*HEADER    UNKNOWN FUNCTION                        29-NOV-18   6N8C              
*TITLE     STRUCTURE OF THE HUNTINGTIN TETRAMER/DIMER MIXTURE DETERMINED BY      
*TITLE    2 PARAMAGNETIC NMR                                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HUNTINGTIN;                                                
*COMPND   3 CHAIN: A, B, C, D;                                                   
*COMPND   4 SYNONYM: HUNTINGTON DISEASE PROTEIN,HD PROTEIN;                      
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 ORGANISM_TAXID: 9606;                                                
*SOURCE   5 GENE: HTT, HD, IT15;                                                 
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    TETRAMER, DIMER OF DIMERS, UNKNOWN FUNCTION                           
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    C.D.SCHWIETERS,S.A.KOTLER,T.SCHMIDT,A.CECCON,R