.910
  460    HB2  LYS  54           1HB      LYS  54  -3.662  12.097   3.697
  461    HB3  LYS  54           2HB      LYS  54  -2.333  11.150   4.406
  462    HG2  LYS  54           1HG      LYS  54  -1.905  10.113   2.211
  463    HG3  LYS  54           2HG      LYS  54  -3.224  11.076   1.502
  464    HD2  LYS  54           1HD      LYS  54  -2.030  13.147   2.089
  465    HD3  LYS  54           2HD      LYS  54  -0.713  12.187   2.802
  466    HE2  LYS  54           1HE      LYS  54  -0.252  11.171   0.625
  467    HE3  LYS  54           2HE      LYS  54  -1.597  12.084  -0.099
  468    HZ1  LYS  54           3HZ      LYS  54   0.828  13.262   1.099
  469    HZ2  LYS  54           1HZ      LYS  54   0.520  13.136  -0.517
  470    HZ3  LYS  54           2HZ      LYS  54  -0.417  14.109   0.428
  471    H    TRP  55           H        TRP  55  -6.039  11.631   3.739
  472    HA   TRP  55           HA       TRP  55  -7.250  10.120   1.446
  473    HB2  TRP  55           1HB      TRP  55  -8.490  11.754   3.691
  474    HB3  TRP  55           2HB      TRP  55  -9.377  11.357   2.199
  475    HD1  TRP  55           HD       TRP  55 -10.399   9.159   2.036
  476    HE1  TRP  55           1HE      TRP  55 -10.605   6.976   3.616
  477    HE3  TRP  55           3HE      TRP  55  -6.929  10.447   5.520
  478    HZ2  TRP  55           2HZ      TRP  55  -9.390   6.110   5.942
  479    HZ3  TRP  55           3HZ      TRP  55  -6.469   8.970   7.377
  480    HH2  TRP  55           HH       TRP  55  -7.641   6.826   7.640
  481    H    ARG  56           H        ARG  56  -6.913  10.988  -0.431
  482    HA   ARG  56           HA       ARG  56  -6.591  13.945  -0.636
  483    HB2  ARG  56           1HB      ARG  56  -4.874  12.592  -1.617
  484    HB3  ARG  56           2HB      ARG  56  -6.083  11.819  -2.668
  485    HG2  ARG  56           1HG      ARG  56  -6.552  13.970  -3.737
  486    HG3  ARG  56           2HG      ARG  56  -5.378  14.771  -2.664
  487    HD2  ARG  56           1HD      ARG  56  -3.598  13.445  -3.642
  488    HD3  ARG  56           2HD      ARG  56  -4.778  12.676  -4.729
  489    HE   ARG  56           HE       ARG  56  -4.773  15.559  -5.201
  490   HH11  ARG  56          1HH1      ARG  56  -2.786  12.744  -5.738
  491   HH12  ARG  56          2HH1      ARG  56  -2.102  13.493  -7.168
  492   HH21  ARG  56          1HH2      ARG  56  -3.993  16.433  -6.831
  493   HH22  ARG  56          2HH2      ARG  56  -2.789  15.596  -7.791
  494    H    HIS  57           H        HIS  57  -7.993  15.264  -1.516
  495    HA   HIS  57           HA       HIS  57 -10.616  14.119  -2.291
  496    HB2  HIS  57           1HB      HIS  57 -10.449  16.058  -0.670
  497    HB3  HIS  57           2HB      HIS  57  -9.823  17.047  -2.011
  498    HD1  HIS  57           1HD      HIS  57 -11.479  17.560  -3.981
  499    HD2  HIS  57           2HD      HIS  57 -13.301  15.705  -0.666
  500    HE1  HIS  57           1HE      HIS  57 -13.878  17.958  -4.220
  501    H    PHE  58           H        PHE  58 -11.484  14.089  -4.231
  502    HA   PHE  58           HA       PHE  58 -10.397  15.694  -6.435
  503    HB2  PHE  58           1HB      PHE  58  -8.745  13.839  -6.349
  504    HB3  PHE  58           2HB      PHE  58 -10.071  12.662  -6.479
  505    HD1  PHE  58           1HD      PHE  58  -8.540  15.558  -8.249
  506    HD2  PHE  58           2HD      PHE  58 -10.750  11.913  -8.533
  507    HE1  PHE  58           1HE      PHE  58  -8.381  15.655 -10.716
  508    HE2  PHE  58           2HE      PHE  58 -10.591  12.005 -10.999
  509    HZ   PHE  58           HZ       PHE  58  -9.408  13.879 -12.090
  510    H    SER  59           H        SER  59 -12.065  16.360  -7.505
  511    HA   SER  59           HA       SER  59 -14.133  16.301  -8.694
  512    HB2  SER  59           1HB      SER  59 -13.583  13.395  -8.727
  513    HB3  SER  59           2HB      SER  59 -14.807  14.282  -9.665
  514    HG   SER  59           HG       SER  59 -12.867  13.950 -10.833
  515    H    GLY  60           H        GLY  60 -14.038  16.133  -5.678
  516    HA2  GLY  60           1HA      GLY  60 -15.863  16.362  -4.219
  517    HA3  GLY  60           2HA      GLY  60 -16.912  15.576  -5.422
  518    H    ARG  61           H        ARG  61 -14.181  13.724  -5.188
  519    HA   ARG  61           HA       ARG  61 -15.444  11.947  -3.123
  520    HB2  ARG  61           1HB      ARG  61 -14.136  11.149  -5.685
  521    HB3  ARG  61           2HB      ARG  61 -14.599  10.049  -4.364
  522    HG2  ARG  61           1HG      ARG  61 -16.950  10.667  -4.658
  523    HG3  ARG  61           2HG      ARG  61 -16.500  11.800  -5.953
  524    HD2  ARG  61           1HD      ARG  61 -15.725   9.959  -7.303
  525    HD3  ARG  61           2HD      ARG  61 -16.144   8.820  -6.002
  526    HE   ARG  61           HE       ARG  61 -18.593  10.116  -6.754
  527   HH11  ARG  61          1HH1      ARG  61 -16.213   8.104  -8.317
  528   HH12  ARG  61          2HH1      ARG  61 -17.451   7.441  -9.365
  529   HH21  ARG  61          1HH2      ARG  61 -20.022   9.373  -7.951
  530   HH22  ARG  61          2HH2      ARG  61 -19.624   8.164  -9.158
  531    H    LYS  62           H        LYS  62 -14.148  10.744  -1.797
  532    HA   LYS  62           HA       LYS  62 -11.363  11.795  -1.547
  533    HB2  LYS  62           1HB      LYS  62 -13.159  10.272   0.344
  534    HB3  LYS  62           2HB      LYS  62 -11.457  10.672   0.674
  535    HG2  LYS  62           1HG      LYS  62 -11.981  13.064   0.569
  536    HG3  LYS  62           2HG      LYS  62 -13.677  12.686   0.186
  537    HD2  LYS  62           1HD      LYS  62 -13.890  11.520   2.358
  538    HD3  LYS  62           2HD      LYS  62 -12.207  11.952   2.741
  539    HE2  LYS  62           1HE      LYS  62 -12.770  14.330   2.622
  540    HE3  LYS  62           2HE      LYS  62 -14.447  13.923   2.190
  541    HZ1  LYS  62           3HZ      LYS  62 -13.116  13.234   4.733
  542    HZ2  LYS  62           1HZ      LYS  62 -14.230  14.436   4.527
  543    HZ3  LYS  62           2HZ      LYS  62 -14.670  12.857   4.332
  544    H    TYR  63           H        TYR  63  -9.611  10.632  -1.825
  545    HA   TYR  63           HA       TYR  63  -9.956   7.690  -2.298
  546    HB2  TYR  63           1HB      TYR  63  -8.202   9.627  -3.823
  547    HB3  TYR  63           2HB      TYR  63  -8.227   7.856  -4.024
  548    HD1  TYR  63           2HD      TYR  63 -10.119   6.758  -5.128
  549    HD2  TYR  63           1HD      TYR  63  -9.997  11.001  -4.719
  550    HE1  TYR  63           2HE      TYR  63 -11.930   6.960  -6.796
  551    HE2  TYR  63           1HE      TYR  63 -11.814  11.222  -6.389
  552    HH   TYR  63           HH       TYR  63 -13.285   8.376  -7.957
  553    H    ARG  64           H        ARG  64  -8.695   6.397  -1.215
  554    HA   ARG  64           HA       ARG  64  -6.865   7.511   0.758
  555    HB2  ARG  64           1HB      ARG  64  -7.479   4.695  -0.009
  556    HB3  ARG  64           2HB      ARG  64  -6.352   5.183   1.278
  557    HG2  ARG  64           1HG      ARG  64  -8.166   6.274   2.491
  558    HG3  ARG  64           2HG      ARG  64  -9.305   5.870   1.183
  559    HD2  ARG  64           1HD      ARG  64  -8.967   3.508   1.647
  560    HD3  ARG  64           2HD      ARG  64  -7.877   3.941   2.986
  561    HE   ARG  64           HE       ARG  64 -10.461   5.117   3.550
  562   HH11  ARG  64          1HH1      ARG  64  -9.063   1.937   3.251
  563   HH12  ARG  64          2HH1      ARG  64 -10.219   1.313   4.410
  564   HH21  ARG  64          1HH2      ARG  64 -11.797   4.417   4.873
  565   HH22  ARG  64          2HH2      ARG  64 -11.779   2.726   5.336
  566    H    GLU  65           H        GLU  65  -4.823   7.983   0.600
  567    HA   GLU  65           HA       GLU  65  -3.193   6.471  -1.419
  568    HB2  GLU  65           1HB      GLU  65  -2.912   9.321  -0.453
  569    HB3  GLU  65           2HB      GLU  65  -1.690   8.451  -1.414
  570    HG2  GLU  65           1HG      GLU  65  -3.488   8.206  -3.262
  571    HG3  GLU  65           2HG      GLU  65  -4.475   9.209  -2.175
  572    H    TYR  66           H        TYR  66  -1.238   5.694  -0.845
  573    HA   TYR  66           HA       TYR  66  -0.567   5.886   2.075
  574    HB2  TYR  66           1HB      TYR  66  -0.488   3.445   0.290
  575    HB3  TYR  66           2HB      TYR  66   0.140   3.535   1.954
  576    HD1  TYR  66           1HD      TYR  66  -2.938   3.569  -0.110
  577    HD2  TYR  66           2HD      TYR  66  -1.342   3.413   3.840
  578    HE1  TYR  66           1HE      TYR  66  -5.176   2.967   0.761
  579    HE2  TYR  66           2HE      TYR  66  -3.569   2.811   4.728
  580    HH   TYR  66           HH       TYR  66  -5.753   2.392   4.234
  581    H    CYS  67           H        CYS  67   1.451   6.281   2.601
  582    HA   CYS  67           HA       CYS  67   3.514   6.369   0.377
  583    HB2  CYS  67           1HB      CYS  67   2.402   8.539   0.833
  584    HB3  CYS  67           2HB      CYS  67   2.816   8.383   2.557
  585    HG   CYS  67           HG       CYS  67   4.211  10.202   1.468
  586    H    LEU  68           H        LEU  68   5.364   5.391   0.899
  587    HA   LEU  68           HA       LEU  68   5.777   4.019   3.361
  588    HB2  LEU  68           1HB      LEU  68   6.763   3.468   1.333
  589    HB3  LEU  68           2HB      LEU  68   7.805   4.907   1.237
  590    HG   LEU  68           HG       LEU  68   8.842   4.135   3.434
  591   HD11  LEU  68          1HD1      LEU  68   8.627   1.684   3.932
  592   HD12  LEU  68          2HD1      LEU  68   7.057   2.509   4.056
  593   HD13  LEU  68          3HD1      LEU  68   7.440   1.538   2.616
  594   HD21  LEU  68          3HD2      LEU  68  10.001   3.942   1.314
  595   HD22  LEU  68          1HD2      LEU  68  10.346   2.519   2.327
  596   HD23  LEU  68          2HD2      LEU  68   9.191   2.395   0.977
  597    H    LYS  69           H        LYS  69   6.370   4.591   5.288
  598    HA   LYS  69           HA       LYS  69   7.326   7.397   5.672
  599    HB2  LYS  69           1HB      LYS  69   5.289   6.640   6.854
  600    HB3  LYS  69           2HB      LYS  69   6.262   5.391   7.668
  601    HG2  LYS  69           1HG      LYS  69   7.598   7.105   8.773
  602    HG3  LYS  69           2HG      LYS  69   6.720   8.384   7.901
  603    HD2  LYS  69           1HD      LYS  69   4.614   7.632   8.988
  604    HD3  LYS  69           2HD      LYS  69   5.550   6.436   9.916
  605    HE2  LYS  69           1HE      LYS  69   6.833   8.206  10.978
  606    HE3  LYS  69           2HE      LYS  69   6.011   9.434   9.986
  607    HZ1  LYS  69           3HZ      LYS  69   4.715   7.693  11.983
  608    HZ2  LYS  69           1HZ      LYS  69   5.067   9.291  12.189
  609    HZ3  LYS  69           2HZ      LYS  69   3.951   8.829  11.066
  610    H    HIS  70           H        HIS  70   8.060   4.050   6.649
  611    HA   HIS  70           HA       HIS  70  10.827   5.001   7.313
  612    HB2  HIS  70           1HB      HIS  70   9.187   2.716   8.491
  613    HB3  HIS  70           2HB      HIS  70  10.933   2.923   8.765
  614    HD1  HIS  70           1HD      HIS  70   7.584   4.364   9.642
  615    HD2  HIS  70           2HD      HIS  70  11.621   4.967  10.689
  616    HE1  HIS  70           1HE      HIS  70   7.567   5.904  11.539
  617    H    ARG  71           H        ARG  71  12.055   4.674   5.617
  618    HA   ARG  71           HA       ARG  71  11.780   2.430   3.814
  619    HB2  ARG  71           1HB      ARG  71  14.005   4.353   4.292
  620    HB3  ARG  71           2HB      ARG  71  14.071   3.026   3.110
  621    HG2  ARG  71           1HG      ARG  71  12.164   3.962   1.911
  622    HG3  ARG  71           2HG      ARG  71  12.016   5.258   3.123
  623    HD2  ARG  71           1HD      ARG  71  14.176   6.117   2.473
  624    HD3  ARG  71           2HD      ARG  71  14.331   4.820   1.265
  625    HE   ARG  71           HE       ARG  71  11.987   6.326   0.548
  626   HH11  ARG  71          1HH1      ARG  71  15.405   6.940   0.867
  627   HH12  ARG  71          2HH1      ARG  71  15.309   8.156  -0.392
  628   HH21  ARG  71          1HH2      ARG  71  11.861   7.721  -0.890
  629   HH22  ARG  71          2HH2      ARG  71  13.289   8.602  -1.394
  630    H    ASP  72           H        ASP  72  13.530   2.942   6.816
  631    HA   ASP  72           HA       ASP  72  15.213   0.598   6.573
  632    HB2  ASP  72           1HB      ASP  72  14.355   2.223   9.042
  633    HB3  ASP  72           2HB      ASP  72  15.398   0.783   8.950
  634    H    GLU  73           H        GLU  73  12.019   1.191   7.985
  635    HA   GLU  73           HA       GLU  73  11.770  -1.469   9.117
  636    HB2  GLU  73           1HB      GLU  73   9.739   0.635   8.361
  637    HB3  GLU  73           2HB      GLU  73   9.345  -0.895   9.183
  638    HG2  GLU  73           1HG      GLU  73  11.078   1.373  10.336
  639    HG3  GLU  73           2HG      GLU  73   9.419   0.873  10.737
  640    H    LEU  74           H        LEU  74  10.886  -0.013   6.015
  641    HA   LEU  74           HA       LEU  74   9.556  -2.325   4.951
  642    HB2  LEU  74           1HB      LEU  74   9.359  -0.239   4.028
  643    HB3  LEU  74           2HB      LEU  74  11.072  -0.038   3.586
  644    HG   LEU  74           HG       LEU  74  10.837  -1.997   2.039
  645   HD11  LEU  74          1HD1      LEU  74   8.514  -2.696   1.403
  646   HD12  LEU  74          2HD1      LEU  74   8.842  -3.029   3.118
  647   HD13  LEU  74          3HD1      LEU  74   7.862  -1.617   2.657
  648   HD21  LEU  74          3HD2      LEU  74  10.745   0.273   1.189
  649   HD22  LEU  74          1HD2      LEU  74   9.621  -0.763   0.277
  650   HD23  LEU  74          2HD2      LEU  74   8.996   0.354   1.514
  651    H    ALA  75           H        ALA  75  12.966  -1.308   4.864
  652    HA   ALA  75           HA       ALA  75  13.882  -3.557   3.355
  653    HB1  ALA  75           1HB      ALA  75  16.107  -2.973   4.239
  654    HB2  ALA  75           2HB      ALA  75  15.232  -1.533   3.666
  655    HB3  ALA  75           3HB      ALA  75  15.351  -1.870   5.410
  656    H    ASP  76           H        ASP  76  13.355  -3.068   6.819
  657    HA   ASP  76           HA       ASP  76  14.500  -5.573   7.669
  658    HB2  ASP  76           1HB      ASP  76  12.354  -3.793   8.971
  659    HB3  ASP  76           2HB      ASP  76  13.038  -5.332   9.550
  660    H    LEU  77           H        LEU  77  11.265  -4.654   6.559
  661    HA   LEU  77           HA       LEU  77  10.066  -7.227   7.080
  662    HB2  LEU  77           1HB      LEU  77   9.539  -4.996   5.242
  663    HB3  LEU  77           2HB      LEU  77   8.387  -6.351   5.268
  664    HG   LEU  77           HG       LEU  77   9.065  -4.549   7.624
  665   HD11  LEU  77          1HD1      LEU  77   6.726  -3.687   7.329
  666   HD12  LEU  77          2HD1      LEU  77   7.716  -3.381   5.882
  667   HD13  LEU  77          3HD1      LEU  77   6.544  -4.720   5.893
  668   HD21  LEU  77          3HD2      LEU  77   8.500  -6.804   8.315
  669   HD22  LEU  77          1HD2      LEU  77   7.182  -5.689   8.748
  670   HD23  LEU  77          2HD2      LEU  77   7.014  -6.762   7.338
  671    H    GLU  78           H        GLU  78  11.768  -5.860   4.295
  672    HA   GLU  78           HA       GLU  78  11.314  -8.142   2.572
  673    HB2  GLU  78           1HB      GLU  78  13.387  -5.952   2.622
  674    HB3  GLU  78           2HB      GLU  78  13.344  -7.229   1.382
  675    HG2  GLU  78           1HG      GLU  78  11.048  -6.421   0.674
  676    HG3  GLU  78           2HG      GLU  78  11.185  -5.260   2.015
  677    H    HIS  79           H        HIS  79  13.845  -7.300   4.902
  678    HA   HIS  79           HA       HIS  79  15.455  -9.642   4.159
  679    HB2  HIS  79           1HB      HIS  79  15.726  -7.671   6.477
  680    HB3  HIS  79           2HB      HIS  79  16.921  -8.908   6.020
  681    HD1  HIS  79           1HD      HIS  79  18.188  -6.368   6.041
  682    HD2  HIS  79           2HD      HIS  79  15.939  -7.481   2.655
  683    HE1  HIS  79           1HE      HIS  79  18.930  -4.907   4.229
  Start of MODEL   16
    1    H    LYS   3           H        LYS   3   5.449 -13.080  -9.348
    2    HA   LYS   3           HA       LYS   3   5.248 -10.811  -7.659
    3    HB2  LYS   3           1HB      LYS   3   2.745 -11.470  -9.220
    4    HB3  LYS   3           2HB      LYS   3   2.791 -10.486  -7.737
    5    HG2  LYS   3           1HG      LYS   3   4.229  -8.840  -8.879
    6    HG3  LYS   3           2HG      LYS   3   4.163  -9.819 -10.364
    7    HD2  LYS   3           1HD      LYS   3   1.715  -9.529 -10.443
    8    HD3  LYS   3           2HD      LYS   3   1.789  -8.539  -8.966
    9    HE2  LYS   3           1HE      LYS   3   3.179  -6.891 -10.112
   10    HE3  LYS   3           2HE      LYS   3   3.180  -7.891 -11.583
   11    HZ1  LYS   3           3HZ      LYS   3   0.801  -6.652 -10.355
   12    HZ2  LYS   3           1HZ      LYS   3   1.566  -6.118 -11.715
   13    HZ3  LYS   3           2HZ      LYS   3   0.801  -7.581 -11.718
   14    H    ALA   4           H        ALA   4   4.085 -13.956  -8.657
   15    HA   ALA   4           HA       ALA   4   2.657 -14.565  -6.245
   16    HB1  ALA   4           1HB      ALA   4   2.780 -16.900  -7.023
   17    HB2  ALA   4           2HB      ALA   4   2.295 -15.799  -8.333
   18    HB3  ALA   4           3HB      ALA   4   3.959 -16.422  -8.265
   19    H    LYS   5           H        LYS   5   6.036 -14.699  -7.120
   20    HA   LYS   5           HA       LYS   5   6.904 -16.399  -4.954
   21    HB2  LYS   5           1HB      LYS   5   8.292 -14.253  -6.562
   22    HB3  LYS   5           2HB      LYS   5   9.104 -15.262  -5.340
   23    HG2  LYS   5           1HG      LYS   5   8.554 -17.281  -6.636
   24    HG3  LYS   5           2HG      LYS   5   7.736 -16.277  -7.855
   25    HD2  LYS   5           1HD      LYS   5   9.859 -15.115  -8.323
   26    HD3  LYS   5           2HD      LYS   5  10.676 -16.124  -7.105
   27    HE2  LYS   5           1HE      LYS   5  10.141 -18.137  -8.394
   28    HE3  LYS   5           2HE      LYS   5   9.291 -17.147  -9.604
   29    HZ1  LYS   5           3HZ      LYS   5  12.166 -16.979  -8.964
   30    HZ2  LYS   5           1HZ      LYS   5  11.523 -17.689 -10.307
   31    HZ3  LYS   5           2HZ      LYS   5  11.379 -16.061 -10.086
   32    H    LEU   6           H        LEU   6   6.139 -12.985  -5.184
   33    HA   LEU   6           HA       LEU   6   7.136 -12.518  -2.430
   34    HB2  LEU   6           1HB      LEU   6   5.748 -10.856  -4.428
   35    HB3  LEU   6           2HB      LEU   6   6.327 -10.138  -2.905
   36    HG   LEU   6           HG       LEU   6   8.034 -11.320  -5.132
   37   HD11  LEU   6          1HD1      LEU   6   8.873  -8.966  -5.363
   38   HD12  LEU   6          2HD1      LEU   6   7.117  -9.057  -5.640
   39   HD13  LEU   6          3HD1      LEU   6   7.745  -8.456  -4.086
   40   HD21  LEU   6          3HD2      LEU   6   8.997 -11.801  -2.959
   41   HD22  LEU   6          1HD2      LEU   6   9.970 -10.566  -3.793
   42   HD23  LEU   6          2HD2      LEU   6   8.858 -10.091  -2.485
   43    H    SER   7           H        SER   7   5.907 -11.966  -0.685
   44    HA   SER   7           HA       SER   7   3.153 -12.935  -0.485
   45    HB2  SER   7           1HB      SER   7   3.165 -12.258   1.643
   46    HB3  SER   7           2HB      SER   7   4.802 -12.864   1.306
   47    HG   SER   7           HG       SER   7   4.810 -10.901   2.480
   48    H    LEU   8           H        LEU   8   1.411 -11.475   0.298
   49    HA   LEU   8           HA       LEU   8   0.869  -9.307  -1.502
   50    HB2  LEU   8           1HB      LEU   8  -0.164 -10.143   1.120
   51    HB3  LEU   8           2HB      LEU   8  -0.974  -8.796   0.285
   52    HG   LEU   8           HG       LEU   8  -0.736 -11.656  -0.725
   53   HD11  LEU   8          1HD1      LEU   8  -3.222 -11.707  -0.396
   54   HD12  LEU   8          2HD1      LEU   8  -2.374 -11.397   1.137
   55   HD13  LEU   8          3HD1      LEU   8  -3.154 -10.056   0.264
   56   HD21  LEU   8          3HD2      LEU   8  -0.675 -10.058  -2.546
   57   HD22  LEU   8          1HD2      LEU   8  -2.233 -10.920  -2.547
   58   HD23  LEU   8          2HD2      LEU   8  -2.136  -9.253  -1.928
   59    H    THR   9           H        THR   9   2.416  -9.443   1.641
   60    HA   THR   9           HA       THR   9   2.321  -6.529   2.001
   61    HB   THR   9           HB       THR   9   3.777  -6.959   3.956
   62    HG1  THR   9           1HG      THR   9   4.307  -9.171   4.417
   63   HG21  THR   9          3HG2      THR   9   1.458  -8.919   3.733
   64   HG22  THR   9          1HG2      THR   9   2.202  -8.356   5.248
   65   HG23  THR   9          2HG2      THR   9   1.331  -7.208   4.203
   66    H    GLN  10           H        GLN  10   4.678  -8.929   0.905
   67    HA   GLN  10           HA       GLN  10   6.849  -7.060   0.572
   68    HB2  GLN  10           1HB      GLN  10   6.143  -9.690  -0.736
   69    HB3  GLN  10           2HB      GLN  10   7.615  -8.771  -1.135
   70    HG2  GLN  10           1HG      GLN  10   8.322  -9.106   1.454
   71    HG3  GLN  10           2HG      GLN  10   6.706  -9.850   1.387
   72   HE21  GLN  10          2HE2      GLN  10  10.104 -10.157   0.541
   73   HE22  GLN  10          1HE2      GLN  10  10.056 -11.840   0.127
   74    H    LEU  11           H        LEU  11   4.215  -8.110  -1.562
   75    HA   LEU  11           HA       LEU  11   5.090  -6.590  -3.846
   76    HB2  LEU  11           1HB      LEU  11   2.517  -7.595  -2.848
   77    HB3  LEU  11           2HB      LEU  11   2.535  -6.789  -4.433
   78    HG   LEU  11           HG       LEU  11   4.094  -9.298  -3.706
   79   HD11  LEU  11          1HD1      LEU  11   2.489 -10.459  -5.246
   80   HD12  LEU  11          2HD1      LEU  11   1.641  -9.718  -3.868
   81   HD13  LEU  11          3HD1      LEU  11   1.613  -8.927  -5.463
   82   HD21  LEU  11          3HD2      LEU  11   5.227  -7.945  -5.366
   83   HD22  LEU  11          1HD2      LEU  11   4.583  -9.420  -6.123
   84   HD23  LEU  11          2HD2      LEU  11   3.748  -7.864  -6.353
   85    H    ILE  12           H        ILE  12   2.862  -5.828  -1.178
   86    HA   ILE  12           HA       ILE  12   2.196  -3.179  -2.082
   87    HB   ILE  12           HB       ILE  12   2.325  -4.414   0.704
   88   HG12  ILE  12          1HG1      ILE  12  -0.081  -3.614  -0.895
   89   HG13  ILE  12          2HG1      ILE  12   0.669  -5.222  -1.013
   90   HG21  ILE  12          1HG2      ILE  12   1.061  -2.431   1.464
   91   HG22  ILE  12          2HG2      ILE  12   2.663  -1.969   0.844
   92   HG23  ILE  12          3HG2      ILE  12   1.214  -1.711  -0.156
   93   HD11  ILE  12          3HD1      ILE  12  -0.467  -3.970   1.512
   94   HD12  ILE  12          1HD1      ILE  12  -1.240  -5.244   0.542
   95   HD13  ILE  12          2HD1      ILE  12   0.287  -5.578   1.394
   96    H    LEU  13           H        LEU  13   4.754  -4.257   0.158
   97    HA   LEU  13           HA       LEU  13   5.572  -1.561   0.748
   98    HB2  LEU  13           1HB      LEU  13   6.860  -4.202   0.915
   99    HB3  LEU  13           2HB      LEU  13   7.689  -2.798   1.625
  100    HG   LEU  13           HG       LEU  13   4.980  -3.894   2.473
  101   HD11  LEU  13          1HD1      LEU  13   6.176  -4.526   4.586
  102   HD12  LEU  13          2HD1      LEU  13   6.883  -5.346   3.173
  103   HD13  LEU  13          3HD1      LEU  13   7.697  -3.931   3.884
  104   HD21  LEU  13          3HD2      LEU  13   5.105  -1.487   2.729
  105   HD22  LEU  13          1HD2      LEU  13   5.140  -2.271   4.327
  106   HD23  LEU  13          2HD2      LEU  13   6.641  -1.630   3.613
  107    H    ILE  14           H        ILE  14   6.792  -3.985  -1.545
  108    HA   ILE  14           HA       ILE  14   9.022  -2.322  -2.420
  109    HB   ILE  14           HB       ILE  14   7.646  -4.756  -3.637
  110   HG12  ILE  14          1HG1      ILE  14  10.374  -4.483  -2.410
  111   HG13  ILE  14          2HG1      ILE  14   8.923  -5.012  -1.527
  112   HG21  ILE  14          1HG2      ILE  14   9.550  -4.838  -5.211
  113   HG22  ILE  14          2HG2      ILE  14   8.613  -3.341  -5.421
  114   HG23  ILE  14          3HG2      ILE  14  10.164  -3.305  -4.550
  115   HD11  ILE  14          3HD1      ILE  14  10.142  -6.400  -3.940
  116   HD12  ILE  14          1HD1      ILE  14  10.276  -6.940  -2.250
  117   HD13  ILE  14          2HD1      ILE  14   8.689  -6.929  -3.058
  118    H    ARG  15           H        ARG  15   5.741  -2.861  -3.631
  119    HA   ARG  15           HA       ARG  15   6.030  -1.259  -5.991
  120    HB2  ARG  15           1HB      ARG  15   4.223  -2.749  -5.775
  121    HB3  ARG  15           2HB      ARG  15   3.614  -1.873  -4.350
  122    HG2  ARG  15           1HG      ARG  15   2.280  -1.302  -6.295
  123    HG3  ARG  15           2HG      ARG  15   3.220   0.115  -5.765
  124    HD2  ARG  15           1HD      ARG  15   4.839  -0.340  -7.531
  125    HD3  ARG  15           2HD      ARG  15   3.824  -1.693  -8.081
  126    HE   ARG  15           HE       ARG  15   2.263   0.764  -8.211
  127   HH11  ARG  15          1HH1      ARG  15   4.949  -0.775  -9.816
  128   HH12  ARG  15          2HH1      ARG  15   4.534   0.044 -11.308
  129   HH21  ARG  15          1HH2      ARG  15   1.780   1.716  -9.910
  130   HH22  ARG  15          2HH2      ARG  15   2.728   1.466 -11.362
  131    H    LEU  16           H        LEU  16   5.124  -0.420  -2.660
  132    HA   LEU  16           HA       LEU  16   4.655   2.381  -3.322
  133    HB2  LEU  16           1HB      LEU  16   5.157   0.881  -0.839
  134    HB3  LEU  16           2HB      LEU  16   4.717   2.602  -0.742
  135    HG   LEU  16           HG       LEU  16   2.995   0.331  -1.810
  136   HD11  LEU  16          1HD1      LEU  16   1.508   0.922   0.123
  137   HD12  LEU  16          2HD1      LEU  16   3.128   0.439   0.677
  138   HD13  LEU  16          3HD1      LEU  16   2.682   2.161   0.626
  139   HD21  LEU  16          3HD2      LEU  16   2.656   2.345  -3.116
  140   HD22  LEU  16          1HD2      LEU  16   1.234   2.041  -2.091
  141   HD23  LEU  16          2HD2      LEU  16   2.408   3.299  -1.634
  142    H    SER  17           H        SER  17   7.420   0.472  -2.342
  143    HA   SER  17           HA       SER  17   9.244   2.658  -1.728
  144    HB2  SER  17           1HB      SER  17   9.629   0.463  -1.005
  145    HB3  SER  17           2HB      SER  17   9.800  -0.084  -2.689
  146    HG   SER  17           HG       SER  17  11.546   1.380  -2.887
  147    H    ASN  18           H        ASN  18   8.322   0.904  -4.704
  148    HA   ASN  18           HA       ASN  18  10.412   2.107  -6.326
  149    HB2  ASN  18           1HB      ASN  18   7.900   0.547  -7.300
  150    HB3  ASN  18           2HB      ASN  18   9.234   1.422  -8.089
  151   HD21  ASN  18          2HD2      ASN  18   8.428  -1.441  -8.053
  152   HD22  ASN  18          1HD2      ASN  18   9.853  -2.305  -7.576
  153    H    ARG  19           H        ARG  19   6.960   2.808  -5.821
  154    HA   ARG  19           HA       ARG  19   7.253   5.081  -7.758
  155    HB2  ARG  19           1HB      ARG  19   4.818   3.503  -7.055
  156    HB3  ARG  19           2HB      ARG  19   4.873   4.950  -8.091
  157    HG2  ARG  19           1HG      ARG  19   6.388   2.387  -8.664
  158    HG3  ARG  19           2HG      ARG  19   4.780   2.763  -9.330
  159    HD2  ARG  19           1HD      ARG  19   5.749   4.773 -10.366
  160    HD3  ARG  19           2HD      ARG  19   7.350   4.237  -9.804
  161    HE   ARG  19           HE       ARG  19   6.235   2.154 -11.495
  162   HH11  ARG  19          1HH1      ARG  19   7.436   5.416 -11.775
  163   HH12  ARG  19          2HH1      ARG  19   7.954   5.089 -13.418
  164   HH21  ARG  19          1HH2      ARG  19   6.815   1.768 -13.377
  165   HH22  ARG  19          2HH2      ARG  19   7.599   3.010 -14.333
  166    H    GLY  20           H        GLY  20   7.127   4.437  -4.519
  167    HA2  GLY  20           1HA      GLY  20   7.374   6.169  -2.931
  168    HA3  GLY  20           2HA      GLY  20   6.623   7.311  -4.069
  169    H    CYS  21           H        CYS  21   4.242   6.362  -4.678
  170    HA   CYS  21           HA       CYS  21   2.762   5.450  -2.241
  171    HB2  CYS  21           1HB      CYS  21   3.240   7.879  -1.964
  172    HB3  CYS  21           2HB      CYS  21   2.479   8.195  -3.542
  173    HG   CYS  21           HG       CYS  21   1.004   9.041  -1.656
  174    H    GLN  22           H        GLN  22   0.933   4.411  -2.800
  175    HA   GLN  22           HA       GLN  22  -0.138   4.803  -5.568
  176    HB2  GLN  22           1HB      GLN  22   0.337   2.210  -4.087
  177    HB3  GLN  22           2HB      GLN  22  -0.666   2.361  -5.549
  178    HG2  GLN  22           1HG      GLN  22   2.429   2.935  -5.592
  179    HG3  GLN  22           2HG      GLN  22   1.425   1.490  -5.855
  180   HE21  GLN  22          2HE2      GLN  22   1.419   4.959  -6.811
  181   HE22  GLN  22          1HE2      GLN  22   1.097   4.668  -8.488
  182    H    THR  23           H        THR  23  -2.341   4.226  -5.873
  183    HA   THR  23           HA       THR  23  -4.021   4.822  -3.541
  184    HB   THR  23           HB       THR  23  -5.904   4.538  -5.105
  185    HG1  THR  23           1HG      THR  23  -3.995   3.974  -7.140
  186   HG21  THR  23          3HG2      THR  23  -3.598   6.102  -6.330
  187   HG22  THR  23          1HG2      THR  23  -5.322   6.325  -6.707
  188   HG23  THR  23          2HG2      THR  23  -4.711   6.702  -5.078
  189    H    LEU  24           H        LEU  24  -5.740   3.512  -2.781
  190    HA   LEU  24           HA       LEU  24  -5.092   0.835  -2.139
  191    HB2  LEU  24           1HB      LEU  24  -6.650   2.115  -1.020
  192    HB3  LEU  24           2HB      LEU  24  -7.833   2.198  -2.347
  193    HG   LEU  24           HG       LEU  24  -8.009  -0.318  -2.221
  194   HD11  LEU  24          1HD1      LEU  24  -7.248  -1.392  -0.085
  195   HD12  LEU  24          2HD1      LEU  24  -5.875  -0.725  -0.998
  196   HD13  LEU  24          3HD1      LEU  24  -6.517   0.151   0.413
  197   HD21  LEU  24          3HD2      LEU  24  -9.717   1.121  -1.278
  198   HD22  LEU  24          1HD2      LEU  24  -9.491  -0.311  -0.245
  199   HD23  LEU  24          2HD2      LEU  24  -8.803   1.258   0.243
  200    H    GLU  25           H        GLU  25  -6.886   2.118  -4.909
  201    HA   GLU  25           HA       GLU  25  -7.710  -0.480  -5.889
  202    HB2  GLU  25           1HB      GLU  25  -7.414   2.218  -7.209
  203    HB3  GLU  25           2HB      GLU  25  -8.058   0.775  -8.028
  204    HG2  GLU  25           1HG      GLU  25  -9.972   0.716  -6.379
  205    HG3  GLU  25           2HG      GLU  25  -9.156   2.074  -5.570
  206    H    GLU  26           H        GLU  26  -4.973   1.659  -6.656
  207    HA   GLU  26           HA       GLU  26  -3.875   0.023  -8.734
  208    HB2  GLU  26           1HB      GLU  26  -2.756   2.060  -6.833
  209    HB3  GLU  26           2HB      GLU  26  -1.692   1.139  -7.925
  210    HG2  GLU  26           1HG      GLU  26  -2.866   2.103  -9.909
  211    HG3  GLU  26           2HG      GLU  26  -4.048   2.774  -8.761
  212    H    LEU  27           H        LEU  27  -3.424  -0.020  -5.218
  213    HA   LEU  27           HA       LEU  27  -1.401  -2.082  -5.250
  214    HB2  LEU  27           1HB      LEU  27  -3.376  -1.106  -3.304
  215    HB3  LEU  27           2HB      LEU  27  -2.223  -2.353  -2.778
  216    HG   LEU  27           HG       LEU  27  -1.517   0.440  -3.760
  217   HD11  LEU  27          1HD1      LEU  27  -0.800   0.823  -1.387
  218   HD12  LEU  27          2HD1      LEU  27  -2.534   0.435  -1.484
  219   HD13  LEU  27          3HD1      LEU  27  -1.370  -0.810  -0.967
  220   HD21  LEU  27          3HD2      LEU  27   0.177  -1.189  -4.358
  221   HD22  LEU  27          1HD2      LEU  27   0.784  -0.130  -3.064
  222   HD23  LEU  27          2HD2      LEU  27   0.240  -1.783  -2.681
  223    H    GLU  28           H        GLU  28  -4.934  -2.141  -5.080
  224    HA   GLU  28           HA       GLU  28  -5.161  -4.973  -4.606
  225    HB2  GLU  28           1HB      GLU  28  -6.972  -3.338  -4.264
  226    HB3  GLU  28           2HB      GLU  28  -7.051  -3.090  -6.026
  227    HG2  GLU  28           1HG      GLU  28  -7.725  -5.537  -6.286
  228    HG3  GLU  28           2HG      GLU  28  -7.574  -5.616  -4.516
  229    H    GLU  29           H        GLU  29  -5.024  -3.042  -7.584
  230    HA   GLU  29           HA       GLU  29  -5.405  -5.385  -9.291
  231    HB2  GLU  29           1HB      GLU  29  -4.484  -2.560  -9.831
  232    HB3  GLU  29           2HB      GLU  29  -4.704  -3.801 -11.089
  233    HG2  GLU  29           1HG      GLU  29  -7.170  -3.909 -10.502
  234    HG3  GLU  29           2HG      GLU  29  -6.784  -2.733  -9.224
  235    H    PHE  30           H        PHE  30  -2.655  -3.586  -8.025
  236    HA   PHE  30           HA       PHE  30  -0.637  -4.789  -9.665
  237    HB2  PHE  30           1HB      PHE  30  -0.199  -2.807  -8.248
  238    HB3  PHE  30           2HB      PHE  30  -0.454  -3.790  -6.788
  239    HD1  PHE  30           1HD      PHE  30   1.708  -3.400  -9.777
  240    HD2  PHE  30           2HD      PHE  30   1.274  -5.004  -5.841
  241    HE1  PHE  30           1HE      PHE  30   4.110  -3.984  -9.752
  242    HE2  PHE  30           2HE      PHE  30   3.676  -5.587  -5.812
  243    HZ   PHE  30           HZ       PHE  30   5.094  -5.078  -7.769
  244    H    THR  31           H        THR  31  -2.049  -5.801  -6.561
  245    HA   THR  31           HA       THR  31  -0.396  -8.262  -6.607
  246    HB   THR  31           HB       THR  31  -1.401  -8.738  -4.423
  247    HG1  THR  31           1HG      THR  31  -2.909  -7.191  -3.559
  248   HG21  THR  31          3HG2      THR  31  -0.571  -5.819  -4.669
  249   HG22  THR  31          1HG2      THR  31  -0.579  -6.774  -3.169
  250   HG23  THR  31          2HG2      THR  31   0.534  -7.202  -4.491
  251    H    GLN  32           H        GLN  32  -3.345  -7.229  -7.854
  252    HA   GLN  32           HA       GLN  32  -5.290  -8.317  -8.518
  253    HB2  GLN  32           1HB      GLN  32  -3.250 -10.532  -8.808
  254    HB3  GLN  32           2HB      GLN  32  -4.931 -10.642  -9.383
  255    HG2  GLN  32           1HG      GLN  32  -2.904  -8.551 -10.575
  256    HG3  GLN  32           2HG      GLN  32  -3.346 -10.227 -10.980
  257   HE21  GLN  32          2HE2      GLN  32  -4.175  -6.899 -11.216
  258   HE22  GLN  32          1HE2      GLN  32  -5.680  -7.090 -12.053
  259    H    ALA  33           H        ALA  33  -5.534  -8.023  -5.990
  260    HA   ALA  33           HA       ALA  33  -6.296 -10.711  -4.929
  261    HB1  ALA  33           1HB      ALA  33  -5.577  -9.972  -2.690
  262    HB2  ALA  33           2HB      ALA  33  -4.218  -9.992  -3.840
  263    HB3  ALA  33           3HB      ALA  33  -4.979  -8.449  -3.387
  264    H    LYS  34           H        LYS  34  -7.853 -10.599  -3.117
  265    HA   LYS  34           HA       LYS  34 -10.117  -8.932  -3.763
  266    HB2  LYS  34           1HB      LYS  34 -10.233 -11.149  -2.667
  267    HB3  LYS  34           2HB      LYS  34  -9.501 -10.431  -1.212
  268    HG2  LYS  34           1HG      LYS  34 -11.424  -8.962  -0.927
  269    HG3  LYS  34           2HG      LYS  34 -12.145  -9.576  -2.434
  270    HD2  LYS  34           1HD      LYS  34 -12.237 -11.845  -1.434
  271    HD3  LYS  34           2HD      LYS  34 -11.591 -11.180   0.085
  272    HE2  LYS  34           1HE      LYS  34 -13.541  -9.685   0.254
  273    HE3  LYS  34           2HE      LYS  34 -14.190 -10.367  -1.254
  274    HZ1  LYS  34           3HZ      LYS  34 -13.719 -11.868   1.241
  275    HZ2  LYS  34           1HZ      LYS  34 -15.190 -11.378   0.681
  276    HZ3  LYS  34           2HZ      LYS  34 -14.320 -12.501  -0.159
  277    H    ARG  35           H        ARG  35 -10.899  -7.103  -2.954
  278    HA   ARG  35           HA       ARG  35  -9.106  -5.148  -1.975
  279    HB2  ARG  35           1HB      ARG  35 -11.173  -4.635  -3.086
  280    HB3  ARG  35           2HB      ARG  35 -12.075  -5.198  -1.660
  281    HG2  ARG  35           1HG      ARG  35 -11.014  -3.434  -0.304
  282    HG3  ARG  35           2HG      ARG  35 -10.140  -2.861  -1.746
  283    HD2  ARG  35           1HD      ARG  35 -11.990  -1.443  -1.318
  284    HD3  ARG  35           2HD      ARG  35 -12.293  -2.375  -2.803
  285    HE   ARG  35           HE       ARG  35 -13.679  -3.513  -0.438
  286   HH11  ARG  35          1HH1      ARG  35 -13.914  -1.178  -3.018
  287   HH12  ARG  35          2HH1      ARG  35 -15.664  -1.250  -2.931
  288   HH21  ARG  35          1HH2      ARG  35 -15.681  -3.600  -0.322
  289   HH22  ARG  35          2HH2      ARG  35 -16.672  -2.629  -1.394
  290    H    GLU  36           H        GLU  36 -11.426  -7.151  -0.156
  291    HA   GLU  36           HA       GLU  36 -10.848  -5.956   2.394
  292    HB2  GLU  36           1HB      GLU  36 -11.929  -8.659   1.601
  293    HB3  GLU  36           2HB      GLU  36 -11.788  -8.105   3.287
  294    HG2  GLU  36           1HG      GLU  36 -13.394  -6.212   2.762
  295    HG3  GLU  36           2HG      GLU  36 -13.367  -6.827   1.092
  296    H    VAL  37           H        VAL  37  -9.535  -8.847   0.781
  297    HA   VAL  37           HA       VAL  37  -7.734  -9.586   2.918
  298    HB   VAL  37           HB       VAL  37  -7.590 -10.049  -0.090
  299   HG11  VAL  37          1HG1      VAL  37  -5.914 -11.780   0.464
  300   HG12  VAL  37          2HG1      VAL  37  -5.347 -10.165   0.948
  301   HG13  VAL  37          3HG1      VAL  37  -5.975 -11.292   2.174
  302   HG21  VAL  37          3HG2      VAL  37  -9.515 -11.086   0.952
  303   HG22  VAL  37          1HG2      VAL  37  -8.322 -12.313   0.465
  304   HG23  VAL  37          2HG2      VAL  37  -8.470 -11.844   2.176
  305    H    LEU  38           H        LEU  38  -7.320  -7.440   0.121
  306    HA   LEU  38           HA       LEU  38  -4.610  -6.736   0.644
  307    HB2  LEU  38           1HB      LEU  38  -5.679  -6.213  -1.305
  308    HB3  LEU  38           2HB      LEU  38  -6.910  -5.139  -0.603
  309    HG   LEU  38           HG       LEU  38  -4.989  -3.655   0.165
  310   HD11  LEU  38          1HD1      LEU  38  -2.846  -3.898  -1.115
  311   HD12  LEU  38          2HD1      LEU  38  -3.171  -5.337  -0.122
  312   HD13  LEU  38          3HD1      LEU  38  -3.486  -5.374  -1.874
  313   HD21  LEU  38          3HD2      LEU  38  -6.422  -3.056  -1.696
  314   HD22  LEU  38          1HD2      LEU  38  -4.746  -2.568  -2.039
  315   HD23  LEU  38          2HD2      LEU  38  -5.426  -4.022  -2.811
  316    H    LEU  39           H        LEU  39  -7.632  -5.364   1.925
  317    HA   LEU  39           HA       LEU  39  -6.328  -3.237   3.367
  318    HB2  LEU  39           1HB      LEU  39  -8.884  -4.669   3.606
  319    HB3  LEU  39           2HB      LEU  39  -8.597  -3.276   4.675
  320    HG   LEU  39           HG       LEU  39  -8.678  -3.202   1.633
  321   HD11  LEU  39          1HD1      LEU  39 -10.803  -1.910   1.963
  322   HD12  LEU  39          2HD1      LEU  39 -10.928  -3.546   2.648
  323   HD13  LEU  39          3HD1      LEU  39 -10.660  -2.151   3.720
  324   HD21  LEU  39          3HD2      LEU  39  -7.147  -1.562   2.555
  325   HD22  LEU  39          1HD2      LEU  39  -8.595  -0.748   1.912
  326   HD23  LEU  39          2HD2      LEU  39  -8.403  -0.972   3.669
  327    H    VAL  40           H        VAL  40  -7.034  -6.587   4.149
  328    HA   VAL  40           HA       VAL  40  -6.420  -6.441   6.973
  329    HB   VAL  40           HB       VAL  40  -6.190  -8.704   4.950
  330   HG11  VAL  40          1HG1      VAL  40  -5.954 -10.188   6.912
  331   HG12  VAL  40          2HG1      VAL  40  -4.600  -9.038   6.812
  332   HG13  VAL  40          3HG1      VAL  40  -5.914  -8.768   7.982
  333   HG21  VAL  40          3HG2      VAL  40  -8.460  -7.960   5.349
  334   HG22  VAL  40          1HG2      VAL  40  -8.185  -9.565   6.066
  335   HG23  VAL  40          2HG2      VAL  40  -8.225  -8.121   7.106
  336    H    THR  41           H        THR  41  -4.365  -7.086   4.143
  337    HA   THR  41           HA       THR  41  -1.992  -7.417   5.808
  338    HB   THR  41           HB       THR  41  -0.762  -7.402   3.666
  339    HG1  THR  41           1HG      THR  41  -2.016  -7.138   1.723
  340   HG21  THR  41          3HG2      THR  41  -3.340  -9.014   3.538
  341   HG22  THR  41          1HG2      THR  41  -1.855  -9.355   2.620
  342   HG23  THR  41          2HG2      THR  41  -1.856  -9.494   4.394
  343    H    LEU  42           H        LEU  42  -3.516  -4.744   4.110
  344    HA   LEU  42           HA       LEU  42  -1.339  -2.880   4.558
  345    HB2  LEU  42           1HB      LEU  42  -4.232  -2.693   4.086
  346    HB3  LEU  42           2HB      LEU  42  -3.317  -1.176   4.238
  347    HG   LEU  42           HG       LEU  42  -2.821  -3.322   2.141
  348   HD11  LEU  42          1HD1      LEU  42  -3.791  -1.661   0.531
  349   HD12  LEU  42          2HD1      LEU  42  -4.981  -2.135   1.766
  350   HD13  LEU  42          3HD1      LEU  42  -4.142  -0.571   1.893
  351   HD21  LEU  42          3HD2      LEU  42  -0.819  -2.087   2.726
  352   HD22  LEU  42          1HD2      LEU  42  -1.360  -1.627   1.096
  353   HD23  LEU  42          2HD2      LEU  42  -1.664  -0.541   2.472
  354    H    THR  43           H        THR  43  -4.208  -3.822   6.404
  355    HA   THR  43           HA       THR  43  -3.867  -1.842   8.476
  356    HB   THR  43           HB       THR  43  -5.202  -4.581   8.560
  357    HG1  THR  43           1HG      THR  43  -7.103  -3.259   8.323
  358   HG21  THR  43          3HG2      THR  43  -5.399  -2.212  10.462
  359   HG22  THR  43          1HG2      THR  43  -6.362  -3.706  10.557
  360   HG23  THR  43          2HG2      THR  43  -4.601  -3.762  10.812
  361    H    ARG  44           H        ARG  44  -2.672  -5.160   8.083
  362    HA   ARG  44           HA       ARG  44  -1.507  -5.357  10.704
  363    HB2  ARG  44           1HB      ARG  44  -0.922  -6.790   8.158
  364    HB3  ARG  44           2HB      ARG  44  -0.089  -7.106   9.698
  365    HG2  ARG  44           1HG      ARG  44  -2.244  -7.684  10.739
  366    HG3  ARG  44           2HG      ARG  44  -3.068  -7.381   9.189
  367    HD2  ARG  44           1HD      ARG  44  -1.757  -9.183   8.185
  368    HD3  ARG  44           2HD      ARG  44  -1.046  -9.516   9.782
  369    HE   ARG  44           HE       ARG  44  -3.770 -10.368   8.967
  370   HH11  ARG  44          1HH1      ARG  44  -1.646  -9.748  11.664
  371   HH12  ARG  44          2HH1      ARG  44  -2.654 -10.745  12.694
  372   HH21  ARG  44          1HH2      ARG  44  -4.930 -11.519  10.133
  373   HH22  ARG  44          2HH2      ARG  44  -4.526 -11.756  11.824
  374    H    LEU  45           H        LEU  45  -0.177  -4.287   7.582
  375    HA   LEU  45           HA       LEU  45   2.455  -3.715   8.603
  376    HB2  LEU  45           1HB      LEU  45   0.802  -2.718   6.388
  377    HB3  LEU  45           2HB      LEU  45   2.476  -2.129   6.516
  378    HG   LEU  45           HG       LEU  45   1.631  -5.028   6.136
  379   HD11  LEU  45          1HD1      LEU  45   2.635  -4.768   3.851
  380   HD12  LEU  45          2HD1      LEU  45   1.276  -3.646   4.092
  381   HD13  LEU  45          3HD1      LEU  45   2.950  -3.053   4.203
  382   HD21  LEU  45          3HD2      LEU  45   3.677  -4.826   7.422
  383   HD22  LEU  45          1HD2      LEU  45   4.041  -5.454   5.796
  384   HD23  LEU  45          2HD2      LEU  45   4.379  -3.751   6.190
  385    H    HIS  46           H        HIS  46  -0.525  -1.821   8.433
  386    HA   HIS  46           HA       HIS  46   0.707   0.659   9.273
  387    HB2  HIS  46           1HB      HIS  46  -1.492   0.590   8.108
  388    HB3  HIS  46           2HB      HIS  46  -2.198  -0.247   9.511
  389    HD1  HIS  46           1HD      HIS  46  -0.371   3.033   8.800
  390    HD2  HIS  46           2HD      HIS  46  -3.467   1.550  11.244
  391    HE1  HIS  46           1HE      HIS  46  -1.188   4.944  10.087
  392    H    GLN  47           H        GLN  47  -0.930  -1.971  11.012
  393    HA   GLN  47           HA       GLN  47  -0.748  -0.724  13.604
  394    HB2  GLN  47           1HB      GLN  47  -0.975  -3.586  12.671
  395    HB3  GLN  47           2HB      GLN  47  -0.901  -3.136  14.391
  396    HG2  GLN  47           1HG      GLN  47  -3.181  -1.743  13.947
  397    HG3  GLN  47           2HG      GLN  47  -2.775  -2.366  12.331
  398   HE21  GLN  47          2HE2      GLN  47  -5.251  -2.785  13.639
  399   HE22  GLN  47          1HE2      GLN  47  -5.410  -4.480  13.964
  400    H    ARG  48           H        ARG  48   1.498  -2.627  11.688
  401    HA   ARG  48           HA       ARG  48   3.471  -2.868  13.822
  402    HB2  ARG  48           1HB      ARG  48   3.642  -3.205  10.867
  403    HB3  ARG  48           2HB      ARG  48   5.034  -3.341  11.967
  404    HG2  ARG  48           1HG      ARG  48   3.958  -5.189  13.141
  405    HG3  ARG  48           2HG      ARG  48   2.516  -5.028  12.108
  406    HD2  ARG  48           1HD      ARG  48   3.858  -5.624  10.174
  407    HD3  ARG  48           2HD      ARG  48   5.275  -5.824  11.231
  408    HE   ARG  48           HE       ARG  48   3.353  -7.692  12.202
  409   HH11  ARG  48          1HH1      ARG  48   4.893  -7.118   9.127
  410   HH12  ARG  48          2HH1      ARG  48   4.797  -8.827   8.753
  411   HH21  ARG  48          1HH2      ARG  48   3.227  -9.651  11.784
  412   HH22  ARG  48          2HH2      ARG  48   3.845 -10.274  10.267
  413    H    GLY  49           H        GLY  49   2.451  -0.321  11.767
  414    HA2  GLY  49           1HA      GLY  49   3.074   1.933  12.046
  415    HA3  GLY  49           2HA      GLY  49   4.484   1.416  13.001
  416    H    VAL  50           H        VAL  50   3.832  -0.138   9.957
  417    HA   VAL  50           HA       VAL  50   6.425   0.892   8.908
  418    HB   VAL  50           HB       VAL  50   4.514  -1.217   7.819
  419   HG11  VAL  50          1HG1      VAL  50   6.422  -1.829   6.370
  420   HG12  VAL  50          2HG1      VAL  50   5.907  -0.152   6.076
  421   HG13  VAL  50          3HG1      VAL  50   7.365  -0.480   7.043
  422   HG21  VAL  50          3HG2      VAL  50   5.457  -1.904   9.942
  423   HG22  VAL  50          1HG2      VAL  50   6.161  -2.841   8.605
  424   HG23  VAL  50          2HG2      VAL  50   7.096  -1.527   9.357
  425    H    ILE  51           H        ILE  51   2.994   0.871   8.002
  426    HA   ILE  51           HA       ILE  51   3.658   2.982   5.964
  427    HB   ILE  51           HB       ILE  51   1.898   2.052   4.520
  428   HG12  ILE  51          1HG1      ILE  51   1.674  -0.187   6.514
  429   HG13  ILE  51          2HG1      ILE  51   0.543   1.180   6.382
  430   HG21  ILE  51          1HG2      ILE  51   2.992  -0.061   3.850
  431   HG22  ILE  51          2HG2      ILE  51   4.196   1.197   4.211
  432   HG23  ILE  51          3HG2      ILE  51   3.876  -0.094   5.394
  433   HD11  ILE  51          3HD1      ILE  51   1.121  -0.865   4.209
  434   HD12  ILE  51          1HD1      ILE  51  -0.334  -0.815   5.230
  435   HD13  ILE  51          2HD1      ILE  51  -0.009   0.503   4.079
  436    H    TYR  52           H        TYR  52   1.825   4.280   5.286
  437    HA   TYR  52           HA       TYR  52  -0.343   4.475   7.314
  438    HB2  TYR  52           1HB      TYR  52  -0.062   6.841   7.579
  439    HB3  TYR  52           2HB      TYR  52   1.428   5.997   8.064
  440    HD1  TYR  52           2HD      TYR  52   3.456   6.167   6.675
  441    HD2  TYR  52           1HD      TYR  52  -0.081   8.323   5.667
  442    HE1  TYR  52           2HE      TYR  52   4.772   7.580   5.131
  443    HE2  TYR  52           1HE      TYR  52   1.222   9.749   4.113
  444    HH   TYR  52           HH       TYR  52   4.731   9.306   3.647
  445    H    ARG  53           H        ARG  53  -1.993   6.124   6.646
  446    HA   ARG  53           HA       ARG  53  -2.335   5.989   3.667
  447    HB2  ARG  53           1HB      ARG  53  -4.674   5.630   3.954
  448    HB3  ARG  53           2HB      ARG  53  -3.675   4.296   4.579
  449    HG2  ARG  53           1HG      ARG  53  -4.091   4.967   6.854
  450    HG3  ARG  53           2HG      ARG  53  -4.916   6.450   6.315
  451    HD2  ARG  53           1HD      ARG  53  -6.492   4.829   7.086
  452    HD3  ARG  53           2HD      ARG  53  -6.677   5.098   5.338
  453    HE   ARG  53           HE       ARG  53  -6.018   2.732   5.016
  454   HH11  ARG  53          1HH1      ARG  53  -5.538   3.677   8.338
  455   HH12  ARG  53          2HH1      ARG  53  -5.347   1.996   8.795
  456   HH21  ARG  53          1HH2      ARG  53  -5.795   0.803   5.522
  457   HH22  ARG  53          2HH2      ARG  53  -5.493   0.356   7.190
  458    H    LYS  54           H        LYS  54  -3.303   7.658   2.638
  459    HA   LYS  54           HA       LYS  54  -4.184   9.971   4.315
  460    HB2  LYS  54           1HB      LYS  54  -2.339  10.075   1.924
  461    HB3  LYS  54           2HB      LYS  54  -3.106  11.485   2.692
  462    HG2  LYS  54           1HG      LYS  54  -1.252   9.589   4.160
  463    HG3  LYS  54           2HG      LYS  54  -0.685  11.056   3.329
  464    HD2  LYS  54           1HD      LYS  54  -2.195  12.421   4.725
  465    HD3  LYS  54           2HD      LYS  54  -2.737  10.950   5.566
  466    HE2  LYS  54           1HE      LYS  54  -0.404  10.544   6.299
  467    HE3  LYS  54           2HE      LYS  54   0.085  12.064   5.515
  468    HZ1  LYS  54           3HZ      LYS  54  -1.848  11.824   7.730
  469    HZ2  LYS  54           1HZ      LYS  54  -0.294  12.359   7.868
  470    HZ3  LYS  54           2HZ      LYS  54  -1.394  13.233   7.003
  471    H    TRP  55           H        TRP  55  -5.826  11.178   3.548
  472    HA   TRP  55           HA       TRP  55  -7.216  10.055   1.147
  473    HB2  TRP  55           1HB      TRP  55  -8.202  11.634   3.554
  474    HB3  TRP  55           2HB      TRP  55  -9.192  11.359   2.102
  475    HD1  TRP  55           HD       TRP  55 -10.142   9.091   1.738
  476    HE1  TRP  55           1HE      TRP  55 -10.484   6.912   3.300
  477    HE3  TRP  55           3HE      TRP  55  -6.954  10.368   5.485
  478    HZ2  TRP  55           2HZ      TRP  55  -9.466   6.046   5.718
  479    HZ3  TRP  55           3HZ      TRP  55  -6.652   8.893   7.378
  480    HH2  TRP  55           HH       TRP  55  -7.853   6.757   7.550
  481    H    ARG  56           H        ARG  56  -6.583  11.032  -0.628
  482    HA   ARG  56           HA       ARG  56  -6.150  13.956  -0.667
  483    HB2  ARG  56           1HB      ARG  56  -4.668  12.562  -1.908
  484    HB3  ARG  56           2HB      ARG  56  -6.031  11.941  -2.867
  485    HG2  ARG  56           1HG      ARG  56  -6.433  14.176  -3.776
  486    HG3  ARG  56           2HG      ARG  56  -5.107  14.830  -2.784
  487    HD2  ARG  56           1HD      ARG  56  -3.519  13.501  -4.003
  488    HD3  ARG  56           2HD      ARG  56  -4.833  12.787  -4.966
  489    HE   ARG  56           HE       ARG  56  -4.721  15.700  -5.363
  490   HH11  ARG  56          1HH1      ARG  56  -3.157  12.729  -6.300
  491   HH12  ARG  56          2HH1      ARG  56  -2.668  13.459  -7.818
  492   HH21  ARG  56          1HH2      ARG  56  -4.162  16.552  -7.091
  493   HH22  ARG  56          2HH2      ARG  56  -3.241  15.638  -8.269
  494    H    HIS  57           H        HIS  57  -7.814  15.239  -0.598
  495    HA   HIS  57           HA       HIS  57 -10.408  14.454  -1.728
  496    HB2  HIS  57           1HB      HIS  57 -10.136  15.880   0.367
  497    HB3  HIS  57           2HB      HIS  57  -9.570  17.194  -0.694
  498    HD2  HIS  57           2HD      HIS  57 -11.660  18.815  -1.653
  499    HE1  HIS  57           1HE      HIS  57 -14.757  16.043  -0.776
  500    HE2  HIS  57           2HE      HIS  57 -14.134  18.447  -1.639
  501    H    PHE  58           H        PHE  58  -9.789  14.065  -3.897
  502    HA   PHE  58           HA       PHE  58  -9.131  16.551  -5.443
  503    HB2  PHE  58           1HB      PHE  58  -7.431  14.778  -5.662
  504    HB3  PHE  58           2HB      PHE  58  -8.685  13.618  -6.153
  505    HD1  PHE  58           1HD      PHE  58  -7.160  16.873  -7.130
  506    HD2  PHE  58           2HD      PHE  58  -9.169  13.312  -8.369
  507    HE1  PHE  58           1HE      PHE  58  -6.818  17.506  -9.494
  508    HE2  PHE  58           2HE      PHE  58  -8.824  13.939 -10.735
  509    HZ   PHE  58           HZ       PHE  58  -7.651  16.037 -11.298
  510    H    SER  59           H        SER  59 -10.512  17.384  -6.792
  511    HA   SER  59           HA       SER  59 -12.514  17.647  -8.062
  512    HB2  SER  59           1HB      SER  59 -12.152  14.738  -8.460
  513    HB3  SER  59           2HB      SER  59 -13.263  15.823  -9.328
  514    HG   SER  59           HG       SER  59 -11.417  17.011  -9.991
  515    H    GLY  60           H        GLY  60 -12.642  17.128  -5.107
  516    HA2  GLY  60           1HA      GLY  60 -14.455  17.135  -3.648
  517    HA3  GLY  60           2HA      GLY  60 -15.531  16.791  -5.022
  518    H    ARG  61           H        ARG  61 -12.800  14.725  -4.677
  519    HA   ARG  61           HA       ARG  61 -14.428  12.668  -3.241
  520    HB2  ARG  61           1HB      ARG  61 -12.986  12.233  -5.817
  521    HB3  ARG  61           2HB      ARG  61 -13.637  10.961  -4.758
  522    HG2  ARG  61           1HG      ARG  61 -15.308  13.148  -6.031
  523    HG3  ARG  61           2HG      ARG  61 -15.090  11.524  -6.725
  524    HD2  ARG  61           1HD      ARG  61 -16.080  10.566  -4.712
  525    HD3  ARG  61           2HD      ARG  61 -16.360  12.211  -4.094
  526    HE   ARG  61           HE       ARG  61 -18.014  10.927  -6.222
  527   HH11  ARG  61          1HH1      ARG  61 -17.216  13.860  -4.512
  528   HH12  ARG  61          2HH1      ARG  61 -18.708  14.594  -5.064
  529   HH21  ARG  61          1HH2      ARG  61 -19.729  11.752  -6.856
  530   HH22  ARG  61          2HH2      ARG  61 -20.144  13.393  -6.401
  531    H    LYS  62           H        LYS  62 -13.420  11.612  -1.718
  532    HA   LYS  62           HA       LYS  62 -10.559  12.269  -1.275
  533    HB2  LYS  62           1HB      LYS  62 -12.626  10.871   0.429
  534    HB3  LYS  62           2HB      LYS  62 -10.941  11.178   0.911
  535    HG2  LYS  62           1HG      LYS  62 -11.323  13.594   0.778
  536    HG3  LYS  62           2HG      LYS  62 -12.999  13.311   0.249
  537    HD2  LYS  62           1HD      LYS  62 -13.505  12.207   2.374
  538    HD3  LYS  62           2HD      LYS  62 -11.821  12.422   2.904
  539    HE2  LYS  62           1HE      LYS  62 -12.124  14.889   2.689
  540    HE3  LYS  62           2HE      LYS  62 -13.839  14.609   2.312
  541    HZ1  LYS  62           3HZ      LYS  62 -12.489  13.844   4.821
  542    HZ2  LYS  62           1HZ      LYS  62 -13.513  15.124   4.634
  543    HZ3  LYS  62           2HZ      LYS  62 -14.079  13.581   4.471
  544    H    TYR  63           H        TYR  63  -9.288  11.081  -2.529
  545    HA   TYR  63           HA       TYR  63  -9.791   8.170  -2.788
  546    HB2  TYR  63           1HB      TYR  63  -7.642   9.966  -3.933
  547    HB3  TYR  63           2HB      TYR  63  -7.849   8.234  -4.290
  548    HD1  TYR  63           2HD      TYR  63  -9.879   7.473  -5.541
  549    HD2  TYR  63           1HD      TYR  63  -8.983  11.612  -5.036
  550    HE1  TYR  63           2HE      TYR  63 -11.449   8.026  -7.369
  551    HE2  TYR  63           1HE      TYR  63 -10.551  12.183  -6.865
  552    HH   TYR  63           HH       TYR  63 -12.385   9.680  -8.624
  553    H    ARG  64           H        ARG  64  -8.727   6.585  -1.846
  554    HA   ARG  64           HA       ARG  64  -6.982   7.367   0.420
  555    HB2  ARG  64           1HB      ARG  64  -8.912   5.832   0.665
  556    HB3  ARG  64           2HB      ARG  64  -7.959   4.633  -0.238
  557    HG2  ARG  64           1HG      ARG  64  -6.213   4.704   1.474
  558    HG3  ARG  64           2HG      ARG  64  -7.127   5.943   2.368
  559    HD2  ARG  64           1HD      ARG  64  -8.119   3.170   1.805
  560    HD3  ARG  64           2HD      ARG  64  -7.274   3.664   3.291
  561    HE   ARG  64           HE       ARG  64  -9.360   5.017   3.852
  562   HH11  ARG  64          1HH1      ARG  64  -9.679   2.945   1.066
  563   HH12  ARG  64          2HH1      ARG  64 -11.423   2.980   1.231
  564   HH21  ARG  64          1HH2      ARG  64 -11.357   5.075   4.051
  565   HH22  ARG  64          2HH2      ARG  64 -12.382   4.194   2.932
  566    H    GLU  65           H        GLU  65  -4.897   7.430   0.302
  567    HA   GLU  65           HA       GLU  65  -3.528   5.531  -1.579
  568    HB2  GLU  65           1HB      GLU  65  -2.768   8.351  -0.803
  569    HB3  GLU  65           2HB      GLU  65  -1.740   7.231  -1.731
  570    HG2  GLU  65           1HG      GLU  65  -3.551   7.207  -3.551
  571    HG3  GLU  65           2HG      GLU  65  -4.404   8.355  -2.493
  572    H    TYR  66           H        TYR  66  -1.597   4.626  -0.964
  573    HA   TYR  66           HA       TYR  66  -1.028   4.807   1.980
  574    HB2  TYR  66           1HB      TYR  66  -1.010   2.440   0.106
  575    HB3  TYR  66           2HB      TYR  66  -0.206   2.437   1.695
  576    HD1  TYR  66           1HD      TYR  66  -3.497   2.668  -0.009
  577    HD2  TYR  66           2HD      TYR  66  -1.469   2.167   3.708
  578    HE1  TYR  66           1HE      TYR  66  -5.639   2.040   1.066
  579    HE2  TYR  66           2HE      TYR  66  -3.597   1.539   4.796
  580    HH   TYR  66           HH       TYR  66  -6.683   1.464   3.001
  581    H    CYS  67           H        CYS  67   1.045   4.796   2.682
  582    HA   CYS  67           HA       CYS  67   3.302   4.562   0.728
  583    HB2  CYS  67           1HB      CYS  67   2.435   6.847   0.466
  584    HB3  CYS  67           2HB      CYS  67   2.491   7.091   2.229
  585    HG   CYS  67           HG       CYS  67   4.268   8.493   1.080
  586    H    LEU  68           H        LEU  68   5.285   4.278   1.747
  587    HA   LEU  68           HA       LEU  68   5.137   3.173   4.445
  588    HB2  LEU  68           1HB      LEU  68   7.077   3.545   2.320
  589    HB3  LEU  68           2HB      LEU  68   7.811   3.186   3.900
  590    HG   LEU  68           HG       LEU  68   6.298   1.125   3.965
  591   HD11  LEU  68          1HD1      LEU  68   5.547   0.278   1.727
  592   HD12  LEU  68          2HD1      LEU  68   4.766   1.824   2.128
  593   HD13  LEU  68          3HD1      LEU  68   6.126   1.786   0.979
  594   HD21  LEU  68          3HD2      LEU  68   8.689   0.980   3.590
  595   HD22  LEU  68          1HD2      LEU  68   7.842  -0.213   2.577
  596   HD23  LEU  68          2HD2      LEU  68   8.465   1.290   1.852
  597    H    LYS  69           H        LYS  69   5.740   3.972   6.332
  598    HA   LYS  69           HA       LYS  69   6.734   6.771   6.427
  599    HB2  LYS  69           1HB      LYS  69   4.929   6.030   7.932
  600    HB3  LYS  69           2HB      LYS  69   6.036   4.826   8.634
  601    HG2  LYS  69           1HG      LYS  69   7.464   6.571   9.513
  602    HG3  LYS  69           2HG      LYS  69   6.506   7.824   8.688
  603    HD2  LYS  69           1HD      LYS  69   4.544   7.229  10.048
  604    HD3  LYS  69           2HD      LYS  69   5.495   5.969  10.871
  605    HE2  LYS  69           1HE      LYS  69   7.008   7.649  11.771
  606    HE3  LYS  69           2HE      LYS  69   6.158   8.929  10.878
  607    HZ1  LYS  69           3HZ      LYS  69   4.990   7.265  13.016
  608    HZ2  LYS  69           1HZ      LYS  69   5.465   8.837  13.175
  609    HZ3  LYS  69           2HZ      LYS  69   4.200   8.455  12.188
  610    H    HIS  70           H        HIS  70   7.811   3.476   7.073
  611    HA   HIS  70           HA       HIS  70  10.275   4.278   8.377
  612    HB2  HIS  70           1HB      HIS  70   9.386   1.667   7.079
  613    HB3  HIS  70           2HB      HIS  70  10.940   1.876   7.918
  614    HD2  HIS  70           2HD      HIS  70   8.482   3.747  10.141
  615    HE1  HIS  70           1HE      HIS  70   8.363  -0.331  11.326
  616    HE2  HIS  70           2HE      HIS  70   7.729   2.152  11.914
  617    H    ARG  71           H        ARG  71  11.493   5.684   7.291
  618    HA   ARG  71           HA       ARG  71  12.162   5.447   4.497
  619    HB2  ARG  71           1HB      ARG  71  13.453   6.893   6.755
  620    HB3  ARG  71           2HB      ARG  71  14.097   6.880   5.098
  621    HG2  ARG  71           1HG      ARG  71  11.993   7.860   4.278
  622    HG3  ARG  71           2HG      ARG  71  11.357   7.881   5.941
  623    HD2  ARG  71           1HD      ARG  71  13.053   9.448   6.593
  624    HD3  ARG  71           2HD      ARG  71  13.759   9.391   4.960
  625    HE   ARG  71           HE       ARG  71  11.045  10.373   4.714
  626   HH11  ARG  71          1HH1      ARG  71  14.075  11.400   6.101
  627   HH12  ARG  71          2HH1      ARG  71  13.638  13.076   5.833
  628   HH21  ARG  71          1HH2      ARG  71  10.527  12.288   4.406
  629   HH22  ARG  71          2HH2      ARG  71  11.615  13.584   4.867
  630    H    ASP  72           H        ASP  72  13.477   4.008   7.415
  631    HA   ASP  72           HA       ASP  72  15.884   2.961   6.242
  632    HB2  ASP  72           1HB      ASP  72  14.201   1.938   8.606
  633    HB3  ASP  72           2HB      ASP  72  15.713   1.283   7.935
  634    H    GLU  73           H        GLU  73  12.575   1.693   6.438
  635    HA   GLU  73           HA       GLU  73  13.245  -0.810   5.114
  636    HB2  GLU  73           1HB      GLU  73  10.647   0.658   5.570
  637    HB3  GLU  73           2HB      GLU  73  10.767  -0.932   4.779
  638    HG2  GLU  73           1HG      GLU  73  11.508  -0.313   7.701
  639    HG3  GLU  73           2HG      GLU  73  10.118  -1.190   7.025
  640    H    LEU  74           H        LEU  74  11.986   2.325   4.029
  641    HA   LEU  74           HA       LEU  74  11.605   1.650   1.292
  642    HB2  LEU  74           1HB      LEU  74  12.395   4.042   2.782
  643    HB3  LEU  74           2HB      LEU  74  12.260   4.215   1.017
  644    HG   LEU  74           HG       LEU  74  10.016   3.344   2.876
  645   HD11  LEU  74          1HD1      LEU  74   9.031   5.597   2.377
  646   HD12  LEU  74          2HD1      LEU  74  10.608   5.747   3.186
  647   HD13  LEU  74          3HD1      LEU  74  10.481   6.005   1.430
  648   HD21  LEU  74          3HD2      LEU  74   9.824   2.399   0.653
  649   HD22  LEU  74          1HD2      LEU  74   8.574   3.644   0.892
  650   HD23  LEU  74          2HD2      LEU  74  10.021   4.009  -0.081
  651    H    ALA  75           H        ALA  75  14.530   2.753   2.992
  652    HA   ALA  75           HA       ALA  75  16.193   2.770   0.662
  653    HB1  ALA  75           1HB      ALA  75  18.066   2.733   2.265
  654    HB2  ALA  75           2HB      ALA  75  16.820   3.911   2.742
  655    HB3  ALA  75           3HB      ALA  75  16.932   2.344   3.579
  656    H    ASP  76           H        ASP  76  15.538   0.259   3.100
  657    HA   ASP  76           HA       ASP  76  17.426  -1.640   2.038
  658    HB2  ASP  76           1HB      ASP  76  14.926  -2.052   3.786
  659    HB3  ASP  76           2HB      ASP  76  16.082  -3.262   3.174
  660    H    LEU  77           H        LEU  77  14.044  -0.947   1.308
  661    HA   LEU  77           HA       LEU  77  13.675  -3.275  -0.379
  662    HB2  LEU  77           1HB      LEU  77  12.387  -0.646  -0.105
  663    HB3  LEU  77           2HB      LEU  77  11.684  -1.817  -1.248
  664    HG   LEU  77           HG       LEU  77  12.001  -2.258   1.747
  665   HD11  LEU  77          1HD1      LEU  77   9.506  -2.009   1.824
  666   HD12  LEU  77          2HD1      LEU  77  10.286  -0.521   1.241
  667   HD13  LEU  77          3HD1      LEU  77   9.505  -1.627   0.087
  668   HD21  LEU  77          3HD2      LEU  77  12.088  -4.315   0.465
  669   HD22  LEU  77          1HD2      LEU  77  10.555  -4.226   1.365
  670   HD23  LEU  77          2HD2      LEU  77  10.582  -3.885  -0.382
  671    H    GLU  78           H        GLU  78  14.752   0.041  -0.950
  672    HA   GLU  78           HA       GLU  78  14.919  -0.275  -3.837
  673    HB2  GLU  78           1HB      GLU  78  16.159   1.649  -1.871
  674    HB3  GLU  78           2HB      GLU  78  16.448   1.718  -3.627
  675    HG2  GLU  78           1HG      GLU  78  13.726   2.115  -2.243
  676    HG3  GLU  78           2HG      GLU  78  14.821   3.305  -2.982
  677    H    HIS  79           H        HIS  79  17.058  -0.943  -1.134
  678    HA   HIS  79           HA       HIS  79  19.421  -1.380  -2.757
  679    HB2  HIS  79           1HB      HIS  79  18.671  -2.340   0.040
  680    HB3  HIS  79           2HB      HIS  79  20.271  -2.558  -0.709
  681    HD2  HIS  79           2HD      HIS  79  19.859   0.901  -1.835
  682    HE1  HIS  79           1HE      HIS  79  20.723   1.268   2.309
  683    HE2  HIS  79           2HE      HIS  79  20.582   2.470  -0.025
  Start of MODEL   17
    1    H    LYS   3           H        LYS   3   8.883 -16.762  -4.057
    2    HA   LYS   3           HA       LYS   3   6.963 -17.745  -2.219
    3    HB2  LYS   3           1HB      LYS   3   9.596 -16.915  -0.988
    4    HB3  LYS   3           2HB      LYS   3   8.060 -17.082  -0.104
    5    HG2  LYS   3           1HG      LYS   3   7.996 -19.480  -0.682
    6    HG3  LYS   3           2HG      LYS   3   9.543 -19.308  -1.545
    7    HD2  LYS   3           1HD      LYS   3  10.650 -18.640   0.538
    8    HD3  LYS   3           2HD      LYS   3   9.105 -18.763   1.411
    9    HE2  LYS   3           1HE      LYS   3   8.990 -21.162   0.857
   10    HE3  LYS   3           2HE      LYS   3  10.547 -21.034   0.008
   11    HZ1  LYS   3           3HZ      LYS   3  10.118 -20.532   2.882
   12    HZ2  LYS   3           1HZ      LYS   3  10.821 -21.879   2.238
   13    HZ3  LYS   3           2HZ      LYS   3  11.563 -20.413   2.094
   14    H    ALA   4           H        ALA   4   8.984 -15.260  -3.496
   15    HA   ALA   4           HA       ALA   4   7.800 -13.032  -2.131
   16    HB1  ALA   4           1HB      ALA   4   8.727 -11.690  -3.979
   17    HB2  ALA   4           2HB      ALA   4   9.921 -12.853  -3.352
   18    HB3  ALA   4           3HB      ALA   4   9.076 -13.181  -4.883
   19    H    LYS   5           H        LYS   5   6.875 -14.870  -4.995
   20    HA   LYS   5           HA       LYS   5   4.722 -13.033  -5.731
   21    HB2  LYS   5           1HB      LYS   5   5.369 -15.877  -6.512
   22    HB3  LYS   5           2HB      LYS   5   4.012 -14.937  -7.177
   23    HG2  LYS   5           1HG      LYS   5   5.600 -13.285  -8.080
   24    HG3  LYS   5           2HG      LYS   5   6.956 -14.229  -7.420
   25    HD2  LYS   5           1HD      LYS   5   6.323 -16.141  -8.830
   26    HD3  LYS   5           2HD      LYS   5   4.953 -15.209  -9.482
   27    HE2  LYS   5           1HE      LYS   5   6.518 -13.547 -10.394
   28    HE3  LYS   5           2HE      LYS   5   7.887 -14.477  -9.741
   29    HZ1  LYS   5           3HZ      LYS   5   5.978 -15.435 -11.775
   30    HZ2  LYS   5           1HZ      LYS   5   7.525 -14.942 -12.069
   31    HZ3  LYS   5           2HZ      LYS   5   7.247 -16.298 -11.172
   32    H    LEU   6           H        LEU   6   5.094 -15.661  -3.507
   33    HA   LEU   6           HA       LEU   6   2.194 -16.159  -3.326
   34    HB2  LEU   6           1HB      LEU   6   4.558 -17.015  -1.788
   35    HB3  LEU   6           2HB      LEU   6   2.960 -17.699  -1.404
   36    HG   LEU   6           HG       LEU   6   4.497 -18.027  -4.012
   37   HD11  LEU   6          1HD1      LEU   6   4.589 -20.443  -3.340
   38   HD12  LEU   6          2HD1      LEU   6   5.387 -19.407  -2.136
   39   HD13  LEU   6          3HD1      LEU   6   3.753 -20.038  -1.824
   40   HD21  LEU   6          3HD2      LEU   6   2.110 -17.887  -4.415
   41   HD22  LEU   6          1HD2      LEU   6   2.671 -19.557  -4.668
   42   HD23  LEU   6          2HD2      LEU   6   1.798 -19.127  -3.177
   43    H    SER   7           H        SER   7   4.697 -14.474  -1.486
   44    HA   SER   7           HA       SER   7   2.943 -13.857   0.807
   45    HB2  SER   7           1HB      SER   7   5.145 -14.171   1.265
   46    HB3  SER   7           2HB      SER   7   5.658 -12.991   0.035
   47    HG   SER   7           HG       SER   7   4.244 -12.502   2.440
   48    H    LEU   8           H        LEU   8   1.252 -12.511   0.453
   49    HA   LEU   8           HA       LEU   8   1.252 -10.299  -1.390
   50    HB2  LEU   8           1HB      LEU   8  -0.211 -10.944   1.079
   51    HB3  LEU   8           2HB      LEU   8  -0.714  -9.524   0.135
   52    HG   LEU   8           HG       LEU   8  -0.766 -12.424  -0.780
   53   HD11  LEU   8          1HD1      LEU   8  -3.252 -12.086  -0.824
   54   HD12  LEU   8          2HD1      LEU   8  -2.593 -11.834   0.808
   55   HD13  LEU   8          3HD1      LEU   8  -3.022 -10.434  -0.204
   56   HD21  LEU   8          3HD2      LEU   8  -0.197 -10.943  -2.614
   57   HD22  LEU   8          1HD2      LEU   8  -1.853 -11.558  -2.823
   58   HD23  LEU   8          2HD2      LEU   8  -1.589  -9.898  -2.239
   59    H    THR   9           H        THR   9   2.209 -10.613   1.995
   60    HA   THR   9           HA       THR   9   2.649  -7.850   2.541
   61    HB   THR   9           HB       THR   9   4.205 -10.279   3.525
   62    HG1  THR   9           1HG      THR   9   2.787 -10.002   5.349
   63   HG21  THR   9          3HG2      THR   9   4.020  -7.446   4.625
   64   HG22  THR   9          1HG2      THR   9   4.866  -8.808   5.397
   65   HG23  THR   9          2HG2      THR   9   5.446  -8.165   3.841
   66    H    GLN  10           H        GLN  10   4.841 -10.278   1.120
   67    HA   GLN  10           HA       GLN  10   7.026  -8.441   0.753
   68    HB2  GLN  10           1HB      GLN  10   7.162 -10.933   0.707
   69    HB3  GLN  10           2HB      GLN  10   6.319 -10.900  -0.861
   70    HG2  GLN  10           1HG      GLN  10   8.827 -10.982  -1.482
   71    HG3  GLN  10           2HG      GLN  10   7.963  -9.434  -1.623
   72   HE21  GLN  10          2HE2      GLN  10   9.921  -8.273  -1.535
   73   HE22  GLN  10          1HE2      GLN  10  10.797  -8.076  -0.054
   74    H    LEU  11           H        LEU  11   4.333  -9.412  -1.347
   75    HA   LEU  11           HA       LEU  11   5.261  -8.030  -3.679
   76    HB2  LEU  11           1HB      LEU  11   2.640  -8.831  -2.620
   77    HB3  LEU  11           2HB      LEU  11   2.688  -8.089  -4.237
   78    HG   LEU  11           HG       LEU  11   4.081 -10.666  -3.414
   79   HD11  LEU  11          1HD1      LEU  11   2.416 -11.765  -4.936
   80   HD12  LEU  11          2HD1      LEU  11   1.608 -10.918  -3.596
   81   HD13  LEU  11          3HD1      LEU  11   1.652 -10.183  -5.215
   82   HD21  LEU  11          3HD2      LEU  11   5.325  -9.453  -5.105
   83   HD22  LEU  11          1HD2      LEU  11   4.586 -10.906  -5.820
   84   HD23  LEU  11          2HD2      LEU  11   3.866  -9.303  -6.113
   85    H    ILE  12           H        ILE  12   3.224  -6.982  -0.969
   86    HA   ILE  12           HA       ILE  12   2.614  -4.364  -1.946
   87    HB   ILE  12           HB       ILE  12   3.065  -5.414   0.880
   88   HG12  ILE  12          1HG1      ILE  12   0.501  -4.588  -0.435
   89   HG13  ILE  12          2HG1      ILE  12   1.154  -6.239  -0.539
   90   HG21  ILE  12          1HG2      ILE  12   2.011  -3.317   1.654
   91   HG22  ILE  12          2HG2      ILE  12   3.534  -2.989   0.794
   92   HG23  ILE  12          3HG2      ILE  12   1.975  -2.718  -0.020
   93   HD11  ILE  12          3HD1      ILE  12   0.437  -4.768   2.021
   94   HD12  ILE  12          1HD1      ILE  12  -0.522  -6.056   1.258
   95   HD13  ILE  12          2HD1      ILE  12   1.090  -6.419   1.919
   96    H    LEU  13           H        LEU  13   5.479  -5.547  -0.231
   97    HA   LEU  13           HA       LEU  13   6.610  -2.839  -0.133
   98    HB2  LEU  13           1HB      LEU  13   7.654  -5.540   0.419
   99    HB3  LEU  13           2HB      LEU  13   8.629  -4.107   0.824
  100    HG   LEU  13           HG       LEU  13   5.976  -4.939   2.058
  101   HD11  LEU  13          1HD1      LEU  13   7.332  -5.092   4.162
  102   HD12  LEU  13          2HD1      LEU  13   7.962  -6.184   2.906
  103   HD13  LEU  13          3HD1      LEU  13   8.786  -4.642   3.240
  104   HD21  LEU  13          3HD2      LEU  13   6.050  -2.530   1.792
  105   HD22  LEU  13          1HD2      LEU  13   6.220  -2.956   3.511
  106   HD23  LEU  13          2HD2      LEU  13   7.649  -2.465   2.570
  107    H    ILE  14           H        ILE  14   6.776  -5.613  -2.239
  108    HA   ILE  14           HA       ILE  14   9.055  -4.690  -3.793
  109    HB   ILE  14           HB       ILE  14   6.693  -6.504  -4.440
  110   HG12  ILE  14          1HG1      ILE  14   9.609  -7.157  -4.138
  111   HG13  ILE  14          2HG1      ILE  14   8.425  -7.240  -2.811
  112   HG21  ILE  14          1HG2      ILE  14   7.903  -7.082  -6.515
  113   HG22  ILE  14          2HG2      ILE  14   7.454  -5.361  -6.495
  114   HG23  ILE  14          3HG2      ILE  14   9.130  -5.846  -6.146
  115   HD11  ILE  14          3HD1      ILE  14   8.310  -8.828  -5.400
  116   HD12  ILE  14          1HD1      ILE  14   8.798  -9.461  -3.811
  117   HD13  ILE  14          2HD1      ILE  14   7.127  -8.910  -4.074
  118    H    ARG  15           H        ARG  15   5.565  -4.129  -4.037
  119    HA   ARG  15           HA       ARG  15   5.819  -2.400  -6.356
  120    HB2  ARG  15           1HB      ARG  15   3.768  -3.495  -5.879
  121    HB3  ARG  15           2HB      ARG  15   3.633  -2.624  -4.334
  122    HG2  ARG  15           1HG      ARG  15   2.180  -1.607  -6.004
  123    HG3  ARG  15           2HG      ARG  15   3.492  -0.490  -5.555
  124    HD2  ARG  15           1HD      ARG  15   4.677  -1.076  -7.582
  125    HD3  ARG  15           2HD      ARG  15   3.357  -2.180  -8.031
  126    HE   ARG  15           HE       ARG  15   2.187   0.435  -7.832
  127   HH11  ARG  15          1HH1      ARG  15   4.670  -1.084  -9.750
  128   HH12  ARG  15          2HH1      ARG  15   4.300  -0.014 -11.088
  129   HH21  ARG  15          1HH2      ARG  15   1.755   1.673  -9.352
  130   HH22  ARG  15          2HH2      ARG  15   2.638   1.560 -10.862
  131    H    LEU  16           H        LEU  16   5.803  -1.860  -2.854
  132    HA   LEU  16           HA       LEU  16   6.048   1.062  -3.277
  133    HB2  LEU  16           1HB      LEU  16   6.009  -0.704  -0.919
  134    HB3  LEU  16           2HB      LEU  16   6.068   1.062  -0.705
  135    HG   LEU  16           HG       LEU  16   3.806  -0.556  -1.940
  136   HD11  LEU  16          1HD1      LEU  16   2.496   0.300   0.021
  137   HD12  LEU  16          2HD1      LEU  16   3.901  -0.656   0.549
  138   HD13  LEU  16          3HD1      LEU  16   3.957   1.122   0.617
  139   HD21  LEU  16          3HD2      LEU  16   4.081   1.553  -3.102
  140   HD22  LEU  16          1HD2      LEU  16   2.604   1.595  -2.110
  141   HD23  LEU  16          2HD2      LEU  16   4.072   2.439  -1.559
  142    H    SER  17           H        SER  17   8.142  -1.412  -3.559
  143    HA   SER  17           HA       SER  17  10.572  -0.296  -2.403
  144    HB2  SER  17           1HB      SER  17  10.447  -2.523  -3.083
  145    HB3  SER  17           2HB      SER  17  10.182  -2.024  -4.771
  146    HG   SER  17           HG       SER  17  12.377  -2.490  -4.317
  147    H    ASN  18           H        ASN  18   9.072  -0.083  -5.662
  148    HA   ASN  18           HA       ASN  18  10.892   2.152  -6.370
  149    HB2  ASN  18           1HB      ASN  18   8.786   0.806  -8.223
  150    HB3  ASN  18           2HB      ASN  18   9.932   2.166  -8.325
  151   HD21  ASN  18          2HD2      ASN  18   9.673  -0.473  -9.740
  152   HD22  ASN  18          1HD2      ASN  18  11.244  -1.188  -9.616
  153    H    ARG  19           H        ARG  19   7.477   1.557  -5.683
  154    HA   ARG  19           HA       ARG  19   6.847   4.414  -6.185
  155    HB2  ARG  19           1HB      ARG  19   5.053   2.186  -5.332
  156    HB3  ARG  19           2HB      ARG  19   4.582   3.851  -5.746
  157    HG2  ARG  19           1HG      ARG  19   5.975   1.997  -7.691
  158    HG3  ARG  19           2HG      ARG  19   4.204   2.091  -7.542
  159    HD2  ARG  19           1HD      ARG  19   4.697   3.450  -9.321
  160    HD3  ARG  19           2HD      ARG  19   4.499   4.578  -7.961
  161    HE   ARG  19           HE       ARG  19   6.865   5.182  -8.280
  162   HH11  ARG  19          1HH1      ARG  19   6.188   2.231 -10.008
  163   HH12  ARG  19          2HH1      ARG  19   7.745   2.336 -10.808
  164   HH21  ARG  19          1HH2      ARG  19   8.653   5.312  -9.181
  165   HH22  ARG  19          2HH2      ARG  19   9.151   4.092 -10.337
  166    H    GLY  20           H        GLY  20   5.964   5.807  -4.678
  167    HA2  GLY  20           1HA      GLY  20   7.050   5.314  -1.957
  168    HA3  GLY  20           2HA      GLY  20   6.591   6.890  -2.645
  169    H    CYS  21           H        CYS  21   4.065   5.509  -3.703
  170    HA   CYS  21           HA       CYS  21   2.463   4.899  -1.281
  171    HB2  CYS  21           1HB      CYS  21   2.907   7.331  -1.122
  172    HB3  CYS  21           2HB      CYS  21   2.274   7.553  -2.772
  173    HG   CYS  21           HG       CYS  21   0.666   8.521  -1.061
  174    H    GLN  22           H        GLN  22   1.023   3.464  -1.996
  175    HA   GLN  22           HA       GLN  22  -0.285   3.964  -4.642
  176    HB2  GLN  22           1HB      GLN  22   0.713   1.351  -3.496
  177    HB3  GLN  22           2HB      GLN  22  -0.428   1.470  -4.857
  178    HG2  GLN  22           1HG      GLN  22   2.521   2.553  -5.051
  179    HG3  GLN  22           2HG      GLN  22   1.733   1.001  -5.418
  180   HE21  GLN  22          2HE2      GLN  22   1.189   4.517  -5.963
  181   HE22  GLN  22          1HE2      GLN  22   0.737   4.358  -7.628
  182    H    THR  23           H        THR  23  -2.373   2.997  -4.901
  183    HA   THR  23           HA       THR  23  -3.914   3.176  -2.377
  184    HB   THR  23           HB       THR  23  -5.886   3.198  -3.786
  185    HG1  THR  23           1HG      THR  23  -5.294   3.129  -6.209
  186   HG21  THR  23          3HG2      THR  23  -3.677   4.859  -5.062
  187   HG22  THR  23          1HG2      THR  23  -5.424   5.156  -5.218
  188   HG23  THR  23          2HG2      THR  23  -4.631   5.321  -3.632
  189    H    LEU  24           H        LEU  24  -5.736   1.651  -2.055
  190    HA   LEU  24           HA       LEU  24  -4.835  -1.060  -1.877
  191    HB2  LEU  24           1HB      LEU  24  -6.443  -0.140  -0.506
  192    HB3  LEU  24           2HB      LEU  24  -7.661   0.130  -1.774
  193    HG   LEU  24           HG       LEU  24  -7.702  -2.356  -2.155
  194   HD11  LEU  24          1HD1      LEU  24  -6.785  -3.808  -0.326
  195   HD12  LEU  24          2HD1      LEU  24  -5.494  -2.879  -1.123
  196   HD13  LEU  24          3HD1      LEU  24  -6.113  -2.361   0.463
  197   HD21  LEU  24          3HD2      LEU  24  -9.437  -1.257  -0.867
  198   HD22  LEU  24          1HD2      LEU  24  -9.088  -2.857  -0.171
  199   HD23  LEU  24          2HD2      LEU  24  -8.460  -1.388   0.616
  200    H    GLU  25           H        GLU  25  -6.661   0.655  -4.359
  201    HA   GLU  25           HA       GLU  25  -7.371  -1.777  -5.806
  202    HB2  GLU  25           1HB      GLU  25  -7.359   1.148  -6.560
  203    HB3  GLU  25           2HB      GLU  25  -7.932  -0.159  -7.624
  204    HG2  GLU  25           1HG      GLU  25  -9.738  -0.706  -5.931
  205    HG3  GLU  25           2HG      GLU  25  -8.998   0.561  -4.925
  206    H    GLU  26           H        GLU  26  -4.804   0.654  -6.075
  207    HA   GLU  26           HA       GLU  26  -3.610  -0.458  -8.454
  208    HB2  GLU  26           1HB      GLU  26  -2.552   1.214  -6.179
  209    HB3  GLU  26           2HB      GLU  26  -1.543   0.695  -7.551
  210    HG2  GLU  26           1HG      GLU  26  -3.071   1.967  -9.120
  211    HG3  GLU  26           2HG      GLU  26  -4.050   2.319  -7.677
  212    H    LEU  27           H        LEU  27  -3.029  -1.022  -4.987
  213    HA   LEU  27           HA       LEU  27  -0.969  -3.008  -5.463
  214    HB2  LEU  27           1HB      LEU  27  -2.771  -2.344  -3.235
  215    HB3  LEU  27           2HB      LEU  27  -1.534  -3.597  -2.985
  216    HG   LEU  27           HG       LEU  27  -1.002  -0.680  -3.668
  217   HD11  LEU  27          1HD1      LEU  27  -0.094  -0.551  -1.333
  218   HD12  LEU  27          2HD1      LEU  27  -1.819  -0.989  -1.332
  219   HD13  LEU  27          3HD1      LEU  27  -0.580  -2.241  -1.066
  220   HD21  LEU  27          3HD2      LEU  27   0.677  -2.162  -4.594
  221   HD22  LEU  27          1HD2      LEU  27   1.364  -1.240  -3.236
  222   HD23  LEU  27          2HD2      LEU  27   0.901  -2.944  -3.012
  223    H    GLU  28           H        GLU  28  -4.472  -3.101  -5.169
  224    HA   GLU  28           HA       GLU  28  -4.781  -5.938  -5.002
  225    HB2  GLU  28           1HB      GLU  28  -6.601  -4.356  -4.662
  226    HB3  GLU  28           2HB      GLU  28  -6.497  -3.859  -6.368
  227    HG2  GLU  28           1HG      GLU  28  -7.102  -6.321  -6.970
  228    HG3  GLU  28           2HG      GLU  28  -7.331  -6.479  -5.214
  229    H    GLU  29           H        GLU  29  -4.574  -3.805  -7.855
  230    HA   GLU  29           HA       GLU  29  -4.793  -5.995  -9.739
  231    HB2  GLU  29           1HB      GLU  29  -3.755  -3.171  -9.978
  232    HB3  GLU  29           2HB      GLU  29  -3.883  -4.304 -11.344
  233    HG2  GLU  29           1HG      GLU  29  -6.382  -4.370 -11.047
  234    HG3  GLU  29           2HG      GLU  29  -6.122  -3.384  -9.591
  235    H    PHE  30           H        PHE  30  -2.070  -4.325  -8.218
  236    HA   PHE  30           HA       PHE  30   0.012  -5.589  -9.719
  237    HB2  PHE  30           1HB      PHE  30   0.436  -3.668  -8.226
  238    HB3  PHE  30           2HB      PHE  30   0.003  -4.660  -6.814
  239    HD1  PHE  30           1HD      PHE  30   2.477  -4.172  -9.506
  240    HD2  PHE  30           2HD      PHE  30   1.533  -6.145  -5.836
  241    HE1  PHE  30           1HE      PHE  30   4.834  -4.885  -9.285
  242    HE2  PHE  30           2HE      PHE  30   3.891  -6.858  -5.611
  243    HZ   PHE  30           HZ       PHE  30   5.541  -6.228  -7.338
  244    H    THR  31           H        THR  31  -1.594  -6.580  -6.692
  245    HA   THR  31           HA       THR  31   0.015  -9.049  -6.606
  246    HB   THR  31           HB       THR  31  -1.267  -9.550  -4.562
  247    HG1  THR  31           1HG      THR  31  -2.686  -7.146  -5.193
  248   HG21  THR  31          3HG2      THR  31  -0.364  -6.645  -4.686
  249   HG22  THR  31          1HG2      THR  31  -0.569  -7.610  -3.205
  250   HG23  THR  31          2HG2      THR  31   0.688  -8.049  -4.386
  251    H    GLN  32           H        GLN  32  -2.950  -8.028  -7.982
  252    HA   GLN  32           HA       GLN  32  -4.743  -9.184  -8.901
  253    HB2  GLN  32           1HB      GLN  32  -2.646 -11.353  -9.149
  254    HB3  GLN  32           2HB      GLN  32  -4.212 -11.310  -9.996
  255    HG2  GLN  32           1HG      GLN  32  -3.256  -9.070 -11.220
  256    HG3  GLN  32           2HG      GLN  32  -1.927  -9.549 -10.139
  257   HE21  GLN  32          2HE2      GLN  32  -1.374  -9.220 -12.768
  258   HE22  GLN  32          1HE2      GLN  32  -1.118 -10.750 -13.539
  259    H    ALA  33           H        ALA  33  -4.756  -9.179  -6.157
  260    HA   ALA  33           HA       ALA  33  -5.643 -11.959  -5.503
  261    HB1  ALA  33           1HB      ALA  33  -4.744 -11.632  -3.231
  262    HB2  ALA  33           2HB      ALA  33  -3.463 -11.526  -4.463
  263    HB3  ALA  33           3HB      ALA  33  -4.106 -10.044  -3.716
  264    H    LYS  34           H        LYS  34  -6.914 -11.947  -3.363
  265    HA   LYS  34           HA       LYS  34  -9.307 -10.433  -3.825
  266    HB2  LYS  34           1HB      LYS  34  -9.146 -12.620  -2.651
  267    HB3  LYS  34           2HB      LYS  34  -8.393 -11.775  -1.278
  268    HG2  LYS  34           1HG      LYS  34 -10.409 -10.493  -0.888
  269    HG3  LYS  34           2HG      LYS  34 -11.162 -11.157  -2.358
  270    HD2  LYS  34           1HD      LYS  34 -11.036 -13.429  -1.358
  271    HD3  LYS  34           2HD      LYS  34 -10.374 -12.712   0.130
  272    HE2  LYS  34           1HE      LYS  34 -12.416 -11.377   0.403
  273    HE3  LYS  34           2HE      LYS  34 -13.078 -12.077  -1.093
  274    HZ1  LYS  34           3HZ      LYS  34 -12.405 -13.583   1.354
  275    HZ2  LYS  34           1HZ      LYS  34 -13.928 -13.184   0.861
  276    HZ3  LYS  34           2HZ      LYS  34 -13.020 -14.232  -0.032
  277    H    ARG  35           H        ARG  35  -9.991  -8.526  -3.236
  278    HA   ARG  35           HA       ARG  35  -8.186  -6.559  -2.248
  279    HB2  ARG  35           1HB      ARG  35 -10.107  -6.040  -3.586
  280    HB3  ARG  35           2HB      ARG  35 -11.172  -6.490  -2.234
  281    HG2  ARG  35           1HG      ARG  35 -10.306  -4.674  -0.884
  282    HG3  ARG  35           2HG      ARG  35  -9.109  -4.269  -2.138
  283    HD2  ARG  35           1HD      ARG  35 -12.090  -4.078  -2.433
  284    HD3  ARG  35           2HD      ARG  35 -10.987  -2.730  -2.072
  285    HE   ARG  35           HE       ARG  35 -10.080  -3.670  -4.572
  286   HH11  ARG  35          1HH1      ARG  35 -13.229  -2.739  -3.397
  287   HH12  ARG  35          2HH1      ARG  35 -13.672  -2.192  -5.002
  288   HH21  ARG  35          1HH2      ARG  35 -10.577  -3.057  -6.417
  289   HH22  ARG  35          2HH2      ARG  35 -12.161  -2.374  -6.725
  290    H    GLU  36           H        GLU  36 -10.668  -8.459  -0.552
  291    HA   GLU  36           HA       GLU  36 -10.494  -7.063   1.934
  292    HB2  GLU  36           1HB      GLU  36 -12.294  -8.611   1.329
  293    HB3  GLU  36           2HB      GLU  36 -11.140  -9.966   1.391
  294    HG2  GLU  36           1HG      GLU  36 -10.829  -9.535   3.876
  295    HG3  GLU  36           2HG      GLU  36 -11.941  -8.166   3.641
  296    H    VAL  37           H        VAL  37  -8.799 -10.004   0.830
  297    HA   VAL  37           HA       VAL  37  -7.321 -10.365   3.298
  298    HB   VAL  37           HB       VAL  37  -6.758 -11.303   0.454
  299   HG11  VAL  37          1HG1      VAL  37  -5.190 -12.894   1.513
  300   HG12  VAL  37          2HG1      VAL  37  -4.691 -11.212   1.808
  301   HG13  VAL  37          3HG1      VAL  37  -5.494 -12.141   3.096
  302   HG21  VAL  37          3HG2      VAL  37  -8.819 -12.194   1.362
  303   HG22  VAL  37          1HG2      VAL  37  -7.576 -13.462   1.255
  304   HG23  VAL  37          2HG2      VAL  37  -7.966 -12.728   2.829
  305    H    LEU  38           H        LEU  38  -6.459  -8.789   0.227
  306    HA   LEU  38           HA       LEU  38  -3.841  -7.990   1.006
  307    HB2  LEU  38           1HB      LEU  38  -4.586  -7.899  -1.151
  308    HB3  LEU  38           2HB      LEU  38  -5.866  -6.692  -0.893
  309    HG   LEU  38           HG       LEU  38  -4.041  -5.077  -0.183
  310   HD11  LEU  38          1HD1      LEU  38  -1.726  -5.602  -0.997
  311   HD12  LEU  38          2HD1      LEU  38  -2.265  -6.779   0.225
  312   HD13  LEU  38          3HD1      LEU  38  -2.286  -7.214  -1.500
  313   HD21  LEU  38          3HD2      LEU  38  -5.125  -4.919  -2.346
  314   HD22  LEU  38          1HD2      LEU  38  -3.397  -4.520  -2.502
  315   HD23  LEU  38          2HD2      LEU  38  -3.995  -6.112  -3.032
  316    H    LEU  39           H        LEU  39  -6.971  -6.372   1.491
  317    HA   LEU  39           HA       LEU  39  -5.911  -3.992   2.660
  318    HB2  LEU  39           1HB      LEU  39  -8.052  -4.162   1.856
  319    HB3  LEU  39           2HB      LEU  39  -8.619  -5.385   3.016
  320    HG   LEU  39           HG       LEU  39  -8.218  -3.735   4.857
  321   HD11  LEU  39          1HD1      LEU  39  -7.968  -1.322   4.217
  322   HD12  LEU  39          2HD1      LEU  39  -6.586  -2.288   3.652
  323   HD13  LEU  39          3HD1      LEU  39  -7.860  -1.803   2.508
  324   HD21  LEU  39          3HD2      LEU  39 -10.448  -4.082   3.971
  325   HD22  LEU  39          1HD2      LEU  39 -10.225  -2.369   4.399
  326   HD23  LEU  39          2HD2      LEU  39 -10.160  -2.878   2.693
  327    H    VAL  40           H        VAL  40  -6.850  -7.088   4.118
  328    HA   VAL  40           HA       VAL  40  -6.383  -6.318   6.860
  329    HB   VAL  40           HB       VAL  40  -6.192  -9.015   5.457
  330   HG11  VAL  40          1HG1      VAL  40  -6.243  -9.984   7.731
  331   HG12  VAL  40          2HG1      VAL  40  -4.793  -8.978   7.495
  332   HG13  VAL  40          3HG1      VAL  40  -6.172  -8.349   8.429
  333   HG21  VAL  40          3HG2      VAL  40  -8.419  -8.059   5.438
  334   HG22  VAL  40          1HG2      VAL  40  -8.337  -9.453   6.541
  335   HG23  VAL  40          2HG2      VAL  40  -8.342  -7.797   7.197
  336    H    THR  41           H        THR  41  -4.208  -7.713   4.418
  337    HA   THR  41           HA       THR  41  -1.928  -7.858   6.158
  338    HB   THR  41           HB       THR  41  -2.046  -7.475   3.136
  339    HG1  THR  41           1HG      THR  41  -1.700  -9.776   3.185
  340   HG21  THR  41          3HG2      THR  41   0.208  -8.426   4.948
  341   HG22  THR  41          1HG2      THR  41   0.251  -8.384   3.171
  342   HG23  THR  41          2HG2      THR  41   0.149  -6.867   4.095
  343    H    LEU  42           H        LEU  42  -3.144  -5.276   4.046
  344    HA   LEU  42           HA       LEU  42  -0.936  -3.489   4.507
  345    HB2  LEU  42           1HB      LEU  42  -3.765  -3.192   3.774
  346    HB3  LEU  42           2HB      LEU  42  -2.755  -1.726   3.809
  347    HG   LEU  42           HG       LEU  42  -2.229  -4.157   2.059
  348   HD11  LEU  42          1HD1      LEU  42  -3.014  -2.710   0.168
  349   HD12  LEU  42          2HD1      LEU  42  -4.308  -2.971   1.360
  350   HD13  LEU  42          3HD1      LEU  42  -3.418  -1.430   1.336
  351   HD21  LEU  42          3HD2      LEU  42  -0.227  -2.911   2.624
  352   HD22  LEU  42          1HD2      LEU  42  -0.631  -2.669   0.907
  353   HD23  LEU  42          2HD2      LEU  42  -0.989  -1.392   2.095
  354    H    THR  43           H        THR  43  -4.002  -4.009   6.201
  355    HA   THR  43           HA       THR  43  -3.651  -1.855   8.087
  356    HB   THR  43           HB       THR  43  -5.173  -4.481   8.362
  357    HG1  THR  43           1HG      THR  43  -6.962  -3.081   7.847
  358   HG21  THR  43          3HG2      THR  43  -5.338  -1.902   9.971
  359   HG22  THR  43          1HG2      THR  43  -6.401  -3.316  10.160
  360   HG23  THR  43          2HG2      THR  43  -4.669  -3.446  10.548
  361    H    ARG  44           H        ARG  44  -2.645  -5.253   8.087
  362    HA   ARG  44           HA       ARG  44  -1.626  -5.244  10.782
  363    HB2  ARG  44           1HB      ARG  44  -1.048  -6.972   8.428
  364    HB3  ARG  44           2HB      ARG  44  -0.260  -7.162  10.011
  365    HG2  ARG  44           1HG      ARG  44  -2.416  -7.566  11.069
  366    HG3  ARG  44           2HG      ARG  44  -3.251  -7.286   9.524
  367    HD2  ARG  44           1HD      ARG  44  -2.203  -9.240   8.589
  368    HD3  ARG  44           2HD      ARG  44  -1.323  -9.510  10.111
  369    HE   ARG  44           HE       ARG  44  -4.138  -9.648  10.729
  370   HH11  ARG  44          1HH1      ARG  44  -1.843 -11.414   8.786
  371   HH12  ARG  44          2HH1      ARG  44  -2.758 -12.888   9.034
  372   HH21  ARG  44          1HH2      ARG  44  -5.200 -11.327  11.016
  373   HH22  ARG  44          2HH2      ARG  44  -4.673 -12.839  10.305
  374    H    LEU  45           H        LEU  45  -0.165  -4.450   7.654
  375    HA   LEU  45           HA       LEU  45   2.486  -4.019   8.734
  376    HB2  LEU  45           1HB      LEU  45   1.010  -3.101   6.362
  377    HB3  LEU  45           2HB      LEU  45   2.728  -2.662   6.513
  378    HG   LEU  45           HG       LEU  45   1.594  -5.480   6.315
  379   HD11  LEU  45          1HD1      LEU  45   2.788  -5.524   4.110
  380   HD12  LEU  45          2HD1      LEU  45   1.559  -4.239   4.153
  381   HD13  LEU  45          3HD1      LEU  45   3.280  -3.833   4.359
  382   HD21  LEU  45          3HD2      LEU  45   3.551  -5.407   7.747
  383   HD22  LEU  45          1HD2      LEU  45   3.955  -6.203   6.209
  384   HD23  LEU  45          2HD2      LEU  45   4.464  -4.523   6.503
  385    H    HIS  46           H        HIS  46  -0.323  -1.929   8.213
  386    HA   HIS  46           HA       HIS  46   0.919   0.526   8.996
  387    HB2  HIS  46           1HB      HIS  46  -1.315   0.480   7.955
  388    HB3  HIS  46           2HB      HIS  46  -1.965  -0.399   9.358
  389    HD2  HIS  46           2HD      HIS  46  -2.867   1.274  11.471
  390    HE1  HIS  46           1HE      HIS  46  -1.285   4.842   9.794
  391    HE2  HIS  46           2HE      HIS  46  -2.756   3.764  11.686
  392    H    GLN  47           H        GLN  47  -0.706  -1.984  10.928
  393    HA   GLN  47           HA       GLN  47  -0.273  -0.640  13.449
  394    HB2  GLN  47           1HB      GLN  47  -0.743  -3.531  12.702
  395    HB3  GLN  47           2HB      GLN  47  -0.608  -2.954  14.380
  396    HG2  GLN  47           1HG      GLN  47  -2.805  -1.464  13.876
  397    HG3  GLN  47           2HG      GLN  47  -2.461  -2.202  12.293
  398   HE21  GLN  47          2HE2      GLN  47  -4.940  -2.384  13.659
  399   HE22  GLN  47          1HE2      GLN  47  -5.204  -4.045  14.076
  400    H    ARG  48           H        ARG  48   1.641  -2.896  11.529
  401    HA   ARG  48           HA       ARG  48   3.675  -3.300  13.556
  402    HB2  ARG  48           1HB      ARG  48   3.647  -3.724  10.609
  403    HB3  ARG  48           2HB      ARG  48   5.078  -3.993  11.632
  404    HG2  ARG  48           1HG      ARG  48   3.933  -5.702  12.889
  405    HG3  ARG  48           2HG      ARG  48   2.401  -5.352  12.052
  406    HD2  ARG  48           1HD      ARG  48   3.368  -6.127   9.972
  407    HD3  ARG  48           2HD      ARG  48   4.891  -6.490  10.820
  408    HE   ARG  48           HE       ARG  48   2.875  -8.096  12.080
  409   HH11  ARG  48          1HH1      ARG  48   4.213  -7.785   8.874
  410   HH12  ARG  48          2HH1      ARG  48   3.907  -9.485   8.575
  411   HH21  ARG  48          1HH2      ARG  48   2.511 -10.043  11.750
  412   HH22  ARG  48          2HH2      ARG  48   2.936 -10.773  10.214
  413    H    GLY  49           H        GLY  49   3.053  -0.814  11.184
  414    HA2  GLY  49           1HA      GLY  49   4.023   1.352  11.252
  415    HA3  GLY  49           2HA      GLY  49   5.341   0.720  12.269
  416    H    VAL  50           H        VAL  50   4.426  -1.120   9.482
  417    HA   VAL  50           HA       VAL  50   7.040  -0.566   8.187
  418    HB   VAL  50           HB       VAL  50   4.732  -2.398   7.406
  419   HG11  VAL  50          1HG1      VAL  50   6.357  -3.378   5.822
  420   HG12  VAL  50          2HG1      VAL  50   6.065  -1.661   5.460
  421   HG13  VAL  50          3HG1      VAL  50   7.557  -2.154   6.296
  422   HG21  VAL  50          3HG2      VAL  50   5.793  -3.099   9.469
  423   HG22  VAL  50          1HG2      VAL  50   6.199  -4.210   8.139
  424   HG23  VAL  50          2HG2      VAL  50   7.394  -3.015   8.696
  425    H    ILE  51           H        ILE  51   3.598  -0.256   7.286
  426    HA   ILE  51           HA       ILE  51   4.454   2.117   5.650
  427    HB   ILE  51           HB       ILE  51   2.536   1.654   4.146
  428   HG12  ILE  51          1HG1      ILE  51   2.271  -0.939   5.644
  429   HG13  ILE  51          2HG1      ILE  51   1.205   0.472   5.835
  430   HG21  ILE  51          1HG2      ILE  51   3.472  -0.312   2.979
  431   HG22  ILE  51          2HG2      ILE  51   4.763   0.778   3.531
  432   HG23  ILE  51          3HG2      ILE  51   4.422  -0.720   4.427
  433   HD11  ILE  51          3HD1      ILE  51   1.608  -1.119   3.279
  434   HD12  ILE  51          1HD1      ILE  51   0.192  -1.212   4.351
  435   HD13  ILE  51          2HD1      ILE  51   0.542   0.294   3.469
  436    H    TYR  52           H        TYR  52   2.895   3.770   5.374
  437    HA   TYR  52           HA       TYR  52   1.177   4.009   7.824
  438    HB2  TYR  52           1HB      TYR  52   2.593   6.075   6.135
  439    HB3  TYR  52           2HB      TYR  52   1.359   6.468   7.358
  440    HD1  TYR  52           1HD      TYR  52   2.561   3.924   9.028
  441    HD2  TYR  52           2HD      TYR  52   4.094   7.607   7.521
  442    HE1  TYR  52           1HE      TYR  52   4.301   3.912  10.791
  443    HE2  TYR  52           2HE      TYR  52   5.838   7.611   9.274
  444    HH   TYR  52           HH       TYR  52   6.722   6.518  11.066
  445    H    ARG  53           H        ARG  53  -0.916   4.087   7.624
  446    HA   ARG  53           HA       ARG  53  -2.187   4.399   4.998
  447    HB2  ARG  53           1HB      ARG  53  -3.143   2.908   6.570
  448    HB3  ARG  53           2HB      ARG  53  -3.358   4.231   7.739
  449    HG2  ARG  53           1HG      ARG  53  -4.923   5.338   6.198
  450    HG3  ARG  53           2HG      ARG  53  -4.713   4.007   5.034
  451    HD2  ARG  53           1HD      ARG  53  -5.788   3.676   7.814
  452    HD3  ARG  53           2HD      ARG  53  -6.788   3.933   6.365
  453    HE   ARG  53           HE       ARG  53  -6.039   1.598   5.628
  454   HH11  ARG  53          1HH1      ARG  53  -5.190   2.472   8.895
  455   HH12  ARG  53          2HH1      ARG  53  -5.043   0.778   9.316
  456   HH21  ARG  53          1HH2      ARG  53  -5.868  -0.346   6.093
  457   HH22  ARG  53          2HH2      ARG  53  -5.428  -0.831   7.719
  458    H    LYS  54           H        LYS  54  -2.956   6.128   4.057
  459    HA   LYS  54           HA       LYS  54  -3.321   8.629   5.612
  460    HB2  LYS  54           1HB      LYS  54  -0.932   8.542   4.931
  461    HB3  LYS  54           2HB      LYS  54  -1.464   8.442   3.236
  462    HG2  LYS  54           1HG      LYS  54  -2.504  10.644   3.401
  463    HG3  LYS  54           2HG      LYS  54  -2.069  10.743   5.123
  464    HD2  LYS  54           1HD      LYS  54   0.332  10.596   4.490
  465    HD3  LYS  54           2HD      LYS  54  -0.146  10.607   2.776
  466    HE2  LYS  54           1HE      LYS  54  -1.235  12.804   3.119
  467    HE3  LYS  54           2HE      LYS  54  -0.676  12.797   4.807
  468    HZ1  LYS  54           3HZ      LYS  54   1.063  12.764   2.425
  469    HZ2  LYS  54           1HZ      LYS  54   0.786  14.072   3.391
  470    HZ3  LYS  54           2HZ      LYS  54   1.583  12.757   3.991
  471    H    TRP  55           H        TRP  55  -4.789   9.984   4.818
  472    HA   TRP  55           HA       TRP  55  -6.275   8.994   2.419
  473    HB2  TRP  55           1HB      TRP  55  -7.081  10.719   4.793
  474    HB3  TRP  55           2HB      TRP  55  -8.092  10.535   3.340
  475    HD1  TRP  55           HD       TRP  55  -9.377   8.453   3.069
  476    HE1  TRP  55           1HE      TRP  55  -9.944   6.331   4.645
  477    HE3  TRP  55           3HE      TRP  55  -5.873   9.253   6.663
  478    HZ2  TRP  55           2HZ      TRP  55  -8.941   5.316   7.011
  479    HZ3  TRP  55           3HZ      TRP  55  -5.688   7.737   8.538
  480    HH2  TRP  55           HH       TRP  55  -7.162   5.784   8.765
  481    H    ARG  56           H        ARG  56  -6.885  10.294   0.754
  482    HA   ARG  56           HA       ARG  56  -5.902  13.092   0.709
  483    HB2  ARG  56           1HB      ARG  56  -4.013  11.821  -0.051
  484    HB3  ARG  56           2HB      ARG  56  -5.019  11.095  -1.325
  485    HG2  ARG  56           1HG      ARG  56  -5.290  13.206  -2.425
  486    HG3  ARG  56           2HG      ARG  56  -4.542  14.075  -1.062
  487    HD2  ARG  56           1HD      ARG  56  -3.008  13.987  -2.851
  488    HD3  ARG  56           2HD      ARG  56  -2.435  12.908  -1.558
  489    HE   ARG  56           HE       ARG  56  -2.925  10.986  -3.114
  490   HH11  ARG  56          1HH1      ARG  56  -3.564  14.096  -4.554
  491   HH12  ARG  56          2HH1      ARG  56  -3.515  13.375  -6.150
  492   HH21  ARG  56          1HH2      ARG  56  -2.872  10.142  -4.935
  493   HH22  ARG  56          2HH2      ARG  56  -3.121  11.119  -6.369
  494    H    HIS  57           H        HIS  57  -7.266  14.406  -0.206
  495    HA   HIS  57           HA       HIS  57  -9.534  13.231  -1.738
  496    HB2  HIS  57           1HB      HIS  57  -9.982  14.822   0.180
  497    HB3  HIS  57           2HB      HIS  57  -9.174  16.095  -0.763
  498    HD1  HIS  57           1HD      HIS  57 -10.332  16.665  -3.130
  499    HD2  HIS  57           2HD      HIS  57 -12.729  14.481  -0.437
  500    HE1  HIS  57           1HE      HIS  57 -12.640  16.985  -3.869
  501    H    PHE  58           H        PHE  58  -9.557  13.178  -3.827
  502    HA   PHE  58           HA       PHE  58  -8.760  15.522  -5.385
  503    HB2  PHE  58           1HB      PHE  58  -7.089  14.349  -6.775
  504    HB3  PHE  58           2HB      PHE  58  -6.551  14.415  -5.082
  505    HD1  PHE  58           2HD      PHE  58  -6.568  12.413  -3.695
  506    HD2  PHE  58           1HD      PHE  58  -7.572  12.296  -7.846
  507    HE1  PHE  58           2HE      PHE  58  -6.233   9.964  -3.706
  508    HE2  PHE  58           1HE      PHE  58  -7.241   9.846  -7.859
  509    HZ   PHE  58           HZ       PHE  58  -6.571   8.680  -5.789
  510    H    SER  59           H        SER  59  -9.296  15.372  -7.616
  511    HA   SER  59           HA       SER  59 -10.815  14.770  -9.358
  512    HB2  SER  59           1HB      SER  59 -10.638  12.098  -8.105
  513    HB3  SER  59           2HB      SER  59 -11.359  12.521  -9.675
  514    HG   SER  59           HG       SER  59  -9.194  11.795  -9.859
  515    H    GLY  60           H        GLY  60 -11.653  15.545  -6.431
  516    HA2  GLY  60           1HA      GLY  60 -13.771  16.348  -5.806
  517    HA3  GLY  60           2HA      GLY  60 -14.510  15.379  -7.101
  518    H    ARG  61           H        ARG  61 -12.325  13.520  -5.337
  519    HA   ARG  61           HA       ARG  61 -14.420  12.516  -3.466
  520    HB2  ARG  61           1HB      ARG  61 -13.070  10.824  -5.520
  521    HB3  ARG  61           2HB      ARG  61 -13.999  10.229  -4.125
  522    HG2  ARG  61           1HG      ARG  61 -15.147  12.034  -6.270
  523    HG3  ARG  61           2HG      ARG  61 -15.247  10.257  -6.316
  524    HD2  ARG  61           1HD      ARG  61 -16.440  10.324  -4.172
  525    HD3  ARG  61           2HD      ARG  61 -16.429  12.101  -4.266
  526    HE   ARG  61           HE       ARG  61 -18.230  10.355  -5.886
  527   HH11  ARG  61          1HH1      ARG  61 -16.948  13.559  -5.383
  528   HH12  ARG  61          2HH1      ARG  61 -18.261  14.238  -6.326
  529   HH21  ARG  61          1HH2      ARG  61 -19.742  11.118  -6.961
  530   HH22  ARG  61          2HH2      ARG  61 -19.855  12.846  -7.226
  531    H    LYS  62           H        LYS  62 -13.697  11.367  -1.715
  532    HA   LYS  62           HA       LYS  62 -10.825  11.799  -1.084
  533    HB2  LYS  62           1HB      LYS  62 -12.632  12.456   0.497
  534    HB3  LYS  62           2HB      LYS  62 -13.065  10.736   0.641
  535    HG2  LYS  62           1HG      LYS  62 -10.857  10.235   1.569
  536    HG3  LYS  62           2HG      LYS  62 -10.374  11.937   1.377
  537    HD2  LYS  62           1HD      LYS  62 -12.202  12.601   2.921
  538    HD3  LYS  62           2HD      LYS  62 -12.600  10.882   3.154
  539    HE2  LYS  62           1HE      LYS  62 -10.362  10.471   4.059
  540    HE3  LYS  62           2HE      LYS  62  -9.931  12.175   3.795
  541    HZ1  LYS  62           3HZ      LYS  62 -12.046  11.205   5.606
  542    HZ2  LYS  62           1HZ      LYS  62 -10.566  11.763   6.073
  543    HZ3  LYS  62           2HZ      LYS  62 -11.647  12.788   5.361
  544    H    TYR  63           H        TYR  63  -9.341  10.328  -1.241
  545    HA   TYR  63           HA       TYR  63 -10.227   7.469  -1.489
  546    HB2  TYR  63           1HB      TYR  63  -7.984   8.959  -2.862
  547    HB3  TYR  63           2HB      TYR  63  -8.183   7.190  -2.888
  548    HD1  TYR  63           2HD      TYR  63 -10.042   6.170  -4.135
  549    HD2  TYR  63           1HD      TYR  63  -9.430  10.388  -4.183
  550    HE1  TYR  63           2HE      TYR  63 -11.561   6.357  -6.077
  551    HE2  TYR  63           1HE      TYR  63 -10.948  10.595  -6.130
  552    HH   TYR  63           HH       TYR  63 -12.543   7.755  -7.583
  553    H    ARG  64           H        ARG  64  -8.928   5.852  -0.661
  554    HA   ARG  64           HA       ARG  64  -7.103   6.759   1.520
  555    HB2  ARG  64           1HB      ARG  64  -8.839   5.286   2.189
  556    HB3  ARG  64           2HB      ARG  64  -8.316   4.084   0.986
  557    HG2  ARG  64           1HG      ARG  64  -6.177   3.829   2.156
  558    HG3  ARG  64           2HG      ARG  64  -6.677   5.053   3.349
  559    HD2  ARG  64           1HD      ARG  64  -7.989   2.393   2.883
  560    HD3  ARG  64           2HD      ARG  64  -6.861   2.798   4.199
  561    HE   ARG  64           HE       ARG  64  -9.089   4.562   4.525
  562   HH11  ARG  64          1HH1      ARG  64  -8.639   1.105   4.448
  563   HH12  ARG  64          2HH1      ARG  64  -9.985   0.900   5.552
  564   HH21  ARG  64          1HH2      ARG  64 -10.636   4.343   5.783
  565   HH22  ARG  64          2HH2      ARG  64 -11.125   2.746   6.314
  566    H    GLU  65           H        GLU  65  -5.007   6.599   1.451
  567    HA   GLU  65           HA       GLU  65  -3.798   4.883  -0.697
  568    HB2  GLU  65           1HB      GLU  65  -2.893   7.576   0.334
  569    HB3  GLU  65           2HB      GLU  65  -1.961   6.530  -0.763
  570    HG2  GLU  65           1HG      GLU  65  -3.859   6.767  -2.475
  571    HG3  GLU  65           2HG      GLU  65  -4.611   7.820  -1.254
  572    H    TYR  66           H        TYR  66  -1.853   3.874  -0.276
  573    HA   TYR  66           HA       TYR  66  -0.984   3.924   2.598
  574    HB2  TYR  66           1HB      TYR  66  -1.018   1.635   0.624
  575    HB3  TYR  66           2HB      TYR  66  -0.180   1.604   2.195
  576    HD1  TYR  66           1HD      TYR  66  -3.468   1.586   0.524
  577    HD2  TYR  66           2HD      TYR  66  -1.435   1.420   4.267
  578    HE1  TYR  66           1HE      TYR  66  -5.564   0.848   1.621
  579    HE2  TYR  66           2HE      TYR  66  -3.516   0.685   5.379
  580    HH   TYR  66           HH       TYR  66  -6.566   0.248   3.569
  581    H    CYS  67           H        CYS  67   0.909   4.752   2.928
  582    HA   CYS  67           HA       CYS  67   2.859   4.914   0.606
  583    HB2  CYS  67           1HB      CYS  67   3.334   7.118   1.540
  584    HB3  CYS  67           2HB      CYS  67   1.574   6.968   1.318
  585    HG   CYS  67           HG       CYS  67   2.097   8.382   3.360
  586    H    LEU  68           H        LEU  68   5.107   5.186   1.302
  587    HA   LEU  68           HA       LEU  68   5.946   3.164   3.155
  588    HB2  LEU  68           1HB      LEU  68   7.232   5.522   1.954
  589    HB3  LEU  68           2HB      LEU  68   8.233   4.379   2.879
  590    HG   LEU  68           HG       LEU  68   6.678   3.765   0.335
  591   HD11  LEU  68          1HD1      LEU  68   8.955   3.475  -0.680
  592   HD12  LEU  68          2HD1      LEU  68   8.728   5.128  -0.062
  593   HD13  LEU  68          3HD1      LEU  68   9.689   3.955   0.869
  594   HD21  LEU  68          3HD2      LEU  68   6.737   1.856   1.828
  595   HD22  LEU  68          1HD2      LEU  68   7.797   1.563   0.428
  596   HD23  LEU  68          2HD2      LEU  68   8.501   2.008   2.001
  597    H    LYS  69           H        LYS  69   6.946   3.264   5.143
  598    HA   LYS  69           HA       LYS  69   5.897   5.194   7.011
  599    HB2  LYS  69           1HB      LYS  69   7.271   4.148   8.623
  600    HB3  LYS  69           2HB      LYS  69   6.614   2.882   7.560
  601    HG2  LYS  69           1HG      LYS  69   8.767   2.798   6.348
  602    HG3  LYS  69           2HG      LYS  69   9.420   4.039   7.444
  603    HD2  LYS  69           1HD      LYS  69   9.028   2.523   9.363
  604    HD3  LYS  69           2HD      LYS  69   8.438   1.277   8.239
  605    HE2  LYS  69           1HE      LYS  69  10.613   1.226   7.123
  606    HE3  LYS  69           2HE      LYS  69  11.209   2.511   8.200
  607    HZ1  LYS  69           3HZ      LYS  69  10.350  -0.180   9.052
  608    HZ2  LYS  69           1HZ      LYS  69  11.913   0.335   8.935
  609    HZ3  LYS  69           2HZ      LYS  69  10.903   1.011  10.052
  610    H    HIS  70           H        HIS  70   8.540   5.293   4.827
  611    HA   HIS  70           HA       HIS  70  10.198   7.171   6.259
  612    HB2  HIS  70           1HB      HIS  70   9.902   6.634   3.268
  613    HB3  HIS  70           2HB      HIS  70  11.175   7.637   4.005
  614    HD2  HIS  70           2HD      HIS  70  10.613   3.917   3.035
  615    HE1  HIS  70           1HE      HIS  70  13.876   4.128   5.749
  616    HE2  HIS  70           2HE      HIS  70  12.527   2.656   4.038
  617    H    ARG  71           H        ARG  71  10.573   9.391   5.746
  618    HA   ARG  71           HA       ARG  71   8.431  11.107   6.054
  619    HB2  ARG  71           1HB      ARG  71  10.751  11.764   6.175
  620    HB3  ARG  71           2HB      ARG  71  10.842  11.706   4.399
  621    HG2  ARG  71           1HG      ARG  71   9.133  13.467   4.254
  622    HG3  ARG  71           2HG      ARG  71   9.045  13.527   6.032
  623    HD2  ARG  71           1HD      ARG  71  11.327  14.278   6.133
  624    HD3  ARG  71           2HD      ARG  71  11.453  14.177   4.361
  625    HE   ARG  71           HE       ARG  71  10.211  16.316   4.263
  626   HH11  ARG  71          1HH1      ARG  71  10.173  15.056   7.514
  627   HH12  ARG  71          2HH1      ARG  71   9.590  16.598   8.111
  628   HH21  ARG  71          1HH2      ARG  71   9.537  18.085   4.930
  629   HH22  ARG  71          2HH2      ARG  71   9.225  18.325   6.638
  630    H    ASP  72           H        ASP  72   6.777  11.856   4.977
  631    HA   ASP  72           HA       ASP  72   5.880  10.566   2.612
  632    HB2  ASP  72           1HB      ASP  72   5.024  13.269   3.813
  633    HB3  ASP  72           2HB      ASP  72   4.378  12.412   2.393
  634    H    GLU  73           H        GLU  73   7.572  13.664   3.011
  635    HA   GLU  73           HA       GLU  73   7.483  14.378   0.218
  636    HB2  GLU  73           1HB      GLU  73   9.335  15.128   2.480
  637    HB3  GLU  73           2HB      GLU  73   9.459  15.805   0.838
  638    HG2  GLU  73           1HG      GLU  73   7.169  16.818   1.090
  639    HG3  GLU  73           2HG      GLU  73   7.077  15.949   2.638
  640    H    LEU  74           H        LEU  74   9.833  12.568   2.169
  641    HA   LEU  74           HA       LEU  74  11.721  12.167   0.036
  642    HB2  LEU  74           1HB      LEU  74  12.256  11.898   2.249
  643    HB3  LEU  74           2HB      LEU  74  11.142  10.550   2.575
  644    HG   LEU  74           HG       LEU  74  12.419   9.186   0.892
  645   HD11  LEU  74          1HD1      LEU  74  14.720   9.980   0.287
  646   HD12  LEU  74          2HD1      LEU  74  13.472  11.087  -0.332
  647   HD13  LEU  74          3HD1      LEU  74  14.396  11.513   1.128
  648   HD21  LEU  74          3HD2      LEU  74  12.783   8.898   3.272
  649   HD22  LEU  74          1HD2      LEU  74  14.320   8.705   2.396
  650   HD23  LEU  74          2HD2      LEU  74  13.982  10.213   3.278
  651    H    ALA  75           H        ALA  75   8.890  10.315   1.106
  652    HA   ALA  75           HA       ALA  75   9.277   8.147  -0.728
  653    HB1  ALA  75           1HB      ALA  75   6.905   7.641  -0.289
  654    HB2  ALA  75           2HB      ALA  75   7.791   7.980   1.217
  655    HB3  ALA  75           3HB      ALA  75   6.720   9.216   0.516
  656    H    ASP  76           H        ASP  76   7.623  11.265  -1.006
  657    HA   ASP  76           HA       ASP  76   6.503  10.774  -3.622
  658    HB2  ASP  76           1HB      ASP  76   7.205  13.406  -2.187
  659    HB3  ASP  76           2HB      ASP  76   6.505  13.162  -3.807
  660    H    LEU  77           H        LEU  77   9.613  12.054  -2.516
  661    HA   LEU  77           HA       LEU  77  10.573  12.744  -5.148
  662    HB2  LEU  77           1HB      LEU  77  11.818  12.011  -2.588
  663    HB3  LEU  77           2HB      LEU  77  12.876  12.516  -3.925
  664    HG   LEU  77           HG       LEU  77  10.708  14.219  -2.637
  665   HD11  LEU  77          1HD1      LEU  77  12.629  15.560  -1.738
  666   HD12  LEU  77          2HD1      LEU  77  12.676  13.885  -1.141
  667   HD13  LEU  77          3HD1      LEU  77  13.761  14.393  -2.457
  668   HD21  LEU  77          3HD2      LEU  77  11.017  14.732  -4.986
  669   HD22  LEU  77          1HD2      LEU  77  11.664  16.055  -3.986
  670   HD23  LEU  77          2HD2      LEU  77  12.773  14.892  -4.751
  671    H    GLU  78           H        GLU  78  10.647   9.772  -3.241
  672    HA   GLU  78           HA       GLU  78  12.293   8.413  -5.288
  673    HB2  GLU  78           1HB      GLU  78  10.950   7.449  -2.760
  674    HB3  GLU  78           2HB      GLU  78  11.954   6.442  -3.831
  675    HG2  GLU  78           1HG      GLU  78  13.933   7.971  -3.320
  676    HG3  GLU  78           2HG      GLU  78  12.785   8.877  -2.307
  677    H    HIS  79           H        HIS  79   8.973   8.979  -4.639
  678    HA   HIS  79           HA       HIS  79   7.737   6.620  -5.535
  679    HB2  HIS  79           1HB      HIS  79   6.509   8.597  -4.617
  680    HB3  HIS  79           2HB      HIS  79   6.834   9.474  -6.131
  681    HD2  HIS  79           2HD      HIS  79   4.854   9.088  -8.107
  682    HE1  HIS  79           1HE      HIS  79   3.055   5.742  -6.201
  683    HE2  HIS  79           2HE      HIS  79   2.949   7.468  -8.181
  Start of MODEL   18
    1    H    LYS   3           H        LYS   3   4.177 -13.168  -9.462
    2    HA   LYS   3           HA       LYS   3   4.090 -10.815  -7.885
    3    HB2  LYS   3           1HB      LYS   3   1.468 -11.512  -9.215
    4    HB3  LYS   3           2HB      LYS   3   1.700 -10.341  -7.894
    5    HG2  LYS   3           1HG      LYS   3   2.920 -10.110 -10.668
    6    HG3  LYS   3           2HG      LYS   3   1.443  -9.270 -10.133
    7    HD2  LYS   3           1HD      LYS   3   2.686  -8.077  -8.421
    8    HD3  LYS   3           2HD      LYS   3   4.162  -8.992  -8.810
    9    HE2  LYS   3           1HE      LYS   3   2.712  -7.258 -10.822
   10    HE3  LYS   3           2HE      LYS   3   4.004  -6.640  -9.768
   11    HZ1  LYS   3           3HZ      LYS   3   4.279  -8.852 -11.700
   12    HZ2  LYS   3           1HZ      LYS   3   4.853  -7.321 -11.908
   13    HZ3  LYS   3           2HZ      LYS   3   5.478  -8.280 -10.721
   14    H    ALA   4           H        ALA   4   2.438 -13.855  -8.682
   15    HA   ALA   4           HA       ALA   4   1.250 -14.183  -6.102
   16    HB1  ALA   4           1HB      ALA   4   0.889 -16.519  -6.803
   17    HB2  ALA   4           2HB      ALA   4   0.446 -15.375  -8.092
   18    HB3  ALA   4           3HB      ALA   4   1.980 -16.272  -8.184
   19    H    LYS   5           H        LYS   5   4.454 -14.789  -7.291
   20    HA   LYS   5           HA       LYS   5   5.279 -16.682  -5.282
   21    HB2  LYS   5           1HB      LYS   5   6.794 -14.654  -6.929
   22    HB3  LYS   5           2HB      LYS   5   7.568 -15.823  -5.832
   23    HG2  LYS   5           1HG      LYS   5   6.638 -17.682  -7.148
   24    HG3  LYS   5           2HG      LYS   5   5.856 -16.518  -8.242
   25    HD2  LYS   5           1HD      LYS   5   8.063 -15.620  -8.866
   26    HD3  LYS   5           2HD      LYS   5   8.844 -16.786  -7.774
   27    HE2  LYS   5           1HE      LYS   5   7.932 -18.645  -9.083
   28    HE3  LYS   5           2HE      LYS   5   7.116 -17.493 -10.165
   29    HZ1  LYS   5           3HZ      LYS   5  10.034 -17.730  -9.799
   30    HZ2  LYS   5           1HZ      LYS   5   9.183 -18.282 -11.101
   31    HZ3  LYS   5           2HZ      LYS   5   9.278 -16.661 -10.803
   32    H    LEU   6           H        LEU   6   4.885 -13.210  -5.275
   33    HA   LEU   6           HA       LEU   6   6.273 -13.009  -2.653
   34    HB2  LEU   6           1HB      LEU   6   4.941 -11.055  -4.414
   35    HB3  LEU   6           2HB      LEU   6   5.836 -10.521  -2.972
   36    HG   LEU   6           HG       LEU   6   6.994 -11.846  -5.456
   37   HD11  LEU   6          1HD1      LEU   6   8.186  -9.654  -5.731
   38   HD12  LEU   6          2HD1      LEU   6   6.420  -9.438  -5.752
   39   HD13  LEU   6          3HD1      LEU   6   7.347  -9.035  -4.288
   40   HD21  LEU   6          3HD2      LEU   6   8.149 -12.601  -3.461
   41   HD22  LEU   6          1HD2      LEU   6   9.196 -11.499  -4.388
   42   HD23  LEU   6          2HD2      LEU   6   8.373 -10.921  -2.919
   43    H    SER   7           H        SER   7   5.310 -12.016  -0.838
   44    HA   SER   7           HA       SER   7   2.640 -13.068  -0.231
   45    HB2  SER   7           1HB      SER   7   2.944 -12.385   1.864
   46    HB3  SER   7           2HB      SER   7   4.541 -12.927   1.300
   47    HG   SER   7           HG       SER   7   4.682 -10.970   2.437
   48    H    LEU   8           H        LEU   8   1.007 -11.618   0.797
   49    HA   LEU   8           HA       LEU   8   0.193  -9.458  -0.924
   50    HB2  LEU   8           1HB      LEU   8  -0.483 -10.276   1.821
   51    HB3  LEU   8           2HB      LEU   8  -1.438  -8.993   1.042
   52    HG   LEU   8           HG       LEU   8  -1.215 -11.891   0.141
   53   HD11  LEU   8          1HD1      LEU   8  -3.652 -11.982   0.726
   54   HD12  LEU   8          2HD1      LEU   8  -2.662 -11.568   2.145
   55   HD13  LEU   8          3HD1      LEU   8  -3.564 -10.296   1.287
   56   HD21  LEU   8          3HD2      LEU   8  -1.385 -10.395  -1.758
   57   HD22  LEU   8          1HD2      LEU   8  -2.908 -11.292  -1.554
   58   HD23  LEU   8          2HD2      LEU   8  -2.799  -9.592  -1.037
   59    H    THR   9           H        THR   9   2.162  -9.599   1.968
   60    HA   THR   9           HA       THR   9   2.050  -6.690   2.386
   61    HB   THR   9           HB       THR   9   3.763  -7.115   4.125
   62    HG1  THR   9           1HG      THR   9   4.459  -9.262   4.466
   63   HG21  THR   9          3HG2      THR   9   1.465  -9.111   4.184
   64   HG22  THR   9          1HG2      THR   9   2.394  -8.552   5.596
   65   HG23  THR   9          2HG2      THR   9   1.374  -7.407   4.691
   66    H    GLN  10           H        GLN  10   4.303  -9.032   0.981
   67    HA   GLN  10           HA       GLN  10   6.421  -7.129   0.520
   68    HB2  GLN  10           1HB      GLN  10   5.663  -9.752  -0.770
   69    HB3  GLN  10           2HB      GLN  10   7.093  -8.810  -1.252
   70    HG2  GLN  10           1HG      GLN  10   8.061  -9.208   1.195
   71    HG3  GLN  10           2HG      GLN  10   6.390  -9.789   1.376
   72   HE21  GLN  10          2HE2      GLN  10   9.068 -11.084   1.822
   73   HE22  GLN  10          1HE2      GLN  10   9.018 -12.543   0.889
   74    H    LEU  11           H        LEU  11   3.682  -8.220  -1.459
   75    HA   LEU  11           HA       LEU  11   4.472  -6.766  -3.816
   76    HB2  LEU  11           1HB      LEU  11   1.948  -7.794  -2.726
   77    HB3  LEU  11           2HB      LEU  11   1.910  -7.042  -4.336
   78    HG   LEU  11           HG       LEU  11   3.573  -9.473  -3.577
   79   HD11  LEU  11          1HD1      LEU  11   1.939 -10.757  -4.981
   80   HD12  LEU  11          2HD1      LEU  11   1.134  -9.989  -3.592
   81   HD13  LEU  11          3HD1      LEU  11   0.992  -9.270  -5.214
   82   HD21  LEU  11          3HD2      LEU  11   4.566  -8.152  -5.350
   83   HD22  LEU  11          1HD2      LEU  11   3.940  -9.681  -6.011
   84   HD23  LEU  11          2HD2      LEU  11   3.035  -8.167  -6.258
   85    H    ILE  12           H        ILE  12   2.310  -5.951  -1.113
   86    HA   ILE  12           HA       ILE  12   1.534  -3.370  -2.150
   87    HB   ILE  12           HB       ILE  12   1.666  -4.500   0.679
   88   HG12  ILE  12          1HG1      ILE  12  -0.706  -3.840  -1.041
   89   HG13  ILE  12          2HG1      ILE  12   0.051  -5.447  -0.953
   90   HG21  ILE  12          1HG2      ILE  12   0.349  -2.523   1.362
   91   HG22  ILE  12          2HG2      ILE  12   1.948  -2.045   0.745
   92   HG23  ILE  12          3HG2      ILE  12   0.504  -1.851  -0.278
   93   HD11  ILE  12          3HD1      ILE  12  -1.200  -3.940   1.370
   94   HD12  ILE  12          1HD1      ILE  12  -1.926  -5.316   0.508
   95   HD13  ILE  12          2HD1      ILE  12  -0.440  -5.546   1.459
   96    H    LEU  13           H        LEU  13   4.187  -4.340   0.003
   97    HA   LEU  13           HA       LEU  13   4.957  -1.607   0.545
   98    HB2  LEU  13           1HB      LEU  13   6.268  -4.232   0.734
   99    HB3  LEU  13           2HB      LEU  13   7.133  -2.808   1.357
  100    HG   LEU  13           HG       LEU  13   4.490  -3.922   2.373
  101   HD11  LEU  13          1HD1      LEU  13   5.794  -4.362   4.470
  102   HD12  LEU  13          2HD1      LEU  13   6.488  -5.234   3.083
  103   HD13  LEU  13          3HD1      LEU  13   7.258  -3.741   3.672
  104   HD21  LEU  13          3HD2      LEU  13   4.504  -1.500   2.478
  105   HD22  LEU  13          1HD2      LEU  13   4.641  -2.179   4.117
  106   HD23  LEU  13          2HD2      LEU  13   6.080  -1.515   3.305
  107    H    ILE  14           H        ILE  14   5.982  -4.007  -1.837
  108    HA   ILE  14           HA       ILE  14   8.146  -2.421  -2.933
  109    HB   ILE  14           HB       ILE  14   6.403  -4.632  -4.103
  110   HG12  ILE  14          1HG1      ILE  14   9.308  -4.657  -3.344
  111   HG13  ILE  14          2HG1      ILE  14   7.988  -5.142  -2.255
  112   HG21  ILE  14          1HG2      ILE  14   8.018  -4.699  -5.973
  113   HG22  ILE  14          2HG2      ILE  14   7.181  -3.131  -5.909
  114   HG23  ILE  14          3HG2      ILE  14   8.849  -3.274  -5.308
  115   HD11  ILE  14          3HD1      ILE  14   8.649  -6.423  -4.930
  116   HD12  ILE  14          1HD1      ILE  14   9.022  -7.103  -3.329
  117   HD13  ILE  14          2HD1      ILE  14   7.329  -6.909  -3.842
  118    H    ARG  15           H        ARG  15   4.700  -2.642  -3.732
  119    HA   ARG  15           HA       ARG  15   4.834  -0.767  -5.915
  120    HB2  ARG  15           1HB      ARG  15   3.005  -2.269  -5.669
  121    HB3  ARG  15           2HB      ARG  15   2.537  -1.478  -4.146
  122    HG2  ARG  15           1HG      ARG  15   1.081  -0.687  -5.893
  123    HG3  ARG  15           2HG      ARG  15   2.173   0.636  -5.418
  124    HD2  ARG  15           1HD      ARG  15   3.567   0.117  -7.367
  125    HD3  ARG  15           2HD      ARG  15   2.365  -1.099  -7.858
  126    HE   ARG  15           HE       ARG  15   1.054   1.496  -7.703
  127   HH11  ARG  15          1HH1      ARG  15   3.404  -0.180  -9.658
  128   HH12  ARG  15          2HH1      ARG  15   2.924   0.763 -11.055
  129   HH21  ARG  15          1HH2      ARG  15   0.497   2.589  -9.291
  130   HH22  ARG  15          2HH2      ARG  15   1.266   2.343 -10.847
  131    H    LEU  16           H        LEU  16   4.380  -0.373  -2.428
  132    HA   LEU  16           HA       LEU  16   3.880   2.502  -2.682
  133    HB2  LEU  16           1HB      LEU  16   4.511   0.671  -0.465
  134    HB3  LEU  16           2HB      LEU  16   4.138   2.373  -0.106
  135    HG   LEU  16           HG       LEU  16   2.272   0.293  -1.308
  136   HD11  LEU  16          1HD1      LEU  16   0.936   0.709   0.773
  137   HD12  LEU  16          2HD1      LEU  16   2.572   0.130   1.161
  138   HD13  LEU  16          3HD1      LEU  16   2.178   1.858   1.322
  139   HD21  LEU  16          3HD2      LEU  16   1.914   2.443  -2.368
  140   HD22  LEU  16          1HD2      LEU  16   0.552   2.065  -1.287
  141   HD23  LEU  16          2HD2      LEU  16   1.793   3.239  -0.781
  142    H    SER  17           H        SER  17   6.657   0.462  -2.443
  143    HA   SER  17           HA       SER  17   8.579   2.545  -1.656
  144    HB2  SER  17           1HB      SER  17   8.885  -0.120  -2.891
  145    HB3  SER  17           2HB      SER  17  10.211   1.000  -2.502
  146    HG   SER  17           HG       SER  17   8.294  -0.021  -0.675
  147    H    ASN  18           H        ASN  18   7.152   1.310  -4.667
  148    HA   ASN  18           HA       ASN  18   9.054   2.780  -6.363
  149    HB2  ASN  18           1HB      ASN  18   6.538   1.184  -7.266
  150    HB3  ASN  18           2HB      ASN  18   7.754   2.215  -8.059
  151   HD21  ASN  18          2HD2      ASN  18   7.061  -0.681  -8.273
  152   HD22  ASN  18          1HD2      ASN  18   8.562  -1.515  -8.047
  153    H    ARG  19           H        ARG  19   5.818   3.256  -5.081
  154    HA   ARG  19           HA       ARG  19   5.545   5.690  -6.816
  155    HB2  ARG  19           1HB      ARG  19   3.375   4.070  -5.560
  156    HB3  ARG  19           2HB      ARG  19   3.194   5.526  -6.567
  157    HG2  ARG  19           1HG      ARG  19   4.492   2.969  -7.543
  158    HG3  ARG  19           2HG      ARG  19   2.757   3.320  -7.732
  159    HD2  ARG  19           1HD      ARG  19   4.974   5.036  -8.797
  160    HD3  ARG  19           2HD      ARG  19   4.130   3.771  -9.722
  161    HE   ARG  19           HE       ARG  19   2.066   5.551  -8.962
  162   HH11  ARG  19          1HH1      ARG  19   5.122   5.987 -10.584
  163   HH12  ARG  19          2HH1      ARG  19   4.454   7.330 -11.492
  164   HH21  ARG  19          1HH2      ARG  19   1.290   7.092  -9.988
  165   HH22  ARG  19          2HH2      ARG  19   2.270   7.961 -11.153
  166    H    GLY  20           H        GLY  20   5.633   4.478  -3.559
  167    HA2  GLY  20           1HA      GLY  20   6.130   5.876  -1.691
  168    HA3  GLY  20           2HA      GLY  20   5.503   7.280  -2.587
  169    H    CYS  21           H        CYS  21   3.039   6.373  -3.419
  170    HA   CYS  21           HA       CYS  21   1.493   5.426  -1.039
  171    HB2  CYS  21           1HB      CYS  21   2.050   7.807  -0.627
  172    HB3  CYS  21           2HB      CYS  21   1.364   8.239  -2.211
  173    HG   CYS  21           HG       CYS  21  -0.136   9.065  -0.337
  174    H    GLN  22           H        GLN  22  -0.161   4.258  -1.777
  175    HA   GLN  22           HA       GLN  22  -1.347   4.938  -4.435
  176    HB2  GLN  22           1HB      GLN  22  -0.437   2.227  -3.450
  177    HB3  GLN  22           2HB      GLN  22  -1.535   2.469  -4.829
  178    HG2  GLN  22           1HG      GLN  22   1.438   3.503  -4.870
  179    HG3  GLN  22           2HG      GLN  22   0.636   1.990  -5.353
  180   HE21  GLN  22          2HE2      GLN  22   0.222   5.544  -5.710
  181   HE22  GLN  22          1HE2      GLN  22  -0.206   5.494  -7.388
  182    H    THR  23           H        THR  23  -3.457   4.101  -4.810
  183    HA   THR  23           HA       THR  23  -5.101   4.030  -2.372
  184    HB   THR  23           HB       THR  23  -6.999   3.901  -3.879
  185    HG1  THR  23           1HG      THR  23  -6.410   3.848  -6.239
  186   HG21  THR  23          3HG2      THR  23  -4.872   5.755  -5.021
  187   HG22  THR  23          1HG2      THR  23  -6.628   5.911  -5.265
  188   HG23  THR  23          2HG2      THR  23  -5.933   6.117  -3.640
  189    H    LEU  24           H        LEU  24  -6.789   2.371  -2.101
  190    HA   LEU  24           HA       LEU  24  -5.705  -0.259  -1.876
  191    HB2  LEU  24           1HB      LEU  24  -7.461   0.546  -0.612
  192    HB3  LEU  24           2HB      LEU  24  -8.620   0.698  -1.954
  193    HG   LEU  24           HG       LEU  24  -8.411  -1.794  -2.296
  194   HD11  LEU  24          1HD1      LEU  24  -7.518  -3.127  -0.368
  195   HD12  LEU  24          2HD1      LEU  24  -6.253  -2.102  -1.087
  196   HD13  LEU  24          3HD1      LEU  24  -7.037  -1.614   0.435
  197   HD21  LEU  24          3HD2      LEU  24 -10.331  -0.829  -1.172
  198   HD22  LEU  24          1HD2      LEU  24  -9.899  -2.381  -0.413
  199   HD23  LEU  24          2HD2      LEU  24  -9.464  -0.848   0.384
  200    H    GLU  25           H        GLU  25  -7.555   1.281  -4.462
  201    HA   GLU  25           HA       GLU  25  -7.915  -1.197  -5.954
  202    HB2  GLU  25           1HB      GLU  25  -8.149   1.718  -6.706
  203    HB3  GLU  25           2HB      GLU  25  -8.518   0.366  -7.805
  204    HG2  GLU  25           1HG      GLU  25 -10.367  -0.367  -6.237
  205    HG3  GLU  25           2HG      GLU  25  -9.823   0.955  -5.181
  206    H    GLU  26           H        GLU  26  -5.581   1.466  -6.029
  207    HA   GLU  26           HA       GLU  26  -4.146   0.458  -8.339
  208    HB2  GLU  26           1HB      GLU  26  -3.430   2.330  -6.085
  209    HB3  GLU  26           2HB      GLU  26  -2.299   1.904  -7.394
  210    HG2  GLU  26           1HG      GLU  26  -3.755   2.999  -9.070
  211    HG3  GLU  26           2HG      GLU  26  -5.015   3.063  -7.816
  212    H    LEU  27           H        LEU  27  -3.868  -0.054  -4.848
  213    HA   LEU  27           HA       LEU  27  -1.569  -1.826  -5.101
  214    HB2  LEU  27           1HB      LEU  27  -3.664  -1.367  -3.089
  215    HB3  LEU  27           2HB      LEU  27  -2.362  -2.519  -2.715
  216    HG   LEU  27           HG       LEU  27  -2.020   0.453  -3.275
  217   HD11  LEU  27          1HD1      LEU  27  -1.368   0.580  -0.856
  218   HD12  LEU  27          2HD1      LEU  27  -3.036  -0.010  -1.047
  219   HD13  LEU  27          3HD1      LEU  27  -1.723  -1.156  -0.686
  220   HD21  LEU  27          3HD2      LEU  27  -0.127  -0.842  -4.061
  221   HD22  LEU  27          1HD2      LEU  27   0.332   0.088  -2.615
  222   HD23  LEU  27          2HD2      LEU  27   0.008  -1.657  -2.484
  223    H    GLU  28           H        GLU  28  -5.046  -2.198  -5.311
  224    HA   GLU  28           HA       GLU  28  -5.088  -5.079  -5.235
  225    HB2  GLU  28           1HB      GLU  28  -7.076  -3.667  -4.989
  226    HB3  GLU  28           2HB      GLU  28  -6.893  -3.128  -6.675
  227    HG2  GLU  28           1HG      GLU  28  -7.244  -5.577  -7.396
  228    HG3  GLU  28           2HG      GLU  28  -7.472  -5.877  -5.658
  229    H    GLU  29           H        GLU  29  -4.583  -2.742  -7.851
  230    HA   GLU  29           HA       GLU  29  -4.611  -4.685  -9.978
  231    HB2  GLU  29           1HB      GLU  29  -3.345  -1.960  -9.697
  232    HB3  GLU  29           2HB      GLU  29  -3.291  -2.924 -11.192
  233    HG2  GLU  29           1HG      GLU  29  -5.780  -2.788 -11.389
  234    HG3  GLU  29           2HG      GLU  29  -5.771  -2.059  -9.768
  235    H    PHE  30           H        PHE  30  -1.937  -3.253  -8.102
  236    HA   PHE  30           HA       PHE  30   0.093  -4.773  -9.515
  237    HB2  PHE  30           1HB      PHE  30   0.570  -2.618  -8.343
  238    HB3  PHE  30           2HB      PHE  30   0.239  -3.417  -6.788
  239    HD1  PHE  30           1HD      PHE  30   2.572  -3.076  -9.580
  240    HD2  PHE  30           2HD      PHE  30   1.781  -4.995  -5.844
  241    HE1  PHE  30           1HE      PHE  30   4.942  -3.771  -9.435
  242    HE2  PHE  30           2HE      PHE  30   4.149  -5.687  -5.695
  243    HZ   PHE  30           HZ       PHE  30   5.729  -5.076  -7.492
  244    H    THR  31           H        THR  31  -1.376  -5.114  -6.273
  245    HA   THR  31           HA       THR  31   0.155  -7.509  -5.681
  246    HB   THR  31           HB       THR  31  -2.384  -6.427  -4.386
  247    HG1  THR  31           1HG      THR  31  -0.551  -5.018  -4.256
  248   HG21  THR  31          3HG2      THR  31  -0.334  -8.453  -3.405
  249   HG22  THR  31          1HG2      THR  31  -1.710  -7.828  -2.466
  250   HG23  THR  31          2HG2      THR  31  -1.998  -8.822  -3.914
  251    H    GLN  32           H        GLN  32  -2.989  -6.883  -7.119
  252    HA   GLN  32           HA       GLN  32  -4.520  -8.320  -8.103
  253    HB2  GLN  32           1HB      GLN  32  -2.137 -10.186  -8.093
  254    HB3  GLN  32           2HB      GLN  32  -3.669 -10.481  -8.949
  255    HG2  GLN  32           1HG      GLN  32  -3.051  -8.258 -10.399
  256    HG3  GLN  32           2HG      GLN  32  -1.690  -8.402  -9.263
  257   HE21  GLN  32          2HE2      GLN  32  -1.228  -8.274 -11.968
  258   HE22  GLN  32          1HE2      GLN  32  -0.675  -9.813 -12.545
  259    H    ALA  33           H        ALA  33  -5.205  -8.098  -5.695
  260    HA   ALA  33           HA       ALA  33  -5.902 -10.840  -4.842
  261    HB1  ALA  33           1HB      ALA  33  -5.259 -10.397  -2.504
  262    HB2  ALA  33           2HB      ALA  33  -3.848 -10.361  -3.589
  263    HB3  ALA  33           3HB      ALA  33  -4.555  -8.840  -2.995
  264    H    LYS  34           H        LYS  34  -7.424 -10.734  -2.896
  265    HA   LYS  34           HA       LYS  34  -9.663  -9.044  -3.640
  266    HB2  LYS  34           1HB      LYS  34  -9.141 -10.783  -1.225
  267    HB3  LYS  34           2HB      LYS  34 -10.680  -9.960  -1.567
  268    HG2  LYS  34           1HG      LYS  34 -10.892 -11.249  -3.664
  269    HG3  LYS  34           2HG      LYS  34  -9.367 -12.088  -3.292
  270    HD2  LYS  34           1HD      LYS  34 -10.368 -12.983  -1.224
  271    HD3  LYS  34           2HD      LYS  34 -11.895 -12.152  -1.609
  272    HE2  LYS  34           1HE      LYS  34 -12.075 -13.459  -3.688
  273    HE3  LYS  34           2HE      LYS  34 -10.559 -14.297  -3.288
  274    HZ1  LYS  34           3HZ      LYS  34 -13.041 -14.390  -1.697
  275    HZ2  LYS  34           1HZ      LYS  34 -12.483 -15.596  -2.673
  276    HZ3  LYS  34           2HZ      LYS  34 -11.635 -15.168  -1.325
  277    H    ARG  35           H        ARG  35 -10.649  -7.386  -2.563
  278    HA   ARG  35           HA       ARG  35  -8.857  -5.465  -1.377
  279    HB2  ARG  35           1HB      ARG  35 -11.831  -5.539  -1.569
  280    HB3  ARG  35           2HB      ARG  35 -10.897  -4.208  -0.846
  281    HG2  ARG  35           1HG      ARG  35  -9.802  -3.766  -2.961
  282    HG3  ARG  35           2HG      ARG  35 -10.589  -5.180  -3.702
  283    HD2  ARG  35           1HD      ARG  35 -12.761  -4.081  -3.323
  284    HD3  ARG  35           2HD      ARG  35 -11.878  -2.640  -2.767
  285    HE   ARG  35           HE       ARG  35 -10.975  -3.142  -5.443
  286   HH11  ARG  35          1HH1      ARG  35 -14.021  -2.428  -3.905
  287   HH12  ARG  35          2HH1      ARG  35 -14.567  -1.606  -5.355
  288   HH21  ARG  35          1HH2      ARG  35 -11.589  -2.213  -7.113
  289   HH22  ARG  35          2HH2      ARG  35 -13.181  -1.484  -7.186
  290    H    GLU  36           H        GLU  36 -10.987  -7.908  -0.034
  291    HA   GLU  36           HA       GLU  36 -10.988  -6.976   2.676
  292    HB2  GLU  36           1HB      GLU  36 -12.473  -8.722   1.814
  293    HB3  GLU  36           2HB      GLU  36 -11.072  -9.795   1.588
  294    HG2  GLU  36           1HG      GLU  36 -10.706  -9.744   4.119
  295    HG3  GLU  36           2HG      GLU  36 -12.126  -8.674   4.151
  296    H    VAL  37           H        VAL  37  -8.841  -9.334   1.057
  297    HA   VAL  37           HA       VAL  37  -7.228  -9.677   3.488
  298    HB   VAL  37           HB       VAL  37  -5.814 -11.090   2.111
  299   HG11  VAL  37          1HG1      VAL  37  -7.475 -12.708   1.255
  300   HG12  VAL  37          2HG1      VAL  37  -7.971 -12.061   2.837
  301   HG13  VAL  37          3HG1      VAL  37  -8.740 -11.461   1.348
  302   HG21  VAL  37          3HG2      VAL  37  -5.664  -9.675   0.151
  303   HG22  VAL  37          1HG2      VAL  37  -6.143 -11.330  -0.297
  304   HG23  VAL  37          2HG2      VAL  37  -7.359 -10.032  -0.259
  305    H    LEU  38           H        LEU  38  -7.115  -7.580   0.708
  306    HA   LEU  38           HA       LEU  38  -4.432  -6.621   1.148
  307    HB2  LEU  38           1HB      LEU  38  -6.910  -5.537   0.008
  308    HB3  LEU  38           2HB      LEU  38  -5.466  -4.499  -0.032
  309    HG   LEU  38           HG       LEU  38  -5.716  -7.235  -1.341
  310   HD11  LEU  38          1HD1      LEU  38  -5.691  -5.951  -3.496
  311   HD12  LEU  38          2HD1      LEU  38  -7.092  -5.506  -2.495
  312   HD13  LEU  38          3HD1      LEU  38  -5.675  -4.431  -2.572
  313   HD21  LEU  38          3HD2      LEU  38  -3.451  -6.739  -0.633
  314   HD22  LEU  38          1HD2      LEU  38  -3.562  -6.666  -2.408
  315   HD23  LEU  38          2HD2      LEU  38  -3.508  -5.163  -1.456
  316    H    LEU  39           H        LEU  39  -7.598  -5.520   2.353
  317    HA   LEU  39           HA       LEU  39  -6.506  -3.322   3.867
  318    HB2  LEU  39           1HB      LEU  39  -8.952  -4.947   3.986
  319    HB3  LEU  39           2HB      LEU  39  -8.805  -3.573   5.105
  320    HG   LEU  39           HG       LEU  39  -8.805  -3.414   2.066
  321   HD11  LEU  39          1HD1      LEU  39 -11.019  -2.274   2.372
  322   HD12  LEU  39          2HD1      LEU  39 -11.053  -3.933   3.012
  323   HD13  LEU  39          3HD1      LEU  39 -10.902  -2.552   4.125
  324   HD21  LEU  39          3HD2      LEU  39  -7.410  -1.702   3.067
  325   HD22  LEU  39          1HD2      LEU  39  -8.893  -0.969   2.408
  326   HD23  LEU  39          2HD2      LEU  39  -8.729  -1.227   4.164
  327    H    VAL  40           H        VAL  40  -7.021  -6.728   4.579
  328    HA   VAL  40           HA       VAL  40  -6.474  -6.616   7.410
  329    HB   VAL  40           HB       VAL  40  -5.984  -8.788   5.335
  330   HG11  VAL  40          1HG1      VAL  40  -5.681 -10.304   7.263
  331   HG12  VAL  40          2HG1      VAL  40  -4.430  -9.038   7.241
  332   HG13  VAL  40          3HG1      VAL  40  -5.799  -8.918   8.372
  333   HG21  VAL  40          3HG2      VAL  40  -8.323  -8.257   5.675
  334   HG22  VAL  40          1HG2      VAL  40  -7.931  -9.852   6.359
  335   HG23  VAL  40          2HG2      VAL  40  -8.129  -8.450   7.435
  336    H    THR  41           H        THR  41  -4.285  -7.027   4.632
  337    HA   THR  41           HA       THR  41  -1.964  -7.175   6.418
  338    HB   THR  41           HB       THR  41  -0.650  -7.166   4.306
  339    HG1  THR  41           1HG      THR  41  -3.222  -6.911   3.078
  340   HG21  THR  41          3HG2      THR  41  -3.058  -9.029   4.252
  341   HG22  THR  41          1HG2      THR  41  -1.522  -9.289   3.391
  342   HG23  THR  41          2HG2      THR  41  -1.558  -9.297   5.171
  343    H    LEU  42           H        LEU  42  -3.619  -4.696   4.582
  344    HA   LEU  42           HA       LEU  42  -1.573  -2.676   4.882
  345    HB2  LEU  42           1HB      LEU  42  -4.486  -2.715   4.522
  346    HB3  LEU  42           2HB      LEU  42  -3.693  -1.126   4.604
  347    HG   LEU  42           HG       LEU  42  -3.091  -3.284   2.547
  348   HD11  LEU  42          1HD1      LEU  42  -4.246  -1.755   0.930
  349   HD12  LEU  42          2HD1      LEU  42  -5.353  -2.289   2.217
  350   HD13  LEU  42          3HD1      LEU  42  -4.642  -0.657   2.274
  351   HD21  LEU  42          3HD2      LEU  42  -1.180  -1.874   3.031
  352   HD22  LEU  42          1HD2      LEU  42  -1.810  -1.506   1.406
  353   HD23  LEU  42          2HD2      LEU  42  -2.157  -0.410   2.766
  354    H    THR  43           H        THR  43  -4.348  -3.644   6.876
  355    HA   THR  43           HA       THR  43  -3.898  -1.682   8.939
  356    HB   THR  43           HB       THR  43  -5.159  -4.451   9.099
  357    HG1  THR  43           1HG      THR  43  -7.104  -3.178   8.994
  358   HG21  THR  43          3HG2      THR  43  -5.286  -2.090  11.016
  359   HG22  THR  43          1HG2      THR  43  -6.201  -3.607  11.172
  360   HG23  THR  43          2HG2      THR  43  -4.426  -3.621  11.307
  361    H    ARG  44           H        ARG  44  -2.698  -4.993   8.465
  362    HA   ARG  44           HA       ARG  44  -1.305  -5.159  10.971
  363    HB2  ARG  44           1HB      ARG  44  -0.931  -6.583   8.383
  364    HB3  ARG  44           2HB      ARG  44   0.072  -6.870   9.823
  365    HG2  ARG  44           1HG      ARG  44  -1.884  -7.564  11.091
  366    HG3  ARG  44           2HG      ARG  44  -2.943  -7.181   9.711
  367    HD2  ARG  44           1HD      ARG  44  -1.900  -8.928   8.418
  368    HD3  ARG  44           2HD      ARG  44  -0.820  -9.302   9.782
  369    HE   ARG  44           HE       ARG  44  -3.528  -9.716  10.696
  370   HH11  ARG  44          1HH1      ARG  44  -1.361 -11.089   8.336
  371   HH12  ARG  44          2HH1      ARG  44  -2.138 -12.650   8.521
  372   HH21  ARG  44          1HH2      ARG  44  -4.436 -11.493  10.913
  373   HH22  ARG  44          2HH2      ARG  44  -3.892 -12.881   9.989
  374    H    LEU  45           H        LEU  45  -0.267  -4.058   7.751
  375    HA   LEU  45           HA       LEU  45   2.453  -3.518   8.517
  376    HB2  LEU  45           1HB      LEU  45   0.602  -2.493   6.479
  377    HB3  LEU  45           2HB      LEU  45   2.281  -1.904   6.450
  378    HG   LEU  45           HG       LEU  45   1.415  -4.806   6.146
  379   HD11  LEU  45          1HD1      LEU  45   2.160  -4.533   3.765
  380   HD12  LEU  45          2HD1      LEU  45   0.824  -3.424   4.156
  381   HD13  LEU  45          3HD1      LEU  45   2.495  -2.815   4.084
  382   HD21  LEU  45          3HD2      LEU  45   3.588  -4.586   7.199
  383   HD22  LEU  45          1HD2      LEU  45   3.776  -5.208   5.543
  384   HD23  LEU  45          2HD2      LEU  45   4.141  -3.502   5.901
  385    H    HIS  46           H        HIS  46  -0.482  -1.527   8.555
  386    HA   HIS  46           HA       HIS  46   0.838   0.898   9.369
  387    HB2  HIS  46           1HB      HIS  46  -1.433   0.963   8.444
  388    HB3  HIS  46           2HB      HIS  46  -2.036  -0.038   9.785
  389    HD1  HIS  46           1HD      HIS  46  -0.136   3.273   9.488
  390    HD2  HIS  46           2HD      HIS  46  -3.351   1.594  11.635
  391    HE1  HIS  46           1HE      HIS  46  -0.920   5.021  11.004
  392    H    GLN  47           H        GLN  47  -0.655  -1.751  11.207
  393    HA   GLN  47           HA       GLN  47  -0.232  -0.522  13.785
  394    HB2  GLN  47           1HB      GLN  47  -0.565  -3.402  12.926
  395    HB3  GLN  47           2HB      GLN  47  -0.489  -2.864  14.620
  396    HG2  GLN  47           1HG      GLN  47  -2.864  -2.194  12.674
  397    HG3  GLN  47           2HG      GLN  47  -2.562  -3.275  14.054
  398   HE21  GLN  47          2HE2      GLN  47  -3.903  -0.391  13.140
  399   HE22  GLN  47          1HE2      GLN  47  -3.856   0.449  14.656
  400    H    ARG  48           H        ARG  48   1.804  -2.381  11.640
  401    HA   ARG  48           HA       ARG  48   3.867  -2.809  13.694
  402    HB2  ARG  48           1HB      ARG  48   3.818  -3.296  10.755
  403    HB3  ARG  48           2HB      ARG  48   5.244  -3.543  11.791
  404    HG2  ARG  48           1HG      ARG  48   4.064  -5.224  13.083
  405    HG3  ARG  48           2HG      ARG  48   2.566  -4.919  12.171
  406    HD2  ARG  48           1HD      ARG  48   3.646  -5.730  10.156
  407    HD3  ARG  48           2HD      ARG  48   5.122  -6.062  11.089
  408    HE   ARG  48           HE       ARG  48   3.074  -7.657  12.292
  409   HH11  ARG  48          1HH1      ARG  48   4.490  -7.392   9.116
  410   HH12  ARG  48          2HH1      ARG  48   4.192  -9.095   8.836
  411   HH21  ARG  48          1HH2      ARG  48   2.718  -9.606  11.982
  412   HH22  ARG  48          2HH2      ARG  48   3.180 -10.360  10.467
  413    H    GLY  49           H        GLY  49   2.848  -0.177  11.895
  414    HA2  GLY  49           1HA      GLY  49   3.750   1.980  11.976
  415    HA3  GLY  49           2HA      GLY  49   5.214   1.324  12.743
  416    H    VAL  50           H        VAL  50   3.832   0.072   9.751
  417    HA   VAL  50           HA       VAL  50   6.369   0.827   8.332
  418    HB   VAL  50           HB       VAL  50   4.202  -1.184   7.592
  419   HG11  VAL  50          1HG1      VAL  50   5.830  -1.916   5.882
  420   HG12  VAL  50          2HG1      VAL  50   5.370  -0.214   5.641
  421   HG13  VAL  50          3HG1      VAL  50   6.939  -0.617   6.381
  422   HG21  VAL  50          3HG2      VAL  50   5.419  -1.904   9.560
  423   HG22  VAL  50          1HG2      VAL  50   5.858  -2.893   8.148
  424   HG23  VAL  50          2HG2      VAL  50   6.968  -1.626   8.728
  425    H    ILE  51           H        ILE  51   2.840   0.823   7.834
  426    HA   ILE  51           HA       ILE  51   3.264   3.160   5.987
  427    HB   ILE  51           HB       ILE  51   1.327   2.403   4.685
  428   HG12  ILE  51          1HG1      ILE  51   1.297  -0.043   6.432
  429   HG13  ILE  51          2HG1      ILE  51   0.199   1.345   6.605
  430   HG21  ILE  51          1HG2      ILE  51   2.276   0.364   3.660
  431   HG22  ILE  51          2HG2      ILE  51   3.547   1.561   3.998
  432   HG23  ILE  51          3HG2      ILE  51   3.345   0.154   5.067
  433   HD11  ILE  51          3HD1      ILE  51   0.432  -0.441   4.160
  434   HD12  ILE  51          1HD1      ILE  51  -0.877  -0.490   5.363
  435   HD13  ILE  51          2HD1      ILE  51  -0.667   0.947   4.334
  436    H    TYR  52           H        TYR  52   1.226   4.411   5.644
  437    HA   TYR  52           HA       TYR  52  -0.648   4.308   7.936
  438    HB2  TYR  52           1HB      TYR  52  -0.421   6.616   8.485
  439    HB3  TYR  52           2HB      TYR  52   1.167   5.826   8.640
  440    HD1  TYR  52           2HD      TYR  52   2.950   6.294   6.996
  441    HD2  TYR  52           1HD      TYR  52  -0.785   8.344   6.839
  442    HE1  TYR  52           2HE      TYR  52   3.951   7.981   5.491
  443    HE2  TYR  52           1HE      TYR  52   0.201  10.044   5.331
  444    HH   TYR  52           HH       TYR  52   3.610   9.886   4.291
  445    H    ARG  53           H        ARG  53  -2.571   5.507   7.631
  446    HA   ARG  53           HA       ARG  53  -3.224   5.783   4.728
  447    HB2  ARG  53           1HB      ARG  53  -4.522   4.207   6.045
  448    HB3  ARG  53           2HB      ARG  53  -5.095   5.566   7.042
  449    HG2  ARG  53           1HG      ARG  53  -6.173   6.576   5.113
  450    HG3  ARG  53           2HG      ARG  53  -5.519   5.306   4.049
  451    HD2  ARG  53           1HD      ARG  53  -7.799   4.863   4.452
  452    HD3  ARG  53           2HD      ARG  53  -6.826   3.656   5.325
  453    HE   ARG  53           HE       ARG  53  -7.706   5.802   7.139
  454   HH11  ARG  53          1HH1      ARG  53  -8.812   2.905   5.543
  455   HH12  ARG  53          2HH1      ARG  53  -9.978   2.638   6.826
  456   HH21  ARG  53          1HH2      ARG  53  -9.040   5.512   8.610
  457   HH22  ARG  53          2HH2      ARG  53 -10.109   4.124   8.574
  458    H    LYS  54           H        LYS  54  -3.975   7.578   3.817
  459    HA   LYS  54           HA       LYS  54  -4.528   9.949   5.513
  460    HB2  LYS  54           1HB      LYS  54  -2.089   9.944   5.064
  461    HB3  LYS  54           2HB      LYS  54  -2.449   9.950   3.320
  462    HG2  LYS  54           1HG      LYS  54  -3.483  12.128   3.481
  463    HG3  LYS  54           2HG      LYS  54  -3.340  12.111   5.256
  464    HD2  LYS  54           1HD      LYS  54  -0.875  12.059   5.042
  465    HD3  LYS  54           2HD      LYS  54  -1.040  12.127   3.271
  466    HE2  LYS  54           1HE      LYS  54  -2.202  14.292   3.468
  467    HE3  LYS  54           2HE      LYS  54  -2.005  14.229   5.235
  468    HZ1  LYS  54           3HZ      LYS  54   0.192  14.315   3.269
  469    HZ2  LYS  54           1HZ      LYS  54  -0.311  15.580   4.200
  470    HZ3  LYS  54           2HZ      LYS  54   0.375  14.256   4.907
  471    H    TRP  55           H        TRP  55  -5.910  11.378   4.672
  472    HA   TRP  55           HA       TRP  55  -7.318  10.607   2.210
  473    HB2  TRP  55           1HB      TRP  55  -7.658  12.901   4.185
  474    HB3  TRP  55           2HB      TRP  55  -8.668  12.691   2.736
  475    HD1  TRP  55           HD       TRP  55  -7.976  11.291   6.087
  476    HE1  TRP  55           1HE      TRP  55  -9.989   9.640   6.811
  477    HE3  TRP  55           3HE      TRP  55 -10.460  11.173   1.653
  478    HZ2  TRP  55           2HZ      TRP  55 -12.204   8.568   5.553
  479    HZ3  TRP  55           3HZ      TRP  55 -12.477   9.861   1.426
  480    HH2  TRP  55           HH       TRP  55 -13.386   8.563   3.305
  481    H    ARG  56           H        ARG  56  -7.268  11.504   0.263
  482    HA   ARG  56           HA       ARG  56  -5.665  14.006  -0.089
  483    HB2  ARG  56           1HB      ARG  56  -4.281  12.095  -0.674
  484    HB3  ARG  56           2HB      ARG  56  -5.481  11.648  -1.909
  485    HG2  ARG  56           1HG      ARG  56  -5.111  13.838  -3.014
  486    HG3  ARG  56           2HG      ARG  56  -3.851  14.206  -1.813
  487    HD2  ARG  56           1HD      ARG  56  -3.813  11.947  -3.789
  488    HD3  ARG  56           2HD      ARG  56  -2.924  13.484  -3.919
  489    HE   ARG  56           HE       ARG  56  -2.094  11.217  -2.161
  490   HH11  ARG  56          1HH1      ARG  56  -1.641  14.570  -3.012
  491   HH12  ARG  56          2HH1      ARG  56  -0.083  14.569  -2.209
  492   HH21  ARG  56          1HH2      ARG  56  -0.308  11.199  -1.245
  493   HH22  ARG  56          2HH2      ARG  56   0.678  12.647  -1.202
  494    H    HIS  57           H        HIS  57  -6.736  15.542  -1.020
  495    HA   HIS  57           HA       HIS  57  -9.354  15.081  -2.196
  496    HB2  HIS  57           1HB      HIS  57  -8.640  17.209  -0.996
  497    HB3  HIS  57           2HB      HIS  57  -7.639  17.589  -2.418
  498    HD1  HIS  57           1HD      HIS  57  -8.881  18.151  -4.637
  499    HD2  HIS  57           2HD      HIS  57 -11.466  17.691  -1.341
  500    HE1  HIS  57           1HE      HIS  57 -10.999  19.180  -5.293
  501    H    PHE  58           H        PHE  58 -10.008  14.880  -4.213
  502    HA   PHE  58           HA       PHE  58  -8.201  15.422  -6.469
  503    HB2  PHE  58           1HB      PHE  58  -7.434  13.168  -5.739
  504    HB3  PHE  58           2HB      PHE  58  -9.101  12.567  -5.889
  505    HD1  PHE  58           1HD      PHE  58  -6.373  14.172  -7.850
  506    HD2  PHE  58           2HD      PHE  58  -9.834  11.667  -7.864
  507    HE1  PHE  58           1HE      PHE  58  -5.957  13.612 -10.221
  508    HE2  PHE  58           2HE      PHE  58  -9.420  11.104 -10.235
  509    HZ   PHE  58           HZ       PHE  58  -7.480  12.080 -11.414
  510    H    SER  59           H        SER  59  -9.414  16.452  -7.833
  511    HA   SER  59           HA       SER  59 -11.207  16.849  -9.355
  512    HB2  SER  59           1HB      SER  59 -11.711  13.972  -8.895
  513    HB3  SER  59           2HB      SER  59 -12.417  15.012 -10.153
  514    HG   SER  59           HG       SER  59 -10.585  13.855 -10.889
  515    H    GLY  60           H        GLY  60 -11.561  17.243  -6.382
  516    HA2  GLY  60           1HA      GLY  60 -13.399  18.429  -5.465
  517    HA3  GLY  60           2HA      GLY  60 -14.490  17.608  -6.605
  518    H    ARG  61           H        ARG  61 -12.498  15.262  -5.442
  519    HA   ARG  61           HA       ARG  61 -14.224  14.656  -3.077
  520    HB2  ARG  61           1HB      ARG  61 -13.735  12.793  -5.356
  521    HB3  ARG  61           2HB      ARG  61 -14.428  12.355  -3.778
  522    HG2  ARG  61           1HG      ARG  61 -15.640  14.394  -5.667
  523    HG3  ARG  61           2HG      ARG  61 -16.116  12.679  -5.609
  524    HD2  ARG  61           1HD      ARG  61 -16.768  12.974  -3.278
  525    HD3  ARG  61           2HD      ARG  61 -16.365  14.702  -3.408
  526    HE   ARG  61           HE       ARG  61 -18.836  13.474  -4.546
  527   HH11  ARG  61          1HH1      ARG  61 -16.767  16.277  -4.408
  528   HH12  ARG  61          2HH1      ARG  61 -18.062  17.270  -5.048
  529   HH21  ARG  61          1HH2      ARG  61 -20.332  14.600  -5.270
  530   HH22  ARG  61          2HH2      ARG  61 -20.095  16.316  -5.538
  531    H    LYS  62           H        LYS  62 -13.202  13.927  -1.382
  532    HA   LYS  62           HA       LYS  62 -10.300  13.395  -1.587
  533    HB2  LYS  62           1HB      LYS  62 -12.223  13.476   0.741
  534    HB3  LYS  62           2HB      LYS  62 -10.481  13.143   0.878
  535    HG2  LYS  62           1HG      LYS  62  -9.971  15.371  -0.015
  536    HG3  LYS  62           2HG      LYS  62 -11.710  15.706  -0.197
  537    HD2  LYS  62           1HD      LYS  62 -12.006  15.451   2.242
  538    HD3  LYS  62           2HD      LYS  62 -10.260  15.147   2.416
  539    HE2  LYS  62           1HE      LYS  62  -9.776  17.374   1.502
  540    HE3  LYS  62           2HE      LYS  62 -11.518  17.681   1.317
  541    HZ1  LYS  62           3HZ      LYS  62 -10.124  17.204   3.873
  542    HZ2  LYS  62           1HZ      LYS  62 -10.650  18.669   3.327
  543    HZ3  LYS  62           2HZ      LYS  62 -11.741  17.487   3.703
  544    H    TYR  63           H        TYR  63  -9.300  11.526  -1.493
  545    HA   TYR  63           HA       TYR  63 -10.974   9.085  -0.985
  546    HB2  TYR  63           1HB      TYR  63  -8.757   9.445  -3.012
  547    HB3  TYR  63           2HB      TYR  63  -9.616   7.927  -2.652
  548    HD1  TYR  63           2HD      TYR  63 -12.009   7.684  -3.282
  549    HD2  TYR  63           1HD      TYR  63  -9.746  11.110  -4.434
  550    HE1  TYR  63           2HE      TYR  63 -13.734   8.247  -4.961
  551    HE2  TYR  63           1HE      TYR  63 -11.464  11.688  -6.122
  552    HH   TYR  63           HH       TYR  63 -14.385   9.695  -6.593
  553    H    ARG  64           H        ARG  64  -9.978   7.304  -0.072
  554    HA   ARG  64           HA       ARG  64  -7.788   8.000   1.765
  555    HB2  ARG  64           1HB      ARG  64  -9.355   5.489   1.396
  556    HB3  ARG  64           2HB      ARG  64  -8.037   5.712   2.570
  557    HG2  ARG  64           1HG      ARG  64  -9.283   7.417   3.736
  558    HG3  ARG  64           2HG      ARG  64 -10.554   7.400   2.489
  559    HD2  ARG  64           1HD      ARG  64  -9.887   5.003   4.147
  560    HD3  ARG  64           2HD      ARG  64 -11.036   6.254   4.675
  561    HE   ARG  64           HE       ARG  64 -11.961   5.264   2.124
  562   HH11  ARG  64          1HH1      ARG  64 -11.493   4.040   5.355
  563   HH12  ARG  64          2HH1      ARG  64 -12.818   2.916   5.128
  564   HH21  ARG  64          1HH2      ARG  64 -13.475   3.977   1.846
  565   HH22  ARG  64          2HH2      ARG  64 -13.950   2.879   3.127
  566    H    GLU  65           H        GLU  65  -5.728   7.690   1.517
  567    HA   GLU  65           HA       GLU  65  -4.840   5.624  -0.469
  568    HB2  GLU  65           1HB      GLU  65  -3.599   8.314   0.126
  569    HB3  GLU  65           2HB      GLU  65  -2.883   7.046  -0.899
  570    HG2  GLU  65           1HG      GLU  65  -4.891   7.292  -2.474
  571    HG3  GLU  65           2HG      GLU  65  -5.429   8.549  -1.337
  572    H    TYR  66           H        TYR  66  -2.984   4.478  -0.027
  573    HA   TYR  66           HA       TYR  66  -2.084   4.638   2.832
  574    HB2  TYR  66           1HB      TYR  66  -2.118   2.335   0.872
  575    HB3  TYR  66           2HB      TYR  66  -1.327   2.298   2.467
  576    HD1  TYR  66           1HD      TYR  66  -4.582   2.425   0.716
  577    HD2  TYR  66           2HD      TYR  66  -2.628   2.077   4.489
  578    HE1  TYR  66           1HE      TYR  66  -6.727   1.746   1.754
  579    HE2  TYR  66           2HE      TYR  66  -4.759   1.397   5.542
  580    HH   TYR  66           HH       TYR  66  -6.975   0.978   5.229
  581    H    CYS  67           H        CYS  67  -0.089   5.147   3.297
  582    HA   CYS  67           HA       CYS  67   1.851   5.499   0.987
  583    HB2  CYS  67           1HB      CYS  67   0.719   7.540   1.850
  584    HB3  CYS  67           2HB      CYS  67   1.294   7.151   3.490
  585    HG   CYS  67           HG       CYS  67   3.792   7.279   2.926
  586    H    LEU  68           H        LEU  68   3.917   4.853   1.310
  587    HA   LEU  68           HA       LEU  68   4.468   3.241   3.733
  588    HB2  LEU  68           1HB      LEU  68   4.923   2.308   1.712
  589    HB3  LEU  68           2HB      LEU  68   5.953   3.614   1.081
  590    HG   LEU  68           HG       LEU  68   7.556   3.123   2.979
  591   HD11  LEU  68          1HD1      LEU  68   7.375   0.850   4.026
  592   HD12  LEU  68          2HD1      LEU  68   5.961   1.854   4.416
  593   HD13  LEU  68          3HD1      LEU  68   5.839   0.593   3.167
  594   HD21  LEU  68          3HD2      LEU  68   8.009   2.405   0.708
  595   HD22  LEU  68          1HD2      LEU  68   8.569   1.167   1.857
  596   HD23  LEU  68          2HD2      LEU  68   7.054   0.924   0.954
  597    H    LYS  69           H        LYS  69   5.687   3.776   5.368
  598    HA   LYS  69           HA       LYS  69   6.548   6.549   5.605
  599    HB2  LYS  69           1HB      LYS  69   6.911   4.123   7.366
  600    HB3  LYS  69           2HB      LYS  69   7.455   5.762   7.793
  601    HG2  LYS  69           1HG      LYS  69   5.116   6.556   7.666
  602    HG3  LYS  69           2HG      LYS  69   4.587   4.901   7.282
  603    HD2  LYS  69           1HD      LYS  69   5.481   4.116   9.442
  604    HD3  LYS  69           2HD      LYS  69   5.993   5.776   9.828
  605    HE2  LYS  69           1HE      LYS  69   3.638   6.516   9.674
  606    HE3  LYS  69           2HE      LYS  69   3.146   4.837   9.355
  607    HZ1  LYS  69           3HZ      LYS  69   4.468   5.799  11.810
  608    HZ2  LYS  69           1HZ      LYS  69   2.868   5.421  11.667
  609    HZ3  LYS  69           2HZ      LYS  69   4.013   4.241  11.515
  610    H    HIS  70           H        HIS  70   8.142   3.483   4.937
  611    HA   HIS  70           HA       HIS  70  10.702   4.968   4.554
  612    HB2  HIS  70           1HB      HIS  70  10.693   3.954   6.870
  613    HB3  HIS  70           2HB      HIS  70  10.501   2.354   6.113
  614    HD1  HIS  70           1HD      HIS  70  12.815   2.065   7.552
  615    HD2  HIS  70           2HD      HIS  70  13.070   4.290   3.981
  616    HE1  HIS  70           1HE      HIS  70  15.192   2.178   6.997
  617    H    ARG  71           H        ARG  71  10.988   4.770   2.463
  618    HA   ARG  71           HA       ARG  71  10.118   2.696   0.779
  619    HB2  ARG  71           1HB      ARG  71  11.050   4.868   0.096
  620    HB3  ARG  71           2HB      ARG  71  12.667   4.196   0.407
  621    HG2  ARG  71           1HG      ARG  71  12.149   2.378  -1.240
  622    HG3  ARG  71           2HG      ARG  71  10.637   3.235  -1.630
  623    HD2  ARG  71           1HD      ARG  71  13.396   4.374  -1.934
  624    HD3  ARG  71           2HD      ARG  71  12.450   3.609  -3.232
  625    HE   ARG  71           HE       ARG  71  10.897   5.838  -2.260
  626   HH11  ARG  71          1HH1      ARG  71  13.966   5.338  -3.841
  627   HH12  ARG  71          2HH1      ARG  71  13.818   6.896  -4.631
  628   HH21  ARG  71          1HH2      ARG  71  10.718   7.627  -3.151
  629   HH22  ARG  71          2HH2      ARG  71  11.969   8.202  -4.237
  630    H    ASP  72           H        ASP  72  10.663   0.705   0.311
  631    HA   ASP  72           HA       ASP  72  12.369  -0.797   2.046
  632    HB2  ASP  72           1HB      ASP  72  11.273  -1.481  -0.748
  633    HB3  ASP  72           2HB      ASP  72  12.286  -2.469   0.335
  634    H    GLU  73           H        GLU  73  12.966   0.675  -1.124
  635    HA   GLU  73           HA       GLU  73  15.612  -0.288  -1.520
  636    HB2  GLU  73           1HB      GLU  73  14.325   0.962  -3.182
  637    HB3  GLU  73           2HB      GLU  73  14.440   2.421  -2.168
  638    HG2  GLU  73           1HG      GLU  73  16.986   2.342  -2.480
  639    HG3  GLU  73           2HG      GLU  73  16.656   0.918  -3.494
  640    H    LEU  74           H        LEU  74  14.504   2.615   0.235
  641    HA   LEU  74           HA       LEU  74  17.155   3.441   0.995
  642    HB2  LEU  74           1HB      LEU  74  14.461   3.861   2.105
  643    HB3  LEU  74           2HB      LEU  74  15.824   4.785   2.778
  644    HG   LEU  74           HG       LEU  74  14.799   4.916  -0.085
  645   HD11  LEU  74          1HD1      LEU  74  14.130   7.253   0.532
  646   HD12  LEU  74          2HD1      LEU  74  13.303   6.054   1.553
  647   HD13  LEU  74          3HD1      LEU  74  14.694   6.960   2.194
  648   HD21  LEU  74          3HD2      LEU  74  17.202   5.221   0.020
  649   HD22  LEU  74          1HD2      LEU  74  16.410   6.769  -0.358
  650   HD23  LEU  74          2HD2      LEU  74  17.019   6.459   1.285
  651    H    ALA  75           H        ALA  75  14.777   1.310   2.500
  652    HA   ALA  75           HA       ALA  75  16.170   0.973   4.975
  653    HB1  ALA  75           1HB      ALA  75  14.845  -1.094   5.194
  654    HB2  ALA  75           2HB      ALA  75  13.838   0.275   4.664
  655    HB3  ALA  75           3HB      ALA  75  14.355  -0.958   3.489
  656    H    ASP  76           H        ASP  76  16.340  -0.811   1.898
  657    HA   ASP  76           HA       ASP  76  18.270  -2.745   2.821
  658    HB2  ASP  76           1HB      ASP  76  17.584  -1.783  -0.021
  659    HB3  ASP  76           2HB      ASP  76  18.779  -2.997   0.496
  660    H    LEU  77           H        LEU  77  18.565   0.479   1.415
  661    HA   LEU  77           HA       LEU  77  21.429   0.382   1.075
  662    HB2  LEU  77           1HB      LEU  77  19.435   2.501   1.496
  663    HB3  LEU  77           2HB      LEU  77  21.120   2.981   1.186
  664    HG   LEU  77           HG       LEU  77  19.348   1.386  -0.705
  665   HD11  LEU  77          1HD1      LEU  77  19.402   3.457  -2.121
  666   HD12  LEU  77          2HD1      LEU  77  18.661   3.776  -0.535
  667   HD13  LEU  77          3HD1      LEU  77  20.339   4.280  -0.851
  668   HD21  LEU  77          3HD2      LEU  77  21.689   0.786  -0.906
  669   HD22  LEU  77          1HD2      LEU  77  21.176   1.713  -2.337
  670   HD23  LEU  77          2HD2      LEU  77  22.144   2.500  -1.066
  671    H    GLU  78           H        GLU  78  19.337   1.278   3.781
  672    HA   GLU  78           HA       GLU  78  21.558   2.112   5.478
  673    HB2  GLU  78           1HB      GLU  78  18.696   1.325   6.031
  674    HB3  GLU  78           2HB      GLU  78  19.845   1.838   7.291
  675    HG2  GLU  78           1HG      GLU  78  20.047   4.091   6.115
  676    HG3  GLU  78           2HG      GLU  78  18.920   3.408   4.921
  677    H    HIS  79           H        HIS  79  19.966  -0.920   4.750
  678    HA   HIS  79           HA       HIS  79  21.173  -2.345   6.999
  679    HB2  HIS  79           1HB      HIS  79  19.845  -3.344   4.437
  680    HB3  HIS  79           2HB      HIS  79  20.357  -4.378   5.792
  681    HD2  HIS  79           2HD      HIS  79  18.882  -1.750   7.889
  682    HE1  HIS  79           1HE      HIS  79  15.526  -3.829   6.316
  683    HE2  HIS  79           2HE      HIS  79  16.425  -2.154   8.132
  Start of MODEL   19
    1    H    LYS   3           H        LYS   3   4.138 -12.882 -10.112
    2    HA   LYS   3           HA       LYS   3   3.800 -10.597  -8.468
    3    HB2  LYS   3           1HB      LYS   3   1.430 -11.289 -10.209
    4    HB3  LYS   3           2HB      LYS   3   1.343 -10.313  -8.724
    5    HG2  LYS   3           1HG      LYS   3   2.842  -8.639  -9.740
    6    HG3  LYS   3           2HG      LYS   3   2.910  -9.610 -11.229
    7    HD2  LYS   3           1HD      LYS   3   0.491  -9.344 -11.535
    8    HD3  LYS   3           2HD      LYS   3   0.395  -8.410 -10.023
    9    HE2  LYS   3           1HE      LYS   3   1.790  -6.664 -10.955
   10    HE3  LYS   3           2HE      LYS   3   2.057  -7.618 -12.431
   11    HZ1  LYS   3           3HZ      LYS   3  -0.539  -6.547 -11.530
   12    HZ2  LYS   3           1HZ      LYS   3   0.379  -5.932 -12.755
   13    HZ3  LYS   3           2HZ      LYS   3  -0.292  -7.432 -12.899
   14    H    ALA   4           H        ALA   4   2.333 -13.642  -9.555
   15    HA   ALA   4           HA       ALA   4   1.105 -14.245  -7.034
   16    HB1  ALA   4           1HB      ALA   4   0.914 -16.535  -7.923
   17    HB2  ALA   4           2HB      ALA   4   0.411 -15.323  -9.125
   18    HB3  ALA   4           3HB      ALA   4   2.003 -16.103  -9.261
   19    H    LYS   5           H        LYS   5   4.357 -14.554  -8.219
   20    HA   LYS   5           HA       LYS   5   5.247 -16.542  -6.312
   21    HB2  LYS   5           1HB      LYS   5   6.696 -14.415  -7.891
   22    HB3  LYS   5           2HB      LYS   5   7.506 -15.611  -6.853
   23    HG2  LYS   5           1HG      LYS   5   6.607 -17.433  -8.238
   24    HG3  LYS   5           2HG      LYS   5   5.781 -16.242  -9.272
   25    HD2  LYS   5           1HD      LYS   5   7.952 -15.268  -9.892
   26    HD3  LYS   5           2HD      LYS   5   8.782 -16.449  -8.852
   27    HE2  LYS   5           1HE      LYS   5   7.902 -18.286 -10.215
   28    HE3  LYS   5           2HE      LYS   5   7.044 -17.118 -11.247
   29    HZ1  LYS   5           3HZ      LYS   5   9.971 -17.289 -10.921
   30    HZ2  LYS   5           1HZ      LYS   5   9.121 -17.816 -12.232
   31    HZ3  LYS   5           2HZ      LYS   5   9.176 -16.207 -11.877
   32    H    LEU   6           H        LEU   6   4.689 -13.112  -6.141
   33    HA   LEU   6           HA       LEU   6   6.261 -12.858  -3.647
   34    HB2  LEU   6           1HB      LEU   6   4.512 -11.045  -5.179
   35    HB3  LEU   6           2HB      LEU   6   5.436 -10.437  -3.785
   36    HG   LEU   6           HG       LEU   6   6.561 -11.490  -6.410
   37   HD11  LEU   6          1HD1      LEU   6   7.419  -9.144  -6.656
   38   HD12  LEU   6          2HD1      LEU   6   5.644  -9.174  -6.534
   39   HD13  LEU   6          3HD1      LEU   6   6.627  -8.710  -5.124
   40   HD21  LEU   6          3HD2      LEU   6   7.967 -12.161  -4.552
   41   HD22  LEU   6          1HD2      LEU   6   8.776 -10.887  -5.495
   42   HD23  LEU   6          2HD2      LEU   6   8.006 -10.491  -3.939
   43    H    SER   7           H        SER   7   5.494 -12.457  -1.640
   44    HA   SER   7           HA       SER   7   2.858 -13.529  -0.922
   45    HB2  SER   7           1HB      SER   7   3.411 -13.210   1.216
   46    HB3  SER   7           2HB      SER   7   4.901 -13.722   0.391
   47    HG   SER   7           HG       SER   7   5.368 -12.014   1.748
   48    H    LEU   8           H        LEU   8   1.508 -12.179   0.633
   49    HA   LEU   8           HA       LEU   8   0.441  -9.870  -0.682
   50    HB2  LEU   8           1HB      LEU   8   0.332 -10.920   2.063
   51    HB3  LEU   8           2HB      LEU   8  -0.702  -9.538   1.642
   52    HG   LEU   8           HG       LEU   8  -0.820 -12.303   0.378
   53   HD11  LEU   8          1HD1      LEU   8  -3.031 -12.479   1.549
   54   HD12  LEU   8          2HD1      LEU   8  -1.700 -12.269   2.711
   55   HD13  LEU   8          3HD1      LEU   8  -2.744 -10.889   2.296
   56   HD21  LEU   8          3HD2      LEU   8  -1.413 -10.553  -1.190
   57   HD22  LEU   8          1HD2      LEU   8  -2.866 -11.471  -0.728
   58   HD23  LEU   8          2HD2      LEU   8  -2.569  -9.862  -0.026
   59    H    THR   9           H        THR   9   2.928 -10.244   1.771
   60    HA   THR   9           HA       THR   9   2.992  -7.331   2.283
   61    HB   THR   9           HB       THR   9   4.820  -7.878   3.852
   62    HG1  THR   9           1HG      THR   9   5.378 -10.103   4.119
   63   HG21  THR   9          3HG2      THR   9   2.437  -9.757   4.104
   64   HG22  THR   9          1HG2      THR   9   3.520  -9.268   5.428
   65   HG23  THR   9          2HG2      THR   9   2.482  -8.059   4.634
   66    H    GLN  10           H        GLN  10   4.857  -9.779   0.564
   67    HA   GLN  10           HA       GLN  10   7.043  -8.016  -0.129
   68    HB2  GLN  10           1HB      GLN  10   5.934 -10.546  -1.351
   69    HB3  GLN  10           2HB      GLN  10   7.351  -9.689  -2.003
   70    HG2  GLN  10           1HG      GLN  10   8.601 -10.218   0.289
   71    HG3  GLN  10           2HG      GLN  10   6.933 -10.703   0.671
   72   HE21  GLN  10          2HE2      GLN  10   9.490 -12.210   0.805
   73   HE22  GLN  10          1HE2      GLN  10   9.252 -13.616  -0.179
   74    H    LEU  11           H        LEU  11   3.983  -8.858  -1.721
   75    HA   LEU  11           HA       LEU  11   4.421  -7.421  -4.137
   76    HB2  LEU  11           1HB      LEU  11   2.111  -8.130  -2.488
   77    HB3  LEU  11           2HB      LEU  11   1.766  -7.203  -3.967
   78    HG   LEU  11           HG       LEU  11   3.227  -9.868  -3.932
   79   HD11  LEU  11          1HD1      LEU  11   1.076 -10.855  -4.765
   80   HD12  LEU  11          2HD1      LEU  11   0.881 -10.159  -3.138
   81   HD13  LEU  11          3HD1      LEU  11   0.290  -9.272  -4.564
   82   HD21  LEU  11          3HD2      LEU  11   3.716  -8.471  -5.853
   83   HD22  LEU  11          1HD2      LEU  11   2.729  -9.865  -6.351
   84   HD23  LEU  11          2HD2      LEU  11   1.979  -8.259  -6.177
   85    H    ILE  12           H        ILE  12   3.000  -6.320  -1.059
   86    HA   ILE  12           HA       ILE  12   2.504  -3.628  -2.071
   87    HB   ILE  12           HB       ILE  12   2.590  -4.790   0.748
   88   HG12  ILE  12          1HG1      ILE  12   0.234  -3.843  -0.854
   89   HG13  ILE  12          2HG1      ILE  12   0.809  -5.526  -0.842
   90   HG21  ILE  12          1HG2      ILE  12   1.549  -2.665   1.462
   91   HG22  ILE  12          2HG2      ILE  12   3.166  -2.386   0.775
   92   HG23  ILE  12          3HG2      ILE  12   1.718  -2.026  -0.191
   93   HD11  ILE  12          3HD1      ILE  12  -0.141  -3.954   1.579
   94   HD12  ILE  12          1HD1      ILE  12  -1.063  -5.215   0.729
   95   HD13  ILE  12          2HD1      ILE  12   0.434  -5.638   1.591
   96    H    LEU  13           H        LEU  13   5.047  -5.050  -0.035
   97    HA   LEU  13           HA       LEU  13   6.200  -2.451   0.537
   98    HB2  LEU  13           1HB      LEU  13   7.107  -5.240   0.752
   99    HB3  LEU  13           2HB      LEU  13   8.149  -3.951   1.399
  100    HG   LEU  13           HG       LEU  13   5.346  -4.662   2.348
  101   HD11  LEU  13          1HD1      LEU  13   6.518  -5.323   4.467
  102   HD12  LEU  13          2HD1      LEU  13   7.096  -6.280   3.083
  103   HD13  LEU  13          3HD1      LEU  13   8.078  -4.934   3.706
  104   HD21  LEU  13          3HD2      LEU  13   5.740  -2.274   2.483
  105   HD22  LEU  13          1HD2      LEU  13   5.731  -2.979   4.116
  106   HD23  LEU  13          2HD2      LEU  13   7.274  -2.546   3.343
  107    H    ILE  14           H        ILE  14   6.886  -5.000  -1.814
  108    HA   ILE  14           HA       ILE  14   9.234  -3.674  -2.923
  109    HB   ILE  14           HB       ILE  14   7.322  -5.781  -4.022
  110   HG12  ILE  14          1HG1      ILE  14  10.197  -6.013  -3.185
  111   HG13  ILE  14          2HG1      ILE  14   8.809  -6.361  -2.128
  112   HG21  ILE  14          1HG2      ILE  14   8.956  -6.073  -5.854
  113   HG22  ILE  14          2HG2      ILE  14   8.256  -4.437  -5.875
  114   HG23  ILE  14          3HG2      ILE  14   9.897  -4.696  -5.235
  115   HD11  ILE  14          3HD1      ILE  14   9.454  -7.776  -4.738
  116   HD12  ILE  14          1HD1      ILE  14   9.722  -8.429  -3.106
  117   HD13  ILE  14          2HD1      ILE  14   8.066  -8.122  -3.680
  118    H    ARG  15           H        ARG  15   5.777  -3.555  -3.641
  119    HA   ARG  15           HA       ARG  15   6.041  -1.786  -5.904
  120    HB2  ARG  15           1HB      ARG  15   4.051  -3.065  -5.454
  121    HB3  ARG  15           2HB      ARG  15   3.749  -2.069  -4.012
  122    HG2  ARG  15           1HG      ARG  15   2.355  -1.307  -5.851
  123    HG3  ARG  15           2HG      ARG  15   3.569  -0.068  -5.447
  124    HD2  ARG  15           1HD      ARG  15   4.932  -0.913  -7.332
  125    HD3  ARG  15           2HD      ARG  15   3.558  -1.953  -7.777
  126    HE   ARG  15           HE       ARG  15   2.587   0.759  -7.796
  127   HH11  ARG  15          1HH1      ARG  15   4.966  -1.117  -9.521
  128   HH12  ARG  15          2HH1      ARG  15   4.716  -0.131 -10.949
  129   HH21  ARG  15          1HH2      ARG  15   2.296   1.902  -9.420
  130   HH22  ARG  15          2HH2      ARG  15   3.193   1.591 -10.893
  131    H    LEU  16           H        LEU  16   5.872  -1.240  -2.417
  132    HA   LEU  16           HA       LEU  16   5.781   1.654  -2.643
  133    HB2  LEU  16           1HB      LEU  16   6.600  -0.269  -0.574
  134    HB3  LEU  16           2HB      LEU  16   6.600   1.463  -0.171
  135    HG   LEU  16           HG       LEU  16   4.172  -0.172  -1.004
  136   HD11  LEU  16          1HD1      LEU  16   3.435   0.161   1.372
  137   HD12  LEU  16          2HD1      LEU  16   4.970  -0.736   1.290
  138   HD13  LEU  16          3HD1      LEU  16   4.969   0.993   1.715
  139   HD21  LEU  16          3HD2      LEU  16   4.019   2.138  -1.723
  140   HD22  LEU  16          1HD2      LEU  16   2.883   1.843  -0.386
  141   HD23  LEU  16          2HD2      LEU  16   4.410   2.706  -0.082
  142    H    SER  17           H        SER  17   8.342  -0.743  -2.619
  143    HA   SER  17           HA       SER  17  10.620   0.998  -2.263
  144    HB2  SER  17           1HB      SER  17  10.679  -1.372  -2.067
  145    HB3  SER  17           2HB      SER  17  10.453  -1.507  -3.827
  146    HG   SER  17           HG       SER  17  12.701  -1.241  -2.593
  147    H    ASN  18           H        ASN  18   8.770  -0.052  -5.146
  148    HA   ASN  18           HA       ASN  18  10.416   1.448  -7.016
  149    HB2  ASN  18           1HB      ASN  18   7.597   0.231  -7.522
  150    HB3  ASN  18           2HB      ASN  18   8.746   1.214  -8.460
  151   HD21  ASN  18          2HD2      ASN  18   7.694  -1.551  -8.788
  152   HD22  ASN  18          1HD2      ASN  18   9.100  -2.552  -8.938
  153    H    ARG  19           H        ARG  19   7.207   2.021  -5.562
  154    HA   ARG  19           HA       ARG  19   7.636   4.935  -6.062
  155    HB2  ARG  19           1HB      ARG  19   5.165   3.421  -6.774
  156    HB3  ARG  19           2HB      ARG  19   5.295   5.190  -6.652
  157    HG2  ARG  19           1HG      ARG  19   6.969   3.490  -8.521
  158    HG3  ARG  19           2HG      ARG  19   5.439   4.272  -8.991
  159    HD2  ARG  19           1HD      ARG  19   6.427   6.440  -8.441
  160    HD3  ARG  19           2HD      ARG  19   7.966   5.618  -8.093
  161    HE   ARG  19           HE       ARG  19   6.932   6.126 -10.849
  162   HH11  ARG  19          1HH1      ARG  19   9.282   4.480  -8.865
  163   HH12  ARG  19          2HH1      ARG  19  10.290   4.210 -10.272
  164   HH21  ARG  19          1HH2      ARG  19   8.080   5.832 -12.468
  165   HH22  ARG  19          2HH2      ARG  19   9.607   4.981 -12.328
  166    H    GLY  20           H        GLY  20   7.316   6.151  -4.366
  167    HA2  GLY  20           1HA      GLY  20   7.061   4.858  -1.844
  168    HA3  GLY  20           2HA      GLY  20   7.037   6.615  -2.118
  169    H    CYS  21           H        CYS  21   4.758   6.802  -3.752
  170    HA   CYS  21           HA       CYS  21   2.589   6.224  -1.710
  171    HB2  CYS  21           1HB      CYS  21   3.110   8.481  -3.696
  172    HB3  CYS  21           2HB      CYS  21   1.716   8.374  -2.594
  173    HG   CYS  21           HG       CYS  21   3.307  10.202  -1.839
  174    H    GLN  22           H        GLN  22   1.184   4.737  -2.404
  175    HA   GLN  22           HA       GLN  22   0.287   4.896  -5.254
  176    HB2  GLN  22           1HB      GLN  22   0.931   2.456  -3.598
  177    HB3  GLN  22           2HB      GLN  22  -0.122   2.400  -5.030
  178    HG2  GLN  22           1HG      GLN  22   2.923   3.176  -5.197
  179    HG3  GLN  22           2HG      GLN  22   1.980   1.681  -5.404
  180   HE21  GLN  22          2HE2      GLN  22   1.762   5.124  -6.428
  181   HE22  GLN  22          1HE2      GLN  22   1.425   4.780  -8.092
  182    H    THR  23           H        THR  23  -1.849   4.375  -5.677
  183    HA   THR  23           HA       THR  23  -3.673   4.718  -3.376
  184    HB   THR  23           HB       THR  23  -5.457   4.727  -5.076
  185    HG1  THR  23           1HG      THR  23  -3.437   4.490  -7.064
  186   HG21  THR  23          3HG2      THR  23  -3.070   6.435  -5.880
  187   HG22  THR  23          1HG2      THR  23  -4.765   6.746  -6.319
  188   HG23  THR  23          2HG2      THR  23  -4.256   6.836  -4.616
  189    H    LEU  24           H        LEU  24  -5.669   3.340  -3.333
  190    HA   LEU  24           HA       LEU  24  -4.935   0.616  -2.817
  191    HB2  LEU  24           1HB      LEU  24  -6.662   1.726  -1.756
  192    HB3  LEU  24           2HB      LEU  24  -7.689   1.914  -3.196
  193    HG   LEU  24           HG       LEU  24  -7.781  -0.598  -3.357
  194   HD11  LEU  24          1HD1      LEU  24  -7.190  -1.890  -1.290
  195   HD12  LEU  24          2HD1      LEU  24  -5.762  -1.082  -1.977
  196   HD13  LEU  24          3HD1      LEU  24  -6.574  -0.395  -0.550
  197   HD21  LEU  24          3HD2      LEU  24  -9.629   0.672  -2.435
  198   HD22  LEU  24          1HD2      LEU  24  -9.449  -0.863  -1.553
  199   HD23  LEU  24          2HD2      LEU  24  -8.875   0.657  -0.824
  200    H    GLU  25           H        GLU  25  -6.395   2.189  -5.627
  201    HA   GLU  25           HA       GLU  25  -6.961  -0.291  -7.021
  202    HB2  GLU  25           1HB      GLU  25  -6.636   2.566  -7.937
  203    HB3  GLU  25           2HB      GLU  25  -7.079   1.222  -9.016
  204    HG2  GLU  25           1HG      GLU  25  -9.193   0.869  -7.672
  205    HG3  GLU  25           2HG      GLU  25  -8.577   2.147  -6.600
  206    H    GLU  26           H        GLU  26  -4.249   2.005  -7.081
  207    HA   GLU  26           HA       GLU  26  -2.747   0.625  -9.109
  208    HB2  GLU  26           1HB      GLU  26  -2.020   2.474  -6.848
  209    HB3  GLU  26           2HB      GLU  26  -0.788   1.746  -7.908
  210    HG2  GLU  26           1HG      GLU  26  -1.757   2.921  -9.883
  211    HG3  GLU  26           2HG      GLU  26  -3.115   3.376  -8.828
  212    H    LEU  27           H        LEU  27  -2.805   0.320  -5.566
  213    HA   LEU  27           HA       LEU  27  -0.805  -1.766  -5.485
  214    HB2  LEU  27           1HB      LEU  27  -3.015  -0.907  -3.747
  215    HB3  LEU  27           2HB      LEU  27  -1.939  -2.199  -3.168
  216    HG   LEU  27           HG       LEU  27  -1.100   0.644  -3.854
  217   HD11  LEU  27          1HD1      LEU  27  -0.725   0.872  -1.383
  218   HD12  LEU  27          2HD1      LEU  27  -2.429   0.515  -1.749
  219   HD13  LEU  27          3HD1      LEU  27  -1.357  -0.775  -1.151
  220   HD21  LEU  27          3HD2      LEU  27   0.655  -0.968  -4.306
  221   HD22  LEU  27          1HD2      LEU  27   1.076   0.002  -2.875
  222   HD23  LEU  27          2HD2      LEU  27   0.476  -1.662  -2.677
  223    H    GLU  28           H        GLU  28  -4.310  -1.756  -5.879
  224    HA   GLU  28           HA       GLU  28  -4.716  -4.579  -5.622
  225    HB2  GLU  28           1HB      GLU  28  -6.526  -2.947  -5.642
  226    HB3  GLU  28           2HB      GLU  28  -6.147  -2.538  -7.333
  227    HG2  GLU  28           1HG      GLU  28  -6.744  -4.974  -7.946
  228    HG3  GLU  28           2HG      GLU  28  -7.159  -5.119  -6.224
  229    H    GLU  29           H        GLU  29  -3.819  -2.582  -8.421
  230    HA   GLU  29           HA       GLU  29  -4.019  -4.704 -10.350
  231    HB2  GLU  29           1HB      GLU  29  -2.435  -2.136 -10.273
  232    HB3  GLU  29           2HB      GLU  29  -2.452  -3.241 -11.669
  233    HG2  GLU  29           1HG      GLU  29  -4.923  -2.848 -11.943
  234    HG3  GLU  29           2HG      GLU  29  -4.825  -1.908 -10.436
  235    H    PHE  30           H        PHE  30  -1.299  -3.514  -8.394
  236    HA   PHE  30           HA       PHE  30   0.578  -5.396  -9.613
  237    HB2  PHE  30           1HB      PHE  30   1.230  -3.158  -8.605
  238    HB3  PHE  30           2HB      PHE  30   0.886  -3.854  -7.006
  239    HD1  PHE  30           1HD      PHE  30   3.023  -4.174 -10.011
  240    HD2  PHE  30           2HD      PHE  30   2.435  -5.192  -5.902
  241    HE1  PHE  30           1HE      PHE  30   5.325  -5.068  -9.905
  242    HE2  PHE  30           2HE      PHE  30   4.739  -6.084  -5.792
  243    HZ   PHE  30           HZ       PHE  30   6.184  -6.022  -7.795
  244    H    THR  31           H        THR  31  -1.425  -5.324  -6.706
  245    HA   THR  31           HA       THR  31  -0.090  -7.601  -5.477
  246    HB   THR  31           HB       THR  31  -2.811  -6.351  -4.916
  247    HG1  THR  31           1HG      THR  31  -0.268  -6.039  -3.642
  248   HG21  THR  31          3HG2      THR  31  -1.124  -8.282  -3.276
  249   HG22  THR  31          1HG2      THR  31  -2.645  -7.524  -2.749
  250   HG23  THR  31          2HG2      THR  31  -2.649  -8.679  -4.104
  251    H    GLN  32           H        GLN  32  -3.034  -7.175  -7.410
  252    HA   GLN  32           HA       GLN  32  -4.487  -8.742  -8.319
  253    HB2  GLN  32           1HB      GLN  32  -1.921 -10.341  -8.289
  254    HB3  GLN  32           2HB      GLN  32  -3.425 -10.876  -9.075
  255    HG2  GLN  32           1HG      GLN  32  -1.836  -8.338 -10.047
  256    HG3  GLN  32           2HG      GLN  32  -1.838 -10.063 -10.482
  257   HE21  GLN  32          2HE2      GLN  32  -3.192  -7.032 -11.079
  258   HE22  GLN  32          1HE2      GLN  32  -4.577  -7.536 -11.990
  259    H    ALA  33           H        ALA  33  -5.026  -8.521  -5.790
  260    HA   ALA  33           HA       ALA  33  -5.765 -11.305  -5.104
  261    HB1  ALA  33           1HB      ALA  33  -5.177 -10.970  -2.735
  262    HB2  ALA  33           2HB      ALA  33  -3.743 -10.881  -3.784
  263    HB3  ALA  33           3HB      ALA  33  -4.467  -9.390  -3.137
  264    H    LYS  34           H        LYS  34  -7.363 -11.325  -3.246
  265    HA   LYS  34           HA       LYS  34  -9.657  -9.802  -3.904
  266    HB2  LYS  34           1HB      LYS  34  -9.628 -11.891  -2.584
  267    HB3  LYS  34           2HB      LYS  34  -8.919 -10.988  -1.224
  268    HG2  LYS  34           1HG      LYS  34 -10.927  -9.605  -1.060
  269    HG3  LYS  34           2HG      LYS  34 -11.633 -10.431  -2.471
  270    HD2  LYS  34           1HD      LYS  34 -11.594 -12.565  -1.232
  271    HD3  LYS  34           2HD      LYS  34 -10.909 -11.726   0.181
  272    HE2  LYS  34           1HE      LYS  34 -12.914 -10.303   0.302
  273    HE3  LYS  34           2HE      LYS  34 -13.602 -11.157  -1.099
  274    HZ1  LYS  34           3HZ      LYS  34 -12.947 -12.382   1.504
  275    HZ2  LYS  34           1HZ      LYS  34 -14.463 -12.011   0.975
  276    HZ3  LYS  34           2HZ      LYS  34 -13.583 -13.175   0.206
  277    H    ARG  35           H        ARG  35 -10.539  -7.941  -3.306
  278    HA   ARG  35           HA       ARG  35  -8.764  -5.828  -2.583
  279    HB2  ARG  35           1HB      ARG  35 -11.742  -5.946  -2.633
  280    HB3  ARG  35           2HB      ARG  35 -10.797  -4.485  -2.259
  281    HG2  ARG  35           1HG      ARG  35  -9.760  -4.559  -4.467
  282    HG3  ARG  35           2HG      ARG  35 -10.630  -6.065  -4.843
  283    HD2  ARG  35           1HD      ARG  35 -12.736  -4.865  -4.686
  284    HD3  ARG  35           2HD      ARG  35 -11.842  -3.363  -4.361
  285    HE   ARG  35           HE       ARG  35 -10.976  -4.321  -6.942
  286   HH11  ARG  35          1HH1      ARG  35 -13.925  -3.168  -5.480
  287   HH12  ARG  35          2HH1      ARG  35 -14.450  -2.532  -7.027
  288   HH21  ARG  35          1HH2      ARG  35 -11.567  -3.606  -8.721
  289   HH22  ARG  35          2HH2      ARG  35 -13.107  -2.782  -8.877
  290    H    GLU  36           H        GLU  36 -11.099  -7.663  -0.637
  291    HA   GLU  36           HA       GLU  36 -10.723  -6.201   1.796
  292    HB2  GLU  36           1HB      GLU  36 -12.532  -7.811   1.403
  293    HB3  GLU  36           2HB      GLU  36 -11.336  -9.131   1.373
  294    HG2  GLU  36           1HG      GLU  36 -10.785  -8.626   3.805
  295    HG3  GLU  36           2HG      GLU  36 -11.969  -7.308   3.657
  296    H    VAL  37           H        VAL  37  -9.070  -9.118   0.569
  297    HA   VAL  37           HA       VAL  37  -7.325  -9.436   2.839
  298    HB   VAL  37           HB       VAL  37  -6.990 -10.235  -0.080
  299   HG11  VAL  37          1HG1      VAL  37  -5.205 -11.737   0.742
  300   HG12  VAL  37          2HG1      VAL  37  -4.799 -10.032   1.046
  301   HG13  VAL  37          3HG1      VAL  37  -5.387 -11.057   2.377
  302   HG21  VAL  37          3HG2      VAL  37  -8.872 -11.306   1.007
  303   HG22  VAL  37          1HG2      VAL  37  -7.560 -12.473   0.720
  304   HG23  VAL  37          2HG2      VAL  37  -7.826 -11.819   2.353
  305    H    LEU  38           H        LEU  38  -6.899  -7.629  -0.189
  306    HA   LEU  38           HA       LEU  38  -4.275  -6.675   0.365
  307    HB2  LEU  38           1HB      LEU  38  -5.244  -6.481  -1.685
  308    HB3  LEU  38           2HB      LEU  38  -6.598  -5.434  -1.201
  309    HG   LEU  38           HG       LEU  38  -4.923  -3.669  -0.584
  310   HD11  LEU  38          1HD1      LEU  38  -2.607  -3.904  -1.520
  311   HD12  LEU  38          2HD1      LEU  38  -2.950  -5.171  -0.320
  312   HD13  LEU  38          3HD1      LEU  38  -3.007  -5.552  -2.057
  313   HD21  LEU  38          3HD2      LEU  38  -6.121  -3.567  -2.690
  314   HD22  LEU  38          1HD2      LEU  38  -4.458  -2.970  -2.907
  315   HD23  LEU  38          2HD2      LEU  38  -4.901  -4.602  -3.468
  316    H    LEU  39           H        LEU  39  -7.441  -5.347   1.297
  317    HA   LEU  39           HA       LEU  39  -6.361  -3.011   2.586
  318    HB2  LEU  39           1HB      LEU  39  -8.824  -4.596   2.833
  319    HB3  LEU  39           2HB      LEU  39  -8.691  -3.107   3.796
  320    HG   LEU  39           HG       LEU  39  -8.611  -3.281   0.758
  321   HD11  LEU  39          1HD1      LEU  39 -10.831  -2.116   0.877
  322   HD12  LEU  39          2HD1      LEU  39 -10.887  -3.696   1.692
  323   HD13  LEU  39          3HD1      LEU  39 -10.764  -2.205   2.652
  324   HD21  LEU  39          3HD2      LEU  39  -7.242  -1.471   1.609
  325   HD22  LEU  39          1HD2      LEU  39  -8.703  -0.814   0.835
  326   HD23  LEU  39          2HD2      LEU  39  -8.590  -0.881   2.609
  327    H    VAL  40           H        VAL  40  -7.002  -6.294   3.710
  328    HA   VAL  40           HA       VAL  40  -6.580  -5.772   6.527
  329    HB   VAL  40           HB       VAL  40  -6.235  -8.285   4.845
  330   HG11  VAL  40          1HG1      VAL  40  -6.152  -9.493   7.000
  331   HG12  VAL  40          2HG1      VAL  40  -4.782  -8.369   6.843
  332   HG13  VAL  40          3HG1      VAL  40  -6.173  -7.942   7.870
  333   HG21  VAL  40          3HG2      VAL  40  -8.522  -7.493   4.980
  334   HG22  VAL  40          1HG2      VAL  40  -8.314  -8.987   5.924
  335   HG23  VAL  40          2HG2      VAL  40  -8.409  -7.415   6.754
  336    H    THR  41           H        THR  41  -4.346  -6.861   3.977
  337    HA   THR  41           HA       THR  41  -2.083  -6.988   5.773
  338    HB   THR  41           HB       THR  41  -2.138  -6.652   2.743
  339    HG1  THR  41           1HG      THR  41  -3.182  -8.572   3.512
  340   HG21  THR  41          3HG2      THR  41   0.047  -7.624   4.628
  341   HG22  THR  41          1HG2      THR  41   0.142  -7.595   2.852
  342   HG23  THR  41          2HG2      THR  41   0.037  -6.069   3.763
  343    H    LEU  42           H        LEU  42  -3.322  -4.474   3.595
  344    HA   LEU  42           HA       LEU  42  -1.219  -2.585   4.097
  345    HB2  LEU  42           1HB      LEU  42  -4.053  -2.443   3.352
  346    HB3  LEU  42           2HB      LEU  42  -3.160  -0.908   3.457
  347    HG   LEU  42           HG       LEU  42  -2.473  -3.230   1.612
  348   HD11  LEU  42          1HD1      LEU  42  -3.259  -1.708  -0.220
  349   HD12  LEU  42          2HD1      LEU  42  -4.571  -2.069   0.927
  350   HD13  LEU  42          3HD1      LEU  42  -3.728  -0.503   1.003
  351   HD21  LEU  42          3HD2      LEU  42  -0.523  -1.956   2.287
  352   HD22  LEU  42          1HD2      LEU  42  -0.895  -1.636   0.578
  353   HD23  LEU  42          2HD2      LEU  42  -1.319  -0.435   1.821
  354    H    THR  43           H        THR  43  -4.258  -3.271   5.785
  355    HA   THR  43           HA       THR  43  -3.989  -1.162   7.729
  356    HB   THR  43           HB       THR  43  -5.371  -3.870   7.943
  357    HG1  THR  43           1HG      THR  43  -7.235  -2.553   7.489
  358   HG21  THR  43          3HG2      THR  43  -5.644  -1.354   9.635
  359   HG22  THR  43          1HG2      THR  43  -6.632  -2.825   9.792
  360   HG23  THR  43          2HG2      THR  43  -4.890  -2.879  10.156
  361    H    ARG  44           H        ARG  44  -2.793  -4.494   7.613
  362    HA   ARG  44           HA       ARG  44  -1.729  -4.519  10.287
  363    HB2  ARG  44           1HB      ARG  44  -1.053  -6.100   7.854
  364    HB3  ARG  44           2HB      ARG  44  -0.248  -6.305   9.427
  365    HG2  ARG  44           1HG      ARG  44  -2.364  -6.905  10.471
  366    HG3  ARG  44           2HG      ARG  44  -3.227  -6.611   8.942
  367    HD2  ARG  44           1HD      ARG  44  -2.033  -8.440   7.914
  368    HD3  ARG  44           2HD      ARG  44  -1.159  -8.730   9.436
  369    HE   ARG  44           HE       ARG  44  -3.966  -9.075  10.001
  370   HH11  ARG  44          1HH1      ARG  44  -1.544 -10.594   8.005
  371   HH12  ARG  44          2HH1      ARG  44  -2.368 -12.132   8.167
  372   HH21  ARG  44          1HH2      ARG  44  -4.925 -10.827  10.187
  373   HH22  ARG  44          2HH2      ARG  44  -4.296 -12.267   9.409
  374    H    LEU  45           H        LEU  45  -0.328  -3.573   7.161
  375    HA   LEU  45           HA       LEU  45   2.247  -2.859   8.271
  376    HB2  LEU  45           1HB      LEU  45   0.697  -2.087   5.895
  377    HB3  LEU  45           2HB      LEU  45   2.353  -1.456   6.067
  378    HG   LEU  45           HG       LEU  45   1.566  -4.389   5.854
  379   HD11  LEU  45          1HD1      LEU  45   2.724  -4.280   3.631
  380   HD12  LEU  45          2HD1      LEU  45   1.343  -3.159   3.696
  381   HD13  LEU  45          3HD1      LEU  45   3.002  -2.540   3.879
  382   HD21  LEU  45          3HD2      LEU  45   3.516  -4.072   7.259
  383   HD22  LEU  45          1HD2      LEU  45   3.996  -4.808   5.712
  384   HD23  LEU  45          2HD2      LEU  45   4.295  -3.078   6.005
  385    H    HIS  46           H        HIS  46  -0.782  -1.105   7.780
  386    HA   HIS  46           HA       HIS  46   0.314   1.490   8.430
  387    HB2  HIS  46           1HB      HIS  46  -1.814   1.252   7.185
  388    HB3  HIS  46           2HB      HIS  46  -2.558   0.470   8.600
  389    HD1  HIS  46           1HD      HIS  46  -0.616   3.735   8.124
  390    HD2  HIS  46           2HD      HIS  46  -4.239   2.367   9.784
  391    HE1  HIS  46           1HE      HIS  46  -1.658   5.684   9.164
  392    H    GLN  47           H        GLN  47  -1.216  -1.064  10.349
  393    HA   GLN  47           HA       GLN  47  -1.169   0.507  12.805
  394    HB2  GLN  47           1HB      GLN  47  -1.448  -2.455  12.265
  395    HB3  GLN  47           2HB      GLN  47  -1.585  -1.706  13.872
  396    HG2  GLN  47           1HG      GLN  47  -3.675  -1.307  11.562
  397    HG3  GLN  47           2HG      GLN  47  -3.574  -2.176  13.111
  398   HE21  GLN  47          2HE2      GLN  47  -4.675   0.578  11.604
  399   HE22  GLN  47          1HE2      GLN  47  -4.827   1.617  12.982
  400    H    ARG  48           H        ARG  48   1.000  -1.782  11.236
  401    HA   ARG  48           HA       ARG  48   2.809  -2.054  13.474
  402    HB2  ARG  48           1HB      ARG  48   2.764  -3.652  11.709
  403    HB3  ARG  48           2HB      ARG  48   3.306  -2.415  10.551
  404    HG2  ARG  48           1HG      ARG  48   5.167  -3.851  11.206
  405    HG3  ARG  48           2HG      ARG  48   5.419  -2.185  11.783
  406    HD2  ARG  48           1HD      ARG  48   4.703  -2.852  13.998
  407    HD3  ARG  48           2HD      ARG  48   4.465  -4.516  13.417
  408    HE   ARG  48           HE       ARG  48   7.230  -3.968  12.985
  409   HH11  ARG  48          1HH1      ARG  48   5.115  -3.915  15.756
  410   HH12  ARG  48          2HH1      ARG  48   6.456  -4.352  16.796
  411   HH21  ARG  48          1HH2      ARG  48   8.778  -4.461  14.163
  412   HH22  ARG  48          2HH2      ARG  48   8.545  -4.663  15.888
  413    H    GLY  49           H        GLY  49   2.457   0.323  10.910
  414    HA2  GLY  49           1HA      GLY  49   3.199   2.593  11.318
  415    HA3  GLY  49           2HA      GLY  49   4.532   1.950  12.306
  416    H    VAL  50           H        VAL  50   3.508   0.692   9.160
  417    HA   VAL  50           HA       VAL  50   6.193   1.435   8.030
  418    HB   VAL  50           HB       VAL  50   4.094  -0.547   7.053
  419   HG11  VAL  50          1HG1      VAL  50   5.850  -1.237   5.454
  420   HG12  VAL  50          2HG1      VAL  50   5.405   0.470   5.220
  421   HG13  VAL  50          3HG1      VAL  50   6.914   0.051   6.067
  422   HG21  VAL  50          3HG2      VAL  50   5.159  -1.315   9.089
  423   HG22  VAL  50          1HG2      VAL  50   5.708  -2.268   7.690
  424   HG23  VAL  50          2HG2      VAL  50   6.766  -1.017   8.384
  425    H    ILE  51           H        ILE  51   2.719   1.610   7.316
  426    HA   ILE  51           HA       ILE  51   3.374   3.817   5.383
  427    HB   ILE  51           HB       ILE  51   1.466   3.057   3.997
  428   HG12  ILE  51          1HG1      ILE  51   1.378   0.668   5.823
  429   HG13  ILE  51          2HG1      ILE  51   0.227   2.026   5.839
  430   HG21  ILE  51          1HG2      ILE  51   2.491   1.015   3.056
  431   HG22  ILE  51          2HG2      ILE  51   3.728   2.236   3.437
  432   HG23  ILE  51          3HG2      ILE  51   3.491   0.842   4.518
  433   HD11  ILE  51          3HD1      ILE  51   0.707   0.131   3.513
  434   HD12  ILE  51          1HD1      ILE  51  -0.692   0.098   4.612
  435   HD13  ILE  51          2HD1      ILE  51  -0.442   1.490   3.530
  436    H    TYR  52           H        TYR  52   1.576   5.233   4.893
  437    HA   TYR  52           HA       TYR  52  -0.363   5.479   7.148
  438    HB2  TYR  52           1HB      TYR  52   0.116   7.774   7.485
  439    HB3  TYR  52           2HB      TYR  52   1.638   6.864   7.645
  440    HD1  TYR  52           2HD      TYR  52   3.368   7.024   5.885
  441    HD2  TYR  52           1HD      TYR  52  -0.180   9.384   5.714
  442    HE1  TYR  52           2HE      TYR  52   4.430   8.480   4.193
  443    HE2  TYR  52           1HE      TYR  52   0.871  10.854   4.018
  444    HH   TYR  52           HH       TYR  52   4.193  10.301   2.846
  445    H    ARG  53           H        ARG  53  -2.151   6.852   6.734
  446    HA   ARG  53           HA       ARG  53  -2.925   6.697   3.867
  447    HB2  ARG  53           1HB      ARG  53  -4.575   7.250   6.294
  448    HB3  ARG  53           2HB      ARG  53  -5.157   7.160   4.614
  449    HG2  ARG  53           1HG      ARG  53  -4.781   4.847   4.479
  450    HG3  ARG  53           2HG      ARG  53  -3.708   4.849   5.900
  451    HD2  ARG  53           1HD      ARG  53  -6.597   5.546   6.134
  452    HD3  ARG  53           2HD      ARG  53  -6.045   3.855   6.096
  453    HE   ARG  53           HE       ARG  53  -4.598   4.915   8.247
  454   HH11  ARG  53          1HH1      ARG  53  -7.984   5.117   7.435
  455   HH12  ARG  53          2HH1      ARG  53  -8.393   5.193   9.136
  456   HH21  ARG  53          1HH2      ARG  53  -5.051   5.012  10.199
  457   HH22  ARG  53          2HH2      ARG  53  -6.722   5.135  10.715
  458    H    LYS  54           H        LYS  54  -2.690   8.321   2.574
  459    HA   LYS  54           HA       LYS  54  -2.866  11.089   3.722
  460    HB2  LYS  54           1HB      LYS  54  -0.726  10.511   2.665
  461    HB3  LYS  54           2HB      LYS  54  -1.590  10.116   1.160
  462    HG2  LYS  54           1HG      LYS  54  -2.369  12.468   1.020
  463    HG3  LYS  54           2HG      LYS  54  -1.423  12.846   2.480
  464    HD2  LYS  54           1HD      LYS  54   0.643  12.197   1.326
  465    HD3  LYS  54           2HD      LYS  54  -0.292  11.782  -0.130
  466    HE2  LYS  54           1HE      LYS  54  -1.042  14.113  -0.317
  467    HE3  LYS  54           2HE      LYS  54  -0.116  14.530   1.144
  468    HZ1  LYS  54           3HZ      LYS  54   1.029  13.530  -1.386
  469    HZ2  LYS  54           1HZ      LYS  54   1.081  15.093  -0.860
  470    HZ3  LYS  54           2HZ      LYS  54   1.888  13.916  -0.031
  471    H    TRP  55           H        TRP  55  -4.578  12.227   3.333
  472    HA   TRP  55           HA       TRP  55  -6.489  11.240   1.274
  473    HB2  TRP  55           1HB      TRP  55  -6.726  13.034   3.707
  474    HB3  TRP  55           2HB      TRP  55  -7.984  13.012   2.449
  475    HD1  TRP  55           HD       TRP  55  -9.455  11.013   2.292
  476    HE1  TRP  55           1HE      TRP  55 -10.003   8.937   3.933
  477    HE3  TRP  55           3HE      TRP  55  -5.484  11.493   5.428
  478    HZ2  TRP  55           2HZ      TRP  55  -8.810   7.827   6.164
  479    HZ3  TRP  55           3HZ      TRP  55  -5.203   9.956   7.274
  480    HH2  TRP  55           HH       TRP  55  -6.799   8.133   7.686
  481    H    ARG  56           H        ARG  56  -6.605  12.089  -0.637
  482    HA   ARG  56           HA       ARG  56  -5.880  14.986  -0.942
  483    HB2  ARG  56           1HB      ARG  56  -4.407  13.516  -2.142
  484    HB3  ARG  56           2HB      ARG  56  -5.800  12.844  -3.019
  485    HG2  ARG  56           1HG      ARG  56  -6.247  15.015  -4.031
  486    HG3  ARG  56           2HG      ARG  56  -4.918  15.746  -3.099
  487    HD2  ARG  56           1HD      ARG  56  -3.334  14.333  -4.276
  488    HD3  ARG  56           2HD      ARG  56  -4.672  13.642  -5.226
  489    HE   ARG  56           HE       ARG  56  -4.623  16.496  -5.722
  490   HH11  ARG  56          1HH1      ARG  56  -2.612  13.710  -6.320
  491   HH12  ARG  56          2HH1      ARG  56  -1.992  14.463  -7.777
  492   HH21  ARG  56          1HH2      ARG  56  -3.917  17.374  -7.382
  493   HH22  ARG  56          2HH2      ARG  56  -2.735  16.553  -8.383
  494    H    HIS  57           H        HIS  57  -7.352  16.380  -1.508
  495    HA   HIS  57           HA       HIS  57 -10.119  15.586  -1.761
  496    HB2  HIS  57           1HB      HIS  57  -9.286  17.826  -0.871
  497    HB3  HIS  57           2HB      HIS  57  -8.905  18.263  -2.553
  498    HD1  HIS  57           1HD      HIS  57 -10.969  18.408  -4.219
  499    HD2  HIS  57           2HD      HIS  57 -12.029  18.154  -0.149
  500    HE1  HIS  57           1HE      HIS  57 -13.274  19.203  -4.073
  501    H    PHE  58           H        PHE  58 -11.393  15.221  -3.426
  502    HA   PHE  58           HA       PHE  58 -10.562  15.898  -6.165
  503    HB2  PHE  58           1HB      PHE  58  -9.319  13.779  -5.768
  504    HB3  PHE  58           2HB      PHE  58 -10.843  12.980  -5.328
  505    HD1  PHE  58           1HD      PHE  58  -9.183  14.814  -8.108
  506    HD2  PHE  58           2HD      PHE  58 -12.109  11.934  -6.928
  507    HE1  PHE  58           1HE      PHE  58  -9.554  14.222 -10.479
  508    HE2  PHE  58           2HE      PHE  58 -12.481  11.336  -9.298
  509    HZ   PHE  58           HZ       PHE  58 -11.203  12.483 -11.074
  510    H    SER  59           H        SER  59 -12.288  16.730  -7.012
  511    HA   SER  59           HA       SER  59 -14.532  16.860  -7.810
  512    HB2  SER  59           1HB      SER  59 -14.488  13.960  -7.235
  513    HB3  SER  59           2HB      SER  59 -15.710  14.868  -8.154
  514    HG   SER  59           HG       SER  59 -14.120  13.913  -9.497
  515    H    GLY  60           H        GLY  60 -13.881  17.311  -4.897
  516    HA2  GLY  60           1HA      GLY  60 -15.448  18.328  -3.421
  517    HA3  GLY  60           2HA      GLY  60 -16.733  17.289  -4.082
  518    H    ARG  61           H        ARG  61 -14.195  15.270  -3.698
  519    HA   ARG  61           HA       ARG  61 -14.834  14.621  -0.852
  520    HB2  ARG  61           1HB      ARG  61 -15.057  12.702  -3.126
  521    HB3  ARG  61           2HB      ARG  61 -15.053  12.279  -1.398
  522    HG2  ARG  61           1HG      ARG  61 -17.090  14.107  -2.702
  523    HG3  ARG  61           2HG      ARG  61 -17.331  12.361  -2.453
  524    HD2  ARG  61           1HD      ARG  61 -17.079  12.705  -0.049
  525    HD3  ARG  61           2HD      ARG  61 -16.935  14.455  -0.340
  526    HE   ARG  61           HE       ARG  61 -19.514  12.953  -0.440
  527   HH11  ARG  61          1HH1      ARG  61 -17.844  15.937  -1.125
  528   HH12  ARG  61          2HH1      ARG  61 -19.379  16.776  -1.233
  529   HH21  ARG  61          1HH2      ARG  61 -21.277  13.902  -0.549
  530   HH22  ARG  61          2HH2      ARG  61 -21.337  15.619  -0.903
  531    H    LYS  62           H        LYS  62 -13.183  14.051   0.336
  532    HA   LYS  62           HA       LYS  62 -10.533  13.796  -0.946
  533    HB2  LYS  62           1HB      LYS  62 -11.439  13.759   1.936
  534    HB3  LYS  62           2HB      LYS  62  -9.748  13.619   1.401
  535    HG2  LYS  62           1HG      LYS  62  -9.863  15.855   0.399
  536    HG3  LYS  62           2HG      LYS  62 -11.567  15.997   0.892
  537    HD2  LYS  62           1HD      LYS  62 -10.902  15.819   3.256
  538    HD3  LYS  62           2HD      LYS  62  -9.198  15.670   2.764
  539    HE2  LYS  62           1HE      LYS  62  -9.297  17.898   1.736
  540    HE3  LYS  62           2HE      LYS  62 -11.000  18.049   2.223
  541    HZ1  LYS  62           3HZ      LYS  62  -8.709  17.777   4.062
  542    HZ2  LYS  62           1HZ      LYS  62  -9.535  19.173   3.757
  543    HZ3  LYS  62           2HZ      LYS  62 -10.290  17.916   4.514
  544    H    TYR  63           H        TYR  63  -9.593  12.012  -1.509
  545    HA   TYR  63           HA       TYR  63 -10.542   9.457  -0.248
  546    HB2  TYR  63           1HB      TYR  63  -9.415   9.931  -3.015
  547    HB3  TYR  63           2HB      TYR  63  -9.862   8.353  -2.321
  548    HD1  TYR  63           2HD      TYR  63 -12.265   7.850  -1.864
  549    HD2  TYR  63           1HD      TYR  63 -11.082  11.379  -3.942
  550    HE1  TYR  63           2HE      TYR  63 -14.581   8.135  -2.677
  551    HE2  TYR  63           1HE      TYR  63 -13.398  11.680  -4.766
  552    HH   TYR  63           HH       TYR  63 -16.009   9.401  -3.921
  553    H    ARG  64           H        ARG  64  -9.124   8.026   0.519
  554    HA   ARG  64           HA       ARG  64  -6.488   9.106   1.193
  555    HB2  ARG  64           1HB      ARG  64  -6.194   7.346   2.604
  556    HB3  ARG  64           2HB      ARG  64  -7.901   7.826   2.745
  557    HG2  ARG  64           1HG      ARG  64  -8.529   5.926   1.286
  558    HG3  ARG  64           2HG      ARG  64  -6.821   5.430   1.228
  559    HD2  ARG  64           1HD      ARG  64  -6.879   5.132   3.662
  560    HD3  ARG  64           2HD      ARG  64  -8.618   5.501   3.628
  561    HE   ARG  64           HE       ARG  64  -7.458   2.892   2.811
  562   HH11  ARG  64          1HH1      ARG  64 -10.242   4.983   2.645
  563   HH12  ARG  64          2HH1      ARG  64 -11.254   3.613   2.228
  564   HH21  ARG  64          1HH2      ARG  64  -8.602   1.311   2.342
  565   HH22  ARG  64          2HH2      ARG  64 -10.320   1.519   2.057
  566    H    GLU  65           H        GLU  65  -4.470   8.350   0.632
  567    HA   GLU  65           HA       GLU  65  -4.416   5.880  -1.051
  568    HB2  GLU  65           1HB      GLU  65  -2.617   6.733  -2.371
  569    HB3  GLU  65           2HB      GLU  65  -4.023   7.818  -2.505
  570    HG2  GLU  65           1HG      GLU  65  -2.848   9.360  -0.788
  571    HG3  GLU  65           2HG      GLU  65  -1.515   8.190  -0.929
  572    H    TYR  66           H        TYR  66  -2.443   4.677  -0.936
  573    HA   TYR  66           HA       TYR  66  -1.544   4.720   1.907
  574    HB2  TYR  66           1HB      TYR  66  -1.483   2.597  -0.243
  575    HB3  TYR  66           2HB      TYR  66  -0.770   2.411   1.377
  576    HD1  TYR  66           2HD      TYR  66  -2.220   2.241   3.358
  577    HD2  TYR  66           1HD      TYR  66  -3.885   2.508  -0.558
  578    HE1  TYR  66           2HE      TYR  66  -4.401   1.495   4.247
  579    HE2  TYR  66           1HE      TYR  66  -6.078   1.761   0.315
  580    HH   TYR  66           HH       TYR  66  -6.549   0.911   3.744
  581    H    CYS  67           H        CYS  67   0.272   5.663   2.373
  582    HA   CYS  67           HA       CYS  67   2.429   5.833   0.244
  583    HB2  CYS  67           1HB      CYS  67   1.515   7.658   2.511
  584    HB3  CYS  67           2HB      CYS  67   2.859   7.993   1.394
  585    HG   CYS  67           HG       CYS  67   0.888   9.514   0.895
  586    H    LEU  68           H        LEU  68   4.458   5.236   0.783
  587    HA   LEU  68           HA       LEU  68   5.008   3.862   3.276
  588    HB2  LEU  68           1HB      LEU  68   6.019   3.361   1.238
  589    HB3  LEU  68           2HB      LEU  68   6.898   4.900   1.094
  590    HG   LEU  68           HG       LEU  68   7.994   4.283   3.334
  591   HD11  LEU  68          1HD1      LEU  68   8.107   1.820   3.800
  592   HD12  LEU  68          2HD1      LEU  68   6.436   2.423   3.911
  593   HD13  LEU  68          3HD1      LEU  68   6.967   1.531   2.466
  594   HD21  LEU  68          3HD2      LEU  68   9.197   4.276   1.230
  595   HD22  LEU  68          1HD2      LEU  68   9.717   2.899   2.230
  596   HD23  LEU  68          2HD2      LEU  68   8.607   2.638   0.864
  597    H    LYS  69           H        LYS  69   5.775   4.512   5.138
  598    HA   LYS  69           HA       LYS  69   5.925   7.344   5.735
  599    HB2  LYS  69           1HB      LYS  69   6.597   4.815   7.216
  600    HB3  LYS  69           2HB      LYS  69   6.987   6.418   7.885
  601    HG2  LYS  69           1HG      LYS  69   4.643   7.042   7.886
  602    HG3  LYS  69           2HG      LYS  69   4.204   5.520   7.075
  603    HD2  LYS  69           1HD      LYS  69   3.768   5.523   9.544
  604    HD3  LYS  69           2HD      LYS  69   4.855   4.225   8.996
  605    HE2  LYS  69           1HE      LYS  69   6.795   5.681   9.627
  606    HE3  LYS  69           2HE      LYS  69   5.636   6.835  10.326
  607    HZ1  LYS  69           3HZ      LYS  69   5.989   4.032  11.176
  608    HZ2  LYS  69           1HZ      LYS  69   6.535   5.357  11.992
  609    HZ3  LYS  69           2HZ      LYS  69   4.915   5.102  11.825
  610    H    HIS  70           H        HIS  70   8.453   4.808   5.759
  611    HA   HIS  70           HA       HIS  70  10.398   6.871   4.849
  612    HB2  HIS  70           1HB      HIS  70  10.787   5.101   7.307
  613    HB3  HIS  70           2HB      HIS  70  12.041   6.123   6.562
  614    HD1  HIS  70           1HD      HIS  70  11.630   8.746   6.680
  615    HD2  HIS  70           2HD      HIS  70   9.066   6.470   9.130
  616    HE1  HIS  70           1HE      HIS  70  10.733  10.296   8.342
  617    H    ARG  71           H        ARG  71  11.941   6.184   3.523
  618    HA   ARG  71           HA       ARG  71  11.715   3.466   2.455
  619    HB2  ARG  71           1HB      ARG  71  13.560   5.719   1.813
  620    HB3  ARG  71           2HB      ARG  71  13.602   4.115   1.041
  621    HG2  ARG  71           1HG      ARG  71  11.263   4.457   0.282
  622    HG3  ARG  71           2HG      ARG  71  11.303   6.094   0.984
  623    HD2  ARG  71           1HD      ARG  71  11.630   6.269  -1.339
  624    HD3  ARG  71           2HD      ARG  71  13.176   6.619  -0.532
  625    HE   ARG  71           HE       ARG  71  14.088   4.629  -1.673
  626   HH11  ARG  71          1HH1      ARG  71  10.615   4.671  -1.980
  627   HH12  ARG  71          2HH1      ARG  71  10.700   3.403  -3.186
  628   HH21  ARG  71          1HH2      ARG  71  14.201   3.171  -3.047
  629   HH22  ARG  71          2HH2      ARG  71  12.745   2.545  -3.795
  630    H    ASP  72           H        ASP  72  13.711   5.105   4.793
  631    HA   ASP  72           HA       ASP  72  15.796   3.103   4.920
  632    HB2  ASP  72           1HB      ASP  72  14.812   5.129   7.018
  633    HB3  ASP  72           2HB      ASP  72  16.113   3.918   7.145
  634    H    GLU  73           H        GLU  73  12.641   3.445   6.487
  635    HA   GLU  73           HA       GLU  73  12.943   1.066   8.128
  636    HB2  GLU  73           1HB      GLU  73  10.547   2.615   7.142
  637    HB3  GLU  73           2HB      GLU  73  10.438   1.196   8.211
  638    HG2  GLU  73           1HG      GLU  73  11.748   2.452   9.973
  639    HG3  GLU  73           2HG      GLU  73  11.898   3.746   8.763
  640    H    LEU  74           H        LEU  74  11.601   1.699   4.905
  641    HA   LEU  74           HA       LEU  74  10.744  -1.011   4.431
  642    HB2  LEU  74           1HB      LEU  74   9.974   0.794   3.226
  643    HB3  LEU  74           2HB      LEU  74  11.537   1.237   2.501
  644    HG   LEU  74           HG       LEU  74  11.571  -0.989   1.356
  645   HD11  LEU  74          1HD1      LEU  74   9.408  -2.254   1.215
  646   HD12  LEU  74          2HD1      LEU  74  10.000  -2.171   2.891
  647   HD13  LEU  74          3HD1      LEU  74   8.678  -1.104   2.357
  648   HD21  LEU  74          3HD2      LEU  74  10.868   1.002   0.166
  649   HD22  LEU  74          1HD2      LEU  74   9.912  -0.398  -0.375
  650   HD23  LEU  74          2HD2      LEU  74   9.197   0.792   0.739
  651    H    ALA  75           H        ALA  75  13.821   0.666   3.932
  652    HA   ALA  75           HA       ALA  75  15.191  -1.396   2.570
  653    HB1  ALA  75           1HB      ALA  75  17.241  -0.406   3.515
  654    HB2  ALA  75           2HB      ALA  75  16.130   0.847   2.909
  655    HB3  ALA  75           3HB      ALA  75  16.256   0.537   4.657
  656    H    ASP  76           H        ASP  76  14.632  -0.946   6.052
  657    HA   ASP  76           HA       ASP  76  16.076  -3.323   6.851
  658    HB2  ASP  76           1HB      ASP  76  13.855  -1.739   8.276
  659    HB3  ASP  76           2HB      ASP  76  14.727  -3.195   8.817
  660    H    LEU  77           H        LEU  77  12.732  -2.701   5.883
  661    HA   LEU  77           HA       LEU  77  11.781  -5.366   6.463
  662    HB2  LEU  77           1HB      LEU  77  10.999  -3.234   4.593
  663    HB3  LEU  77           2HB      LEU  77   9.961  -4.672   4.732
  664    HG   LEU  77           HG       LEU  77  10.596  -2.692   6.953
  665   HD11  LEU  77          1HD1      LEU  77   8.164  -2.101   6.775
  666   HD12  LEU  77          2HD1      LEU  77   9.020  -1.785   5.247
  667   HD13  LEU  77          3HD1      LEU  77   8.004  -3.237   5.414
  668   HD21  LEU  77          3HD2      LEU  77  10.327  -4.943   7.808
  669   HD22  LEU  77          1HD2      LEU  77   8.924  -3.949   8.268
  670   HD23  LEU  77          2HD2      LEU  77   8.786  -5.123   6.936
  671    H    GLU  78           H        GLU  78  13.447  -3.926   3.723
  672    HA   GLU  78           HA       GLU  78  13.103  -6.257   2.004
  673    HB2  GLU  78           1HB      GLU  78  14.995  -3.907   1.970
  674    HB3  GLU  78           2HB      GLU  78  14.993  -5.194   0.741
  675    HG2  GLU  78           1HG      GLU  78  12.627  -4.551   0.111
  676    HG3  GLU  78           2HG      GLU  78  12.723  -3.380   1.445
  677    H    HIS  79           H        HIS  79  15.570  -5.147   4.284
  678    HA   HIS  79           HA       HIS  79  17.553  -7.100   3.720
  679    HB2  HIS  79           1HB      HIS  79  16.782  -5.764   6.351
  680    HB3  HIS  79           2HB      HIS  79  18.239  -6.759   6.122
  681    HD2  HIS  79           2HD      HIS  79  18.726  -5.062   2.974
  682    HE1  HIS  79           1HE      HIS  79  19.615  -2.039   5.824
  683    HE2  HIS  79           2HE      HIS  79  19.813  -2.836   3.327
  Start of MODEL   20
    1    H    LYS   3           H        LYS   3   9.115 -14.550  -3.939
    2    HA   LYS   3           HA       LYS   3   6.905 -16.047  -2.988
    3    HB2  LYS   3           1HB      LYS   3   8.804 -15.080  -0.846
    4    HB3  LYS   3           2HB      LYS   3   7.121 -15.586  -0.569
    5    HG2  LYS   3           1HG      LYS   3   7.679 -17.852  -1.385
    6    HG3  LYS   3           2HG      LYS   3   9.366 -17.341  -1.622
    7    HD2  LYS   3           1HD      LYS   3   9.566 -16.862   0.782
    8    HD3  LYS   3           2HD      LYS   3   7.873 -17.355   1.024
    9    HE2  LYS   3           1HE      LYS   3   8.418 -19.616   0.228
   10    HE3  LYS   3           2HE      LYS   3  10.110 -19.124  -0.014
   11    HZ1  LYS   3           3HZ      LYS   3   8.691 -19.169   2.572
   12    HZ2  LYS   3           1HZ      LYS   3   9.807 -20.275   2.072
   13    HZ3  LYS   3           2HZ      LYS   3  10.260 -18.713   2.349
   14    H    ALA   4           H        ALA   4   8.789 -13.139  -3.129
   15    HA   ALA   4           HA       ALA   4   6.838 -11.365  -1.998
   16    HB1  ALA   4           1HB      ALA   4   8.123  -9.590  -3.126
   17    HB2  ALA   4           2HB      ALA   4   9.192 -10.729  -2.275
   18    HB3  ALA   4           3HB      ALA   4   9.017 -10.823  -4.043
   19    H    LYS   5           H        LYS   5   7.142 -12.881  -5.115
   20    HA   LYS   5           HA       LYS   5   5.328 -11.105  -6.522
   21    HB2  LYS   5           1HB      LYS   5   6.197 -13.958  -7.000
   22    HB3  LYS   5           2HB      LYS   5   5.138 -13.038  -8.095
   23    HG2  LYS   5           1HG      LYS   5   6.929 -11.392  -8.455
   24    HG3  LYS   5           2HG      LYS   5   7.987 -12.294  -7.346
   25    HD2  LYS   5           1HD      LYS   5   7.892 -14.249  -8.833
   26    HD3  LYS   5           2HD      LYS   5   6.816 -13.362  -9.938
   27    HE2  LYS   5           1HE      LYS   5   8.572 -11.694 -10.326
   28    HE3  LYS   5           2HE      LYS   5   9.649 -12.561  -9.205
   29    HZ1  LYS   5           3HZ      LYS   5   8.575 -13.641 -11.731
   30    HZ2  LYS   5           1HZ      LYS   5  10.119 -13.111 -11.495
   31    HZ3  LYS   5           2HZ      LYS   5   9.573 -14.445 -10.694
   32    H    LEU   6           H        LEU   6   4.904 -13.682  -4.256
   33    HA   LEU   6           HA       LEU   6   2.038 -13.971  -5.030
   34    HB2  LEU   6           1HB      LEU   6   3.802 -15.379  -3.134
   35    HB3  LEU   6           2HB      LEU   6   2.122 -15.916  -3.369
   36    HG   LEU   6           HG       LEU   6   4.362 -15.973  -5.430
   37   HD11  LEU   6          1HD1      LEU   6   4.049 -18.458  -5.295
   38   HD12  LEU   6          2HD1      LEU   6   4.504 -17.777  -3.715
   39   HD13  LEU   6          3HD1      LEU   6   2.810 -18.218  -4.040
   40   HD21  LEU   6          3HD2      LEU   6   2.244 -15.429  -6.477
   41   HD22  LEU   6          1HD2      LEU   6   2.725 -17.087  -6.907
   42   HD23  LEU   6          2HD2      LEU   6   1.462 -16.815  -5.681
   43    H    SER   7           H        SER   7   4.126 -12.796  -2.469
   44    HA   SER   7           HA       SER   7   2.036 -12.397  -0.456
   45    HB2  SER   7           1HB      SER   7   4.142 -12.673   0.309
   46    HB3  SER   7           2HB      SER   7   4.797 -11.402  -0.749
   47    HG   SER   7           HG       SER   7   2.981 -11.076   1.404
   48    H    LEU   8           H        LEU   8   0.408 -10.993  -0.705
   49    HA   LEU   8           HA       LEU   8   0.459  -8.724  -2.486
   50    HB2  LEU   8           1HB      LEU   8  -1.135  -9.455  -0.122
   51    HB3  LEU   8           2HB      LEU   8  -1.624  -8.049  -1.096
   52    HG   LEU   8           HG       LEU   8  -1.506 -10.942  -2.036
   53   HD11  LEU   8          1HD1      LEU   8  -4.000 -10.722  -2.194
   54   HD12  LEU   8          2HD1      LEU   8  -3.433 -10.468  -0.527
   55   HD13  LEU   8          3HD1      LEU   8  -3.881  -9.073  -1.538
   56   HD21  LEU   8          3HD2      LEU   8  -0.925  -9.402  -3.817
   57   HD22  LEU   8          1HD2      LEU   8  -2.537 -10.095  -4.116
   58   HD23  LEU   8          2HD2      LEU   8  -2.382  -8.434  -3.495
   59    H    THR   9           H        THR   9   1.233  -9.141   0.930
   60    HA   THR   9           HA       THR   9   1.527  -6.364   1.573
   61    HB   THR   9           HB       THR   9   3.031  -8.772   2.681
   62    HG1  THR   9           1HG      THR   9   1.413  -8.579   4.342
   63   HG21  THR   9          3HG2      THR   9   2.629  -5.970   3.802
   64   HG22  THR   9          1HG2      THR   9   3.430  -7.320   4.639
   65   HG23  THR   9          2HG2      THR   9   4.156  -6.626   3.168
   66    H    GLN  10           H        GLN  10   3.890  -8.736   0.349
   67    HA   GLN  10           HA       GLN  10   6.081  -6.881   0.247
   68    HB2  GLN  10           1HB      GLN  10   5.460  -9.397  -1.307
   69    HB3  GLN  10           2HB      GLN  10   6.990  -8.495  -1.447
   70    HG2  GLN  10           1HG      GLN  10   6.100 -10.033   1.148
   71    HG3  GLN  10           2HG      GLN  10   7.250 -10.278  -0.188
   72   HE21  GLN  10          2HE2      GLN  10   6.928  -9.237   2.946
   73   HE22  GLN  10          1HE2      GLN  10   8.326  -8.218   3.057
   74    H    LEU  11           H        LEU  11   3.678  -7.849  -2.191
   75    HA   LEU  11           HA       LEU  11   4.794  -6.380  -4.359
   76    HB2  LEU  11           1HB      LEU  11   2.072  -7.154  -3.569
   77    HB3  LEU  11           2HB      LEU  11   2.293  -6.391  -5.161
   78    HG   LEU  11           HG       LEU  11   3.551  -9.008  -4.249
   79   HD11  LEU  11          1HD1      LEU  11   2.018 -10.052  -5.937
   80   HD12  LEU  11          2HD1      LEU  11   1.102  -9.209  -4.666
   81   HD13  LEU  11          3HD1      LEU  11   1.312  -8.452  -6.263
   82   HD21  LEU  11          3HD2      LEU  11   4.970  -7.795  -5.796
   83   HD22  LEU  11          1HD2      LEU  11   4.276  -9.223  -6.601
   84   HD23  LEU  11          2HD2      LEU  11   3.616  -7.603  -6.934
   85    H    ILE  12           H        ILE  12   2.414  -5.389  -1.904
   86    HA   ILE  12           HA       ILE  12   2.000  -2.730  -2.889
   87    HB   ILE  12           HB       ILE  12   1.918  -3.888  -0.069
   88   HG12  ILE  12          1HG1      ILE  12  -0.328  -2.994  -1.851
   89   HG13  ILE  12          2HG1      ILE  12   0.288  -4.663  -1.788
   90   HG21  ILE  12          1HG2      ILE  12   0.763  -1.801   0.581
   91   HG22  ILE  12          2HG2      ILE  12   2.420  -1.468   0.027
   92   HG23  ILE  12          3HG2      ILE  12   1.040  -1.140  -1.047
   93   HD11  ILE  12          3HD1      ILE  12  -0.898  -3.118   0.544
   94   HD12  ILE  12          1HD1      ILE  12  -1.714  -4.401  -0.377
   95   HD13  ILE  12          2HD1      ILE  12  -0.281  -4.785   0.606
   96    H    LEU  13           H        LEU  13   4.464  -3.987  -0.664
   97    HA   LEU  13           HA       LEU  13   5.522  -1.322  -0.153
   98    HB2  LEU  13           1HB      LEU  13   6.516  -4.066   0.244
   99    HB3  LEU  13           2HB      LEU  13   7.432  -2.699   0.921
  100    HG   LEU  13           HG       LEU  13   4.616  -3.567   1.686
  101   HD11  LEU  13          1HD1      LEU  13   5.664  -4.036   3.916
  102   HD12  LEU  13          2HD1      LEU  13   6.422  -5.005   2.630
  103   HD13  LEU  13          3HD1      LEU  13   7.246  -3.557   3.258
  104   HD21  LEU  13          3HD2      LEU  13   4.814  -1.151   1.729
  105   HD22  LEU  13          1HD2      LEU  13   4.730  -1.784   3.391
  106   HD23  LEU  13          2HD2      LEU  13   6.293  -1.260   2.714
  107    H    ILE  14           H        ILE  14   6.169  -3.854  -2.477
  108    HA   ILE  14           HA       ILE  14   8.721  -2.833  -3.393
  109    HB   ILE  14           HB       ILE  14   6.570  -4.529  -4.730
  110   HG12  ILE  14          1HG1      ILE  14   9.332  -5.302  -3.853
  111   HG13  ILE  14          2HG1      ILE  14   7.904  -5.414  -2.798
  112   HG21  ILE  14          1HG2      ILE  14   8.232  -4.961  -6.507
  113   HG22  ILE  14          2HG2      ILE  14   7.800  -3.237  -6.441
  114   HG23  ILE  14          3HG2      ILE  14   9.344  -3.793  -5.752
  115   HD11  ILE  14          3HD1      ILE  14   8.266  -6.838  -5.458
  116   HD12  ILE  14          1HD1      ILE  14   8.404  -7.584  -3.851
  117   HD13  ILE  14          2HD1      ILE  14   6.837  -6.948  -4.404
  118    H    ARG  15           H        ARG  15   5.416  -2.338  -4.623
  119    HA   ARG  15           HA       ARG  15   6.261  -0.512  -6.688
  120    HB2  ARG  15           1HB      ARG  15   4.183  -1.739  -6.760
  121    HB3  ARG  15           2HB      ARG  15   3.573  -0.754  -5.410
  122    HG2  ARG  15           1HG      ARG  15   3.764   1.266  -6.784
  123    HG3  ARG  15           2HG      ARG  15   4.404   0.297  -8.134
  124    HD2  ARG  15           1HD      ARG  15   2.303  -0.898  -8.265
  125    HD3  ARG  15           2HD      ARG  15   1.666   0.084  -6.924
  126    HE   ARG  15           HE       ARG  15   1.504   1.990  -8.555
  127   HH11  ARG  15          1HH1      ARG  15   2.747  -0.917 -10.026
  128   HH12  ARG  15          2HH1      ARG  15   2.377  -0.278 -11.615
  129   HH21  ARG  15          1HH2      ARG  15   1.081   2.738 -10.369
  130   HH22  ARG  15          2HH2      ARG  15   1.427   1.806 -11.812
  131    H    LEU  16           H        LEU  16   5.212  -0.052  -3.339
  132    HA   LEU  16           HA       LEU  16   5.059   2.842  -3.580
  133    HB2  LEU  16           1HB      LEU  16   5.242   0.922  -1.359
  134    HB3  LEU  16           2HB      LEU  16   5.032   2.647  -0.978
  135    HG   LEU  16           HG       LEU  16   3.088   0.828  -2.447
  136   HD11  LEU  16          1HD1      LEU  16   1.575   1.385  -0.525
  137   HD12  LEU  16          2HD1      LEU  16   3.074   0.610   0.036
  138   HD13  LEU  16          3HD1      LEU  16   2.873   2.372   0.190
  139   HD21  LEU  16          3HD2      LEU  16   3.113   3.014  -3.494
  140   HD22  LEU  16          1HD2      LEU  16   1.600   2.795  -2.583
  141   HD23  LEU  16          2HD2      LEU  16   2.902   3.805  -1.913
  142    H    SER  17           H        SER  17   7.583   0.552  -2.800
  143    HA   SER  17           HA       SER  17   9.523   2.396  -1.670
  144    HB2  SER  17           1HB      SER  17   9.701   0.104  -1.339
  145    HB3  SER  17           2HB      SER  17   9.888  -0.176  -3.085
  146    HG   SER  17           HG       SER  17  11.800   0.221  -1.447
  147    H    ASN  18           H        ASN  18   8.804   1.256  -4.990
  148    HA   ASN  18           HA       ASN  18  11.059   2.751  -6.124
  149    HB2  ASN  18           1HB      ASN  18   8.848   1.193  -7.663
  150    HB3  ASN  18           2HB      ASN  18  10.236   2.216  -8.103
  151   HD21  ASN  18          2HD2      ASN  18   9.598  -0.667  -8.529
  152   HD22  ASN  18          1HD2      ASN  18  10.981  -1.522  -7.932
  153    H    ARG  19           H        ARG  19   7.563   3.184  -5.845
  154    HA   ARG  19           HA       ARG  19   7.757   5.593  -7.601
  155    HB2  ARG  19           1HB      ARG  19   5.392   3.991  -6.747
  156    HB3  ARG  19           2HB      ARG  19   5.334   5.508  -7.673
  157    HG2  ARG  19           1HG      ARG  19   6.569   4.469  -9.502
  158    HG3  ARG  19           2HG      ARG  19   6.715   2.960  -8.569
  159    HD2  ARG  19           1HD      ARG  19   4.295   2.717  -8.625
  160    HD3  ARG  19           2HD      ARG  19   4.186   4.196  -9.609
  161    HE   ARG  19           HE       ARG  19   5.002   1.542 -10.679
  162   HH11  ARG  19          1HH1      ARG  19   4.933   4.985 -11.228
  163   HH12  ARG  19          2HH1      ARG  19   5.174   4.722 -12.944
  164   HH21  ARG  19          1HH2      ARG  19   5.271   1.224 -12.642
  165   HH22  ARG  19          2HH2      ARG  19   5.365   2.579 -13.753
  166    H    GLY  20           H        GLY  20   7.544   4.679  -4.333
  167    HA2  GLY  20           1HA      GLY  20   7.840   6.205  -2.556
  168    HA3  GLY  20           2HA      GLY  20   7.340   7.536  -3.622
  169    H    CYS  21           H        CYS  21   4.940   7.077  -4.487
  170    HA   CYS  21           HA       CYS  21   3.146   6.134  -2.265
  171    HB2  CYS  21           1HB      CYS  21   3.832   8.454  -1.765
  172    HB3  CYS  21           2HB      CYS  21   3.342   8.959  -3.400
  173    HG   CYS  21           HG       CYS  21   1.740   9.889  -1.665
  174    H    GLN  22           H        GLN  22   1.404   5.173  -3.105
  175    HA   GLN  22           HA       GLN  22   0.490   5.970  -5.838
  176    HB2  GLN  22           1HB      GLN  22   0.973   3.185  -4.768
  177    HB3  GLN  22           2HB      GLN  22  -0.034   3.532  -6.194
  178    HG2  GLN  22           1HG      GLN  22   3.052   4.148  -6.133
  179    HG3  GLN  22           2HG      GLN  22   2.057   2.766  -6.649
  180   HE21  GLN  22          2HE2      GLN  22   2.284   6.331  -7.035
  181   HE22  GLN  22          1HE2      GLN  22   1.874   6.342  -8.719
  182    H    THR  23           H        THR  23  -1.689   5.377  -6.345
  183    HA   THR  23           HA       THR  23  -3.461   5.800  -4.049
  184    HB   THR  23           HB       THR  23  -5.260   5.842  -5.673
  185    HG1  THR  23           1HG      THR  23  -4.489   5.455  -7.981
  186   HG21  THR  23          3HG2      THR  23  -2.775   7.167  -6.830
  187   HG22  THR  23          1HG2      THR  23  -4.458   7.596  -7.218
  188   HG23  THR  23          2HG2      THR  23  -3.829   7.855  -5.573
  189    H    LEU  24           H        LEU  24  -5.314   4.486  -3.574
  190    HA   LEU  24           HA       LEU  24  -4.799   1.726  -3.173
  191    HB2  LEU  24           1HB      LEU  24  -6.391   2.939  -2.030
  192    HB3  LEU  24           2HB      LEU  24  -7.464   3.227  -3.420
  193    HG   LEU  24           HG       LEU  24  -7.769   0.737  -3.602
  194   HD11  LEU  24          1HD1      LEU  24  -7.176  -0.636  -1.587
  195   HD12  LEU  24          2HD1      LEU  24  -5.726   0.068  -2.337
  196   HD13  LEU  24          3HD1      LEU  24  -6.404   0.792  -0.861
  197   HD21  LEU  24          3HD2      LEU  24  -9.458   2.133  -2.567
  198   HD22  LEU  24          1HD2      LEU  24  -9.356   0.573  -1.717
  199   HD23  LEU  24          2HD2      LEU  24  -8.625   2.029  -0.998
  200    H    GLU  25           H        GLU  25  -6.309   3.387  -5.910
  201    HA   GLU  25           HA       GLU  25  -7.131   0.957  -7.250
  202    HB2  GLU  25           1HB      GLU  25  -8.103   3.171  -7.687
  203    HB3  GLU  25           2HB      GLU  25  -6.544   3.706  -8.359
  204    HG2  GLU  25           1HG      GLU  25  -6.793   1.974 -10.204
  205    HG3  GLU  25           2HG      GLU  25  -8.299   1.513  -9.379
  206    H    GLU  26           H        GLU  26  -4.249   3.021  -7.481
  207    HA   GLU  26           HA       GLU  26  -3.062   1.527  -9.655
  208    HB2  GLU  26           1HB      GLU  26  -1.964   3.392  -7.557
  209    HB3  GLU  26           2HB      GLU  26  -0.945   2.619  -8.796
  210    HG2  GLU  26           1HG      GLU  26  -2.077   3.859 -10.592
  211    HG3  GLU  26           2HG      GLU  26  -3.358   4.249  -9.422
  212    H    LEU  27           H        LEU  27  -2.866   1.274  -6.128
  213    HA   LEU  27           HA       LEU  27  -0.966  -0.923  -6.176
  214    HB2  LEU  27           1HB      LEU  27  -2.972   0.091  -4.280
  215    HB3  LEU  27           2HB      LEU  27  -1.939  -1.266  -3.772
  216    HG   LEU  27           HG       LEU  27  -0.978   1.516  -4.547
  217   HD11  LEU  27          1HD1      LEU  27  -0.387   1.723  -2.119
  218   HD12  LEU  27          2HD1      LEU  27  -2.136   1.474  -2.340
  219   HD13  LEU  27          3HD1      LEU  27  -1.102   0.120  -1.824
  220   HD21  LEU  27          3HD2      LEU  27   0.626  -0.205  -5.132
  221   HD22  LEU  27          1HD2      LEU  27   1.225   0.738  -3.747
  222   HD23  LEU  27          2HD2      LEU  27   0.540  -0.886  -3.490
  223    H    GLU  28           H        GLU  28  -4.487  -0.681  -6.276
  224    HA   GLU  28           HA       GLU  28  -5.077  -3.458  -5.991
  225    HB2  GLU  28           1HB      GLU  28  -6.771  -1.716  -5.932
  226    HB3  GLU  28           2HB      GLU  28  -6.440  -1.321  -7.637
  227    HG2  GLU  28           1HG      GLU  28  -7.193  -3.775  -8.170
  228    HG3  GLU  28           2HG      GLU  28  -7.664  -3.768  -6.456
  229    H    GLU  29           H        GLU  29  -4.294  -1.552  -8.897
  230    HA   GLU  29           HA       GLU  29  -4.701  -3.787 -10.698
  231    HB2  GLU  29           1HB      GLU  29  -3.238  -1.161 -10.973
  232    HB3  GLU  29           2HB      GLU  29  -3.433  -2.337 -12.295
  233    HG2  GLU  29           1HG      GLU  29  -5.935  -2.027 -12.180
  234    HG3  GLU  29           2HG      GLU  29  -5.621  -0.986 -10.772
  235    H    PHE  30           H        PHE  30  -1.876  -2.438  -9.048
  236    HA   PHE  30           HA       PHE  30   0.064  -4.079 -10.416
  237    HB2  PHE  30           1HB      PHE  30   0.669  -2.030  -9.132
  238    HB3  PHE  30           2HB      PHE  30   0.199  -2.855  -7.626
  239    HD1  PHE  30           1HD      PHE  30   2.567  -2.959 -10.473
  240    HD2  PHE  30           2HD      PHE  30   1.675  -4.243  -6.498
  241    HE1  PHE  30           1HE      PHE  30   4.861  -3.855 -10.250
  242    HE2  PHE  30           2HE      PHE  30   3.968  -5.138  -6.269
  243    HZ   PHE  30           HZ       PHE  30   5.561  -4.946  -8.149
  244    H    THR  31           H        THR  31  -1.822  -4.544  -7.444
  245    HA   THR  31           HA       THR  31  -0.408  -7.104  -6.940
  246    HB   THR  31           HB       THR  31  -1.683  -7.160  -4.844
  247    HG1  THR  31           1HG      THR  31  -2.912  -4.772  -5.833
  248   HG21  THR  31          3HG2      THR  31  -0.547  -4.392  -5.405
  249   HG22  THR  31          1HG2      THR  31  -0.808  -5.103  -3.796
  250   HG23  THR  31          2HG2      THR  31   0.392  -5.817  -4.900
  251    H    GLN  32           H        GLN  32  -3.194  -6.002  -8.546
  252    HA   GLN  32           HA       GLN  32  -5.139  -7.065  -9.265
  253    HB2  GLN  32           1HB      GLN  32  -3.141  -9.334  -9.318
  254    HB3  GLN  32           2HB      GLN  32  -4.780  -9.436 -10.000
  255    HG2  GLN  32           1HG      GLN  32  -2.619  -7.454 -11.145
  256    HG3  GLN  32           2HG      GLN  32  -3.100  -9.128 -11.511
  257   HE21  GLN  32          2HE2      GLN  32  -3.748  -5.799 -11.980
  258   HE22  GLN  32          1HE2      GLN  32  -5.221  -5.964 -12.876
  259    H    ALA  33           H        ALA  33  -5.588  -6.648  -6.802
  260    HA   ALA  33           HA       ALA  33  -6.778  -9.177  -5.814
  261    HB1  ALA  33           1HB      ALA  33  -5.958  -8.759  -3.528
  262    HB2  ALA  33           2HB      ALA  33  -4.615  -9.026  -4.666
  263    HB3  ALA  33           3HB      ALA  33  -5.008  -7.378  -4.125
  264    H    LYS  34           H        LYS  34  -8.362  -8.853  -4.104
  265    HA   LYS  34           HA       LYS  34 -10.119  -6.634  -4.755
  266    HB2  LYS  34           1HB      LYS  34 -10.162  -8.695  -2.546
  267    HB3  LYS  34           2HB      LYS  34 -11.451  -7.505  -2.844
  268    HG2  LYS  34           1HG      LYS  34 -11.802  -8.470  -5.095
  269    HG3  LYS  34           2HG      LYS  34 -10.543  -9.684  -4.756
  270    HD2  LYS  34           1HD      LYS  34 -11.873 -10.525  -2.856
  271    HD3  LYS  34           2HD      LYS  34 -13.135  -9.320  -3.213
  272    HE2  LYS  34           1HE      LYS  34 -13.450 -10.325  -5.441
  273    HE3  LYS  34           2HE      LYS  34 -12.208 -11.539  -5.063
  274    HZ1  LYS  34           3HZ      LYS  34 -14.760 -11.193  -3.625
  275    HZ2  LYS  34           1HZ      LYS  34 -14.424 -12.392  -4.706
  276    HZ3  LYS  34           2HZ      LYS  34 -13.607 -12.320  -3.274
  277    H    ARG  35           H        ARG  35 -10.738  -4.884  -3.592
  278    HA   ARG  35           HA       ARG  35  -8.668  -3.616  -2.028
  279    HB2  ARG  35           1HB      ARG  35 -11.515  -2.866  -2.500
  280    HB3  ARG  35           2HB      ARG  35 -10.344  -1.898  -1.573
  281    HG2  ARG  35           1HG      ARG  35  -8.964  -1.586  -3.524
  282    HG3  ARG  35           2HG      ARG  35  -9.967  -2.713  -4.469
  283    HD2  ARG  35           1HD      ARG  35 -11.856  -1.127  -4.156
  284    HD3  ARG  35           2HD      ARG  35 -10.682   0.017  -3.468
  285    HE   ARG  35           HE       ARG  35  -9.787  -0.676  -6.136
  286   HH11  ARG  35          1HH1      ARG  35 -12.435   1.012  -4.624
  287   HH12  ARG  35          2HH1      ARG  35 -12.585   2.049  -6.029
  288   HH21  ARG  35          1HH2      ARG  35  -9.949   0.497  -7.756
  289   HH22  ARG  35          2HH2      ARG  35 -11.169   1.757  -7.816
  290    H    GLU  36           H        GLU  36 -11.527  -5.482  -1.207
  291    HA   GLU  36           HA       GLU  36 -11.596  -4.859   1.592
  292    HB2  GLU  36           1HB      GLU  36 -12.370  -7.329   0.039
  293    HB3  GLU  36           2HB      GLU  36 -12.664  -7.118   1.783
  294    HG2  GLU  36           1HG      GLU  36 -14.162  -5.149   1.268
  295    HG3  GLU  36           2HG      GLU  36 -13.686  -5.384  -0.429
  296    H    VAL  37           H        VAL  37  -9.557  -7.000  -0.293
  297    HA   VAL  37           HA       VAL  37  -8.323  -8.163   2.152
  298    HB   VAL  37           HB       VAL  37  -7.636  -8.440  -0.805
  299   HG11  VAL  37          1HG1      VAL  37  -6.188 -10.298  -0.056
  300   HG12  VAL  37          2HG1      VAL  37  -5.670  -8.754   0.660
  301   HG13  VAL  37          3HG1      VAL  37  -6.587  -9.926   1.638
  302   HG21  VAL  37          3HG2      VAL  37  -9.780  -9.433  -0.269
  303   HG22  VAL  37          1HG2      VAL  37  -8.564 -10.690  -0.593
  304   HG23  VAL  37          2HG2      VAL  37  -9.047 -10.331   1.082
  305    H    LEU  38           H        LEU  38  -7.473  -5.855  -0.405
  306    HA   LEU  38           HA       LEU  38  -4.734  -5.606   0.479
  307    HB2  LEU  38           1HB      LEU  38  -6.572  -3.952  -1.114
  308    HB3  LEU  38           2HB      LEU  38  -4.869  -3.454  -0.989
  309    HG   LEU  38           HG       LEU  38  -5.879  -6.063  -2.188
  310   HD11  LEU  38          1HD1      LEU  38  -5.108  -5.082  -4.365
  311   HD12  LEU  38          2HD1      LEU  38  -6.384  -4.088  -3.622
  312   HD13  LEU  38          3HD1      LEU  38  -4.682  -3.576  -3.517
  313   HD21  LEU  38          3HD2      LEU  38  -3.703  -6.307  -1.146
  314   HD22  LEU  38          1HD2      LEU  38  -3.539  -6.373  -2.917
  315   HD23  LEU  38          2HD2      LEU  38  -3.085  -4.895  -2.037
  316    H    LEU  39           H        LEU  39  -7.710  -3.884   1.263
  317    HA   LEU  39           HA       LEU  39  -6.414  -1.663   2.570
  318    HB2  LEU  39           1HB      LEU  39  -9.059  -2.934   2.687
  319    HB3  LEU  39           2HB      LEU  39  -8.797  -1.474   3.670
  320    HG   LEU  39           HG       LEU  39  -8.574  -1.645   0.639
  321   HD11  LEU  39          1HD1      LEU  39 -10.641  -0.223   0.650
  322   HD12  LEU  39          2HD1      LEU  39 -10.930  -1.790   1.442
  323   HD13  LEU  39          3HD1      LEU  39 -10.685  -0.326   2.426
  324   HD21  LEU  39          3HD2      LEU  39  -7.048  -0.016   1.584
  325   HD22  LEU  39          1HD2      LEU  39  -8.374   0.815   0.736
  326   HD23  LEU  39          2HD2      LEU  39  -8.370   0.728   2.516
  327    H    VAL  40           H        VAL  40  -7.359  -4.870   3.633
  328    HA   VAL  40           HA       VAL  40  -6.931  -4.447   6.468
  329    HB   VAL  40           HB       VAL  40  -6.656  -6.933   4.728
  330   HG11  VAL  40          1HG1      VAL  40  -6.702  -8.182   6.862
  331   HG12  VAL  40          2HG1      VAL  40  -5.282  -7.113   6.776
  332   HG13  VAL  40          3HG1      VAL  40  -6.691  -6.648   7.761
  333   HG21  VAL  40          3HG2      VAL  40  -8.911  -6.049   4.797
  334   HG22  VAL  40          1HG2      VAL  40  -8.798  -7.568   5.717
  335   HG23  VAL  40          2HG2      VAL  40  -8.863  -6.010   6.577
  336    H    THR  41           H        THR  41  -4.737  -5.625   3.918
  337    HA   THR  41           HA       THR  41  -2.441  -5.725   5.658
  338    HB   THR  41           HB       THR  41  -2.612  -5.387   2.633
  339    HG1  THR  41           1HG      THR  41  -2.086  -7.676   2.752
  340   HG21  THR  41          3HG2      THR  41  -0.275  -6.177   4.415
  341   HG22  THR  41          1HG2      THR  41  -0.269  -6.166   2.637
  342   HG23  THR  41          2HG2      THR  41  -0.438  -4.638   3.536
  343    H    LEU  42           H        LEU  42  -3.765  -3.189   3.563
  344    HA   LEU  42           HA       LEU  42  -1.514  -1.416   3.846
  345    HB2  LEU  42           1HB      LEU  42  -4.364  -1.107   3.211
  346    HB3  LEU  42           2HB      LEU  42  -3.331   0.338   3.129
  347    HG   LEU  42           HG       LEU  42  -2.906  -2.188   1.491
  348   HD11  LEU  42          1HD1      LEU  42  -3.763  -0.839  -0.442
  349   HD12  LEU  42          2HD1      LEU  42  -5.006  -1.026   0.818
  350   HD13  LEU  42          3HD1      LEU  42  -4.110   0.505   0.670
  351   HD21  LEU  42          3HD2      LEU  42  -0.875  -0.928   1.899
  352   HD22  LEU  42          1HD2      LEU  42  -1.349  -0.777   0.190
  353   HD23  LEU  42          2HD2      LEU  42  -1.650   0.566   1.322
  354    H    THR  43           H        THR  43  -4.558  -1.738   5.641
  355    HA   THR  43           HA       THR  43  -4.028   0.522   7.378
  356    HB   THR  43           HB       THR  43  -5.833  -1.904   7.763
  357    HG1  THR  43           1HG      THR  43  -7.447  -0.353   7.142
  358   HG21  THR  43          3HG2      THR  43  -5.727   0.752   9.248
  359   HG22  THR  43          1HG2      THR  43  -6.944  -0.526   9.484
  360   HG23  THR  43          2HG2      THR  43  -5.242  -0.828   9.907
  361    H    ARG  44           H        ARG  44  -3.390  -2.956   7.598
  362    HA   ARG  44           HA       ARG  44  -2.409  -2.896  10.305
  363    HB2  ARG  44           1HB      ARG  44  -2.023  -4.803   8.057
  364    HB3  ARG  44           2HB      ARG  44  -1.212  -4.980   9.631
  365    HG2  ARG  44           1HG      ARG  44  -3.373  -5.100  10.758
  366    HG3  ARG  44           2HG      ARG  44  -4.213  -4.852   9.208
  367    HD2  ARG  44           1HD      ARG  44  -3.383  -6.953   8.398
  368    HD3  ARG  44           2HD      ARG  44  -2.472  -7.195   9.907
  369    HE   ARG  44           HE       ARG  44  -5.280  -7.036  10.595
  370   HH11  ARG  44          1HH1      ARG  44  -3.147  -9.152   8.826
  371   HH12  ARG  44          2HH1      ARG  44  -4.158 -10.524   9.237
  372   HH21  ARG  44          1HH2      ARG  44  -6.453  -8.594  11.067
  373   HH22  ARG  44          2HH2      ARG  44  -6.043 -10.206  10.514
  374    H    LEU  45           H        LEU  45  -0.807  -2.496   7.162
  375    HA   LEU  45           HA       LEU  45   1.838  -2.151   8.254
  376    HB2  LEU  45           1HB      LEU  45   0.436  -1.235   5.837
  377    HB3  LEU  45           2HB      LEU  45   2.174  -0.886   5.988
  378    HG   LEU  45           HG       LEU  45   0.906  -3.651   5.913
  379   HD11  LEU  45          1HD1      LEU  45   2.047  -3.844   3.687
  380   HD12  LEU  45          2HD1      LEU  45   0.873  -2.508   3.697
  381   HD13  LEU  45          3HD1      LEU  45   2.613  -2.166   3.849
  382   HD21  LEU  45          3HD2      LEU  45   2.894  -3.597   7.301
  383   HD22  LEU  45          1HD2      LEU  45   3.232  -4.476   5.790
  384   HD23  LEU  45          2HD2      LEU  45   3.816  -2.808   5.998
  385    H    HIS  46           H        HIS  46  -0.784   0.132   7.526
  386    HA   HIS  46           HA       HIS  46   0.610   2.517   8.219
  387    HB2  HIS  46           1HB      HIS  46  -1.612   2.541   7.127
  388    HB3  HIS  46           2HB      HIS  46  -2.344   1.852   8.596
  389    HD2  HIS  46           2HD      HIS  46  -3.139   3.783  10.517
  390    HE1  HIS  46           1HE      HIS  46  -1.212   7.033   8.575
  391    HE2  HIS  46           2HE      HIS  46  -2.809   6.262  10.515
  392    H    GLN  47           H        GLN  47  -1.275   0.290  10.264
  393    HA   GLN  47           HA       GLN  47  -0.804   1.784  12.693
  394    HB2  GLN  47           1HB      GLN  47  -1.537  -1.096  12.146
  395    HB3  GLN  47           2HB      GLN  47  -1.404  -0.406  13.781
  396    HG2  GLN  47           1HG      GLN  47  -3.417   1.249  13.073
  397    HG3  GLN  47           2HG      GLN  47  -3.097   0.359  11.567
  398   HE21  GLN  47          2HE2      GLN  47  -5.630   0.520  12.802
  399   HE22  GLN  47          1HE2      GLN  47  -6.075  -1.062  13.345
  400    H    ARG  48           H        ARG  48   0.972  -0.735  11.000
  401    HA   ARG  48           HA       ARG  48   2.869  -1.214  13.144
  402    HB2  ARG  48           1HB      ARG  48   2.912  -1.788  10.224
  403    HB3  ARG  48           2HB      ARG  48   4.295  -2.098  11.300
  404    HG2  ARG  48           1HG      ARG  48   3.083  -3.706  12.558
  405    HG3  ARG  48           2HG      ARG  48   1.536  -3.219  11.824
  406    HD2  ARG  48           1HD      ARG  48   2.267  -5.339  10.984
  407    HD3  ARG  48           2HD      ARG  48   2.269  -4.111   9.698
  408    HE   ARG  48           HE       ARG  48   4.988  -4.408  10.688
  409   HH11  ARG  48          1HH1      ARG  48   2.616  -6.218   8.883
  410   HH12  ARG  48          2HH1      ARG  48   3.894  -7.044   8.018
  411   HH21  ARG  48          1HH2      ARG  48   6.464  -5.353   9.710
  412   HH22  ARG  48          2HH2      ARG  48   6.091  -6.552   8.489
  413    H    GLY  49           H        GLY  49   2.487   1.288  10.785
  414    HA2  GLY  49           1HA      GLY  49   3.649   3.350  10.824
  415    HA3  GLY  49           2HA      GLY  49   4.907   2.613  11.843
  416    H    VAL  50           H        VAL  50   3.830   0.864   9.051
  417    HA   VAL  50           HA       VAL  50   6.499   1.183   7.778
  418    HB   VAL  50           HB       VAL  50   4.079  -0.502   7.009
  419   HG11  VAL  50          1HG1      VAL  50   5.660  -1.643   5.490
  420   HG12  VAL  50          2HG1      VAL  50   5.505   0.080   5.075
  421   HG13  VAL  50          3HG1      VAL  50   6.938  -0.497   5.959
  422   HG21  VAL  50          3HG2      VAL  50   5.040  -1.221   9.113
  423   HG22  VAL  50          1HG2      VAL  50   5.392  -2.394   7.824
  424   HG23  VAL  50          2HG2      VAL  50   6.659  -1.275   8.377
  425    H    ILE  51           H        ILE  51   3.109   1.539   6.703
  426    HA   ILE  51           HA       ILE  51   4.100   3.716   4.874
  427    HB   ILE  51           HB       ILE  51   2.165   3.212   3.432
  428   HG12  ILE  51          1HG1      ILE  51   1.623   0.900   5.275
  429   HG13  ILE  51          2HG1      ILE  51   0.725   2.436   5.267
  430   HG21  ILE  51          1HG2      ILE  51   2.878   1.007   2.573
  431   HG22  ILE  51          2HG2      ILE  51   4.283   2.021   2.979
  432   HG23  ILE  51          3HG2      ILE  51   3.783   0.713   4.077
  433   HD11  ILE  51          3HD1      ILE  51   0.923   0.478   2.952
  434   HD12  ILE  51          1HD1      ILE  51  -0.484   0.690   4.018
  435   HD13  ILE  51          2HD1      ILE  51   0.025   2.014   2.942
  436    H    TYR  52           H        TYR  52   2.476   5.335   4.311
  437    HA   TYR  52           HA       TYR  52   0.714   5.930   6.666
  438    HB2  TYR  52           1HB      TYR  52   2.394   7.861   5.053
  439    HB3  TYR  52           2HB      TYR  52   1.216   8.304   6.313
  440    HD1  TYR  52           1HD      TYR  52   4.540   6.852   5.661
  441    HD2  TYR  52           2HD      TYR  52   1.731   7.966   8.669
  442    HE1  TYR  52           1HE      TYR  52   6.308   6.635   7.382
  443    HE2  TYR  52           2HE      TYR  52   3.484   7.752  10.399
  444    HH   TYR  52           HH       TYR  52   5.664   7.260  10.834
  445    H    ARG  53           H        ARG  53  -1.273   6.643   6.302
  446    HA   ARG  53           HA       ARG  53  -2.210   6.539   3.484
  447    HB2  ARG  53           1HB      ARG  53  -3.400   5.230   5.068
  448    HB3  ARG  53           2HB      ARG  53  -3.736   6.678   6.046
  449    HG2  ARG  53           1HG      ARG  53  -5.038   7.625   4.180
  450    HG3  ARG  53           2HG      ARG  53  -4.719   6.157   3.223
  451    HD2  ARG  53           1HD      ARG  53  -6.113   6.102   5.870
  452    HD3  ARG  53           2HD      ARG  53  -6.962   6.359   4.329
  453    HE   ARG  53           HE       ARG  53  -6.310   3.952   3.751
  454   HH11  ARG  53          1HH1      ARG  53  -5.710   4.911   7.049
  455   HH12  ARG  53          2HH1      ARG  53  -5.722   3.230   7.546
  456   HH21  ARG  53          1HH2      ARG  53  -6.318   2.022   4.304
  457   HH22  ARG  53          2HH2      ARG  53  -6.068   1.582   5.982
  458    H    LYS  54           H        LYS  54  -3.011   8.157   2.336
  459    HA   LYS  54           HA       LYS  54  -3.122  10.849   3.657
  460    HB2  LYS  54           1HB      LYS  54  -1.099  10.596   2.277
  461    HB3  LYS  54           2HB      LYS  54  -2.126  10.192   0.881
  462    HG2  LYS  54           1HG      LYS  54  -3.128  12.415   0.932
  463    HG3  LYS  54           2HG      LYS  54  -2.191  12.826   2.388
  464    HD2  LYS  54           1HD      LYS  54  -0.097  12.545   1.118
  465    HD3  LYS  54           2HD      LYS  54  -1.038  12.146  -0.339
  466    HE2  LYS  54           1HE      LYS  54  -2.050  14.351  -0.343
  467    HE3  LYS  54           2HE      LYS  54  -1.242  14.758   1.187
  468    HZ1  LYS  54           3HZ      LYS  54   0.114  14.192  -1.370
  469    HZ2  LYS  54           1HZ      LYS  54  -0.088  15.687  -0.703
  470    HZ3  LYS  54           2HZ      LYS  54   0.866  14.570   0.049
  471    H    TRP  55           H        TRP  55  -4.878  11.993   3.389
  472    HA   TRP  55           HA       TRP  55  -7.005  10.779   1.671
  473    HB2  TRP  55           1HB      TRP  55  -7.163  12.667   4.062
  474    HB3  TRP  55           2HB      TRP  55  -8.560  12.120   3.105
  475    HD1  TRP  55           HD       TRP  55  -9.436   9.844   3.507
  476    HE1  TRP  55           1HE      TRP  55  -9.041   7.954   5.396
  477    HE3  TRP  55           3HE      TRP  55  -5.177  11.727   5.545
  478    HZ2  TRP  55           2HZ      TRP  55  -7.149   7.501   7.359
  479    HZ3  TRP  55           3HZ      TRP  55  -4.106  10.587   7.389
  480    HH2  TRP  55           HH       TRP  55  -5.023   8.507   8.321
  481    H    ARG  56           H        ARG  56  -6.809  11.589  -0.307
  482    HA   ARG  56           HA       ARG  56  -6.702  14.561  -0.597
  483    HB2  ARG  56           1HB      ARG  56  -6.383  12.394  -2.625
  484    HB3  ARG  56           2HB      ARG  56  -6.411  14.142  -2.961
  485    HG2  ARG  56           1HG      ARG  56  -4.420  14.423  -1.513
  486    HG3  ARG  56           2HG      ARG  56  -4.373  12.659  -1.271
  487    HD2  ARG  56           1HD      ARG  56  -2.756  13.213  -2.875
  488    HD3  ARG  56           2HD      ARG  56  -4.105  12.420  -3.721
  489    HE   ARG  56           HE       ARG  56  -4.307  15.339  -3.983
  490   HH11  ARG  56          1HH1      ARG  56  -2.554  12.589  -5.217
  491   HH12  ARG  56          2HH1      ARG  56  -2.297  13.426  -6.735
  492   HH21  ARG  56          1HH2      ARG  56  -4.013  16.315  -5.712
  493   HH22  ARG  56          2HH2      ARG  56  -3.129  15.551  -7.018
  494    H    HIS  57           H        HIS  57  -8.216  15.741  -1.668
  495    HA   HIS  57           HA       HIS  57 -10.767  14.353  -2.352
  496    HB2  HIS  57           1HB      HIS  57 -10.572  16.829  -0.578
  497    HB3  HIS  57           2HB      HIS  57 -12.068  16.035  -1.125
  498    HD2  HIS  57           2HD      HIS  57  -9.432  15.716   1.789
  499    HE1  HIS  57           1HE      HIS  57 -12.213  12.512   2.014
  500    HE2  HIS  57           2HE      HIS  57 -10.253  13.812   3.190
  501    H    PHE  58           H        PHE  58 -11.556  14.915  -4.213
  502    HA   PHE  58           HA       PHE  58 -11.147  17.648  -5.263
  503    HB2  PHE  58           1HB      PHE  58  -9.086  16.454  -5.988
  504    HB3  PHE  58           2HB      PHE  58 -10.092  15.203  -6.751
  505    HD1  PHE  58           1HD      PHE  58  -9.422  18.865  -6.802
  506    HD2  PHE  58           2HD      PHE  58 -10.731  15.406  -8.942
  507    HE1  PHE  58           1HE      PHE  58  -9.468  20.179  -8.895
  508    HE2  PHE  58           2HE      PHE  58 -10.775  16.716 -11.037
  509    HZ   PHE  58           HZ       PHE  58 -10.145  19.104 -11.014
  510    H    SER  59           H        SER  59 -12.906  18.333  -6.165
  511    HA   SER  59           HA       SER  59 -14.971  18.314  -7.367
  512    HB2  SER  59           1HB      SER  59 -13.933  15.741  -8.392
  513    HB3  SER  59           2HB      SER  59 -15.344  16.654  -8.976
  514    HG   SER  59           HG       SER  59 -13.906  18.387  -9.417
  515    H    GLY  60           H        GLY  60 -14.576  17.024  -4.602
  516    HA2  GLY  60           1HA      GLY  60 -16.204  16.266  -3.101
  517    HA3  GLY  60           2HA      GLY  60 -17.296  15.944  -4.466
  518    H    ARG  61           H        ARG  61 -14.301  14.639  -5.156
  519    HA   ARG  61           HA       ARG  61 -15.274  11.918  -4.394
  520    HB2  ARG  61           1HB      ARG  61 -13.277  12.758  -6.446
  521    HB3  ARG  61           2HB      ARG  61 -13.673  11.082  -6.002
  522    HG2  ARG  61           1HG      ARG  61 -16.011  11.468  -6.710
  523    HG3  ARG  61           2HG      ARG  61 -15.569  13.121  -7.208
  524    HD2  ARG  61           1HD      ARG  61 -13.987  12.160  -8.814
  525    HD3  ARG  61           2HD      ARG  61 -14.573  10.540  -8.369
  526    HE   ARG  61           HE       ARG  61 -16.834  12.077  -9.345
  527   HH11  ARG  61          1HH1      ARG  61 -13.869  10.704 -10.563
  528   HH12  ARG  61          2HH1      ARG  61 -14.606  10.496 -12.140
  529   HH21  ARG  61          1HH2      ARG  61 -17.689  11.854 -11.145
  530   HH22  ARG  61          2HH2      ARG  61 -16.785  11.152 -12.474
  531    H    LYS  62           H        LYS  62 -14.059  10.450  -3.325
  532    HA   LYS  62           HA       LYS  62 -11.814  11.620  -1.744
  533    HB2  LYS  62           1HB      LYS  62 -13.450   9.101  -1.415
  534    HB3  LYS  62           2HB      LYS  62 -12.087   9.572  -0.374
  535    HG2  LYS  62           1HG      LYS  62 -13.299  11.585   0.329
  536    HG3  LYS  62           2HG      LYS  62 -14.657  11.149  -0.737
  537    HD2  LYS  62           1HD      LYS  62 -14.982   9.062   0.545
  538    HD3  LYS  62           2HD      LYS  62 -13.647   9.530   1.627
  539    HE2  LYS  62           1HE      LYS  62 -14.880  11.527   2.314
  540    HE3  LYS  62           2HE      LYS  62 -16.203  11.110   1.201
  541    HZ1  LYS  62           3HZ      LYS  62 -15.341   9.501   3.517
  542    HZ2  LYS  62           1HZ      LYS  62 -16.694  10.442   3.453
  543    HZ3  LYS  62           2HZ      LYS  62 -16.568   9.113   2.485
  544    H    TYR  63           H        TYR  63  -9.786  11.055  -1.931
  545    HA   TYR  63           HA       TYR  63  -9.148   8.696  -3.673
  546    HB2  TYR  63           1HB      TYR  63  -7.716  11.356  -3.539
  547    HB3  TYR  63           2HB      TYR  63  -7.209   9.935  -4.484
  548    HD1  TYR  63           1HD      TYR  63  -9.645  12.694  -4.250
  549    HD2  TYR  63           2HD      TYR  63  -8.357   9.335  -6.540
  550    HE1  TYR  63           1HE      TYR  63 -11.032  13.468  -6.151
  551    HE2  TYR  63           2HE      TYR  63  -9.734  10.094  -8.447
  552    HH   TYR  63           HH       TYR  63 -11.175  11.676  -9.232
  553    H    ARG  64           H        ARG  64  -8.413   7.173  -2.416
  554    HA   ARG  64           HA       ARG  64  -6.785   7.846  -0.038
  555    HB2  ARG  64           1HB      ARG  64  -7.701   5.208  -1.091
  556    HB3  ARG  64           2HB      ARG  64  -6.763   5.482   0.396
  557    HG2  ARG  64           1HG      ARG  64  -8.597   6.743   1.367
  558    HG3  ARG  64           2HG      ARG  64  -9.530   6.602  -0.144
  559    HD2  ARG  64           1HD      ARG  64  -9.632   4.197   0.164
  560    HD3  ARG  64           2HD      ARG  64  -8.738   4.365   1.692
  561    HE   ARG  64           HE       ARG  64 -11.135   5.902   2.011
  562   HH11  ARG  64          1HH1      ARG  64 -10.359   2.566   1.360
  563   HH12  ARG  64          2HH1      ARG  64 -11.817   2.059   2.192
  564   HH21  ARG  64          1HH2      ARG  64 -12.812   5.338   2.959
  565   HH22  ARG  64          2HH2      ARG  64 -13.216   3.638   3.102
  566    H    GLU  65           H        GLU  65  -4.734   8.247  -0.183
  567    HA   GLU  65           HA       GLU  65  -3.121   6.628  -2.130
  568    HB2  GLU  65           1HB      GLU  65  -2.658   9.371  -0.955
  569    HB3  GLU  65           2HB      GLU  65  -1.434   8.449  -1.862
  570    HG2  GLU  65           1HG      GLU  65  -3.118   8.461  -3.854
  571    HG3  GLU  65           2HG      GLU  65  -4.050   9.542  -2.793
  572    H    TYR  66           H        TYR  66  -1.181   5.748  -1.509
  573    HA   TYR  66           HA       TYR  66  -0.614   5.777   1.433
  574    HB2  TYR  66           1HB      TYR  66  -0.600   3.374  -0.406
  575    HB3  TYR  66           2HB      TYR  66  -0.031   3.401   1.281
  576    HD1  TYR  66           1HD      TYR  66  -3.001   3.503  -0.906
  577    HD2  TYR  66           2HD      TYR  66  -1.609   3.432   3.123
  578    HE1  TYR  66           1HE      TYR  66  -5.298   2.992  -0.131
  579    HE2  TYR  66           2HE      TYR  66  -3.896   2.922   3.915
  580    HH   TYR  66           HH       TYR  66  -6.636   2.556   1.653
  581    H    CYS  67           H        CYS  67   1.383   6.168   1.982
  582    HA   CYS  67           HA       CYS  67   3.507   6.147  -0.187
  583    HB2  CYS  67           1HB      CYS  67   2.695   8.359   0.539
  584    HB3  CYS  67           2HB      CYS  67   2.988   7.920   2.239
  585    HG   CYS  67           HG       CYS  67   5.155   8.159  -0.194
  586    H    LEU  68           H        LEU  68   5.333   5.051   0.228
  587    HA   LEU  68           HA       LEU  68   5.639   3.799   2.924
  588    HB2  LEU  68           1HB      LEU  68   5.579   2.319   1.218
  589    HB3  LEU  68           2HB      LEU  68   6.785   3.103   0.172
  590    HG   LEU  68           HG       LEU  68   8.505   2.657   1.949
  591   HD11  LEU  68          1HD1      LEU  68   7.952   0.911   3.665
  592   HD12  LEU  68          2HD1      LEU  68   6.930   2.356   3.857
  593   HD13  LEU  68          3HD1      LEU  68   6.271   0.894   3.083
  594   HD21  LEU  68          3HD2      LEU  68   8.345   1.249  -0.017
  595   HD22  LEU  68          1HD2      LEU  68   8.774   0.263   1.401
  596   HD23  LEU  68          2HD2      LEU  68   7.109   0.238   0.771
  597    H    LYS  69           H        LYS  69   6.879   4.720   4.331
  598    HA   LYS  69           HA       LYS  69   9.300   6.187   3.332
  599    HB2  LYS  69           1HB      LYS  69   7.605   6.735   5.773
  600    HB3  LYS  69           2HB      LYS  69   9.117   7.572   5.344
  601    HG2  LYS  69           1HG      LYS  69   8.051   8.425   3.287
  602    HG3  LYS  69           2HG      LYS  69   6.538   7.608   3.741
  603    HD2  LYS  69           1HD      LYS  69   6.441   8.960   5.807
  604    HD3  LYS  69           2HD      LYS  69   7.936   9.794   5.320
  605    HE2  LYS  69           1HE      LYS  69   6.816  10.622   3.296
  606    HE3  LYS  69           2HE      LYS  69   5.321   9.786   3.778
  607    HZ1  LYS  69           3HZ      LYS  69   6.637  11.956   5.286
  608    HZ2  LYS  69           1HZ      LYS  69   5.272  12.113   4.373
  609    HZ3  LYS  69           2HZ      LYS  69   5.251  11.180   5.734
  610    H    HIS  70           H        HIS  70   8.009   3.754   5.418
  611    HA   HIS  70           HA       HIS  70  10.208   3.589   7.268
  612    HB2  HIS  70           1HB      HIS  70   7.988   2.513   7.673
  613    HB3  HIS  70           2HB      HIS  70   8.319   1.376   6.345
  614    HD1  HIS  70           1HD      HIS  70   9.982   2.442   9.620
  615    HD2  HIS  70           2HD      HIS  70   9.369  -1.033   7.314
  616    HE1  HIS  70           1HE      HIS  70  11.035   0.617  10.857
  617    H    ARG  71           H        ARG  71  12.108   2.626   7.245
  618    HA   ARG  71           HA       ARG  71  13.412   2.117   4.775
  619    HB2  ARG  71           1HB      ARG  71  14.518   2.697   6.865
  620    HB3  ARG  71           2HB      ARG  71  14.206   1.044   7.444
  621    HG2  ARG  71           1HG      ARG  71  15.553   0.132   5.617
  622    HG3  ARG  71           2HG      ARG  71  15.838   1.774   4.993
  623    HD2  ARG  71           1HD      ARG  71  17.059   2.337   6.985
  624    HD3  ARG  71           2HD      ARG  71  16.736   0.721   7.657
  625    HE   ARG  71           HE       ARG  71  18.531  -0.128   6.177
  626   HH11  ARG  71          1HH1      ARG  71  17.771   3.177   5.368
  627   HH12  ARG  71          2HH1      ARG  71  19.227   3.283   4.400
  628   HH21  ARG  71          1HH2      ARG  71  20.199  -0.027   5.064
  629   HH22  ARG  71          2HH2      ARG  71  20.612   1.455   4.223
  630    H    ASP  72           H        ASP  72  13.620   0.479   3.456
  631    HA   ASP  72           HA       ASP  72  11.855  -1.783   3.665
  632    HB2  ASP  72           1HB      ASP  72  14.283  -1.309   1.833
  633    HB3  ASP  72           2HB      ASP  72  13.169  -2.697   1.896
  634    H    GLU  73           H        GLU  73  15.313  -1.381   4.357
  635    HA   GLU  73           HA       GLU  73  15.901  -4.095   4.969
  636    HB2  GLU  73           1HB      GLU  73  17.566  -2.303   4.758
  637    HB3  GLU  73           2HB      GLU  73  16.958  -1.579   6.265
  638    HG2  GLU  73           1HG      GLU  73  17.708  -3.643   7.528
  639    HG3  GLU  73           2HG      GLU  73  18.174  -4.290   5.938
  640    H    LEU  74           H        LEU  74  14.629  -1.510   7.067
  641    HA   LEU  74           HA       LEU  74  14.498  -3.159   9.424
  642    HB2  LEU  74           1HB      LEU  74  13.074  -0.765   8.477
  643    HB3  LEU  74           2HB      LEU  74  12.783  -1.328  10.140
  644    HG   LEU  74           HG       LEU  74  15.432  -0.362   8.991
  645   HD11  LEU  74          1HD1      LEU  74  15.149   1.521  10.625
  646   HD12  LEU  74          2HD1      LEU  74  13.810   1.473   9.456
  647   HD13  LEU  74          3HD1      LEU  74  13.574   0.847  11.105
  648   HD21  LEU  74          3HD2      LEU  74  15.769  -2.146  10.596
  649   HD22  LEU  74          1HD2      LEU  74  16.291  -0.595  11.294
  650   HD23  LEU  74          2HD2      LEU  74  14.737  -1.314  11.783
  651    H    ALA  75           H        ALA  75  12.203  -2.508   6.811
  652    HA   ALA  75           HA       ALA  75   9.982  -3.875   7.954
  653    HB1  ALA  75           1HB      ALA  75   9.167  -4.068   5.638
  654    HB2  ALA  75           2HB      ALA  75   9.786  -2.434   5.979
  655    HB3  ALA  75           3HB      ALA  75  10.768  -3.580   5.035
  656    H    ASP  76           H        ASP  76  12.724  -5.053   6.035
  657    HA   ASP  76           HA       ASP  76  11.765  -7.785   5.889
  658    HB2  ASP  76           1HB      ASP  76  14.589  -6.611   5.540
  659    HB3  ASP  76           2HB      ASP  76  14.055  -8.306   5.444
  660    H    LEU  77           H        LEU  77  13.714  -5.979   8.205
  661    HA   LEU  77           HA       LEU  77  14.532  -8.315   9.717
  662    HB2  LEU  77           1HB      LEU  77  14.275  -5.437  10.263
  663    HB3  LEU  77           2HB      LEU  77  14.971  -6.479  11.526
  664    HG   LEU  77           HG       LEU  77  16.111  -6.036   8.739
  665   HD11  LEU  77          1HD1      LEU  77  17.962  -4.858   9.953
  666   HD12  LEU  77          2HD1      LEU  77  16.397  -4.061  10.233
  667   HD13  LEU  77          3HD1      LEU  77  17.098  -5.113  11.487
  668   HD21  LEU  77          3HD2      LEU  77  16.552  -8.276   9.555
  669   HD22  LEU  77          1HD2      LEU  77  18.054  -7.321   9.563
  670   HD23  LEU  77          2HD2      LEU  77  17.184  -7.624  11.086
  671    H    GLU  78           H        GLU  78  11.695  -6.267   9.710
  672    HA   GLU  78           HA       GLU  78  10.619  -7.156  12.234
  673    HB2  GLU  78           1HB      GLU  78   9.385  -6.061   9.711
  674    HB3  GLU  78           2HB      GLU  78   8.424  -6.510  11.142
  675    HG2  GLU  78           1HG      GLU  78   9.669  -4.774  12.495
  676    HG3  GLU  78           2HG      GLU  78  10.645  -4.512  11.033
  677    H    HIS  79           H        HIS  79  10.676  -8.553   9.022
  678    HA   HIS  79           HA       HIS  79   8.878 -10.747   9.963
  679    HB2  HIS  79           1HB      HIS  79   9.835  -9.951   7.178
  680    HB3  HIS  79           2HB      HIS  79   8.870 -11.405   7.529
  681    HD1  HIS  79           1HD      HIS  79   6.431 -10.956   8.532
  682    HD2  HIS  79           2HD      HIS  79   8.307  -7.570   6.867
  683    HE1  HIS  79           1HE      HIS  79   4.645  -9.352   8.076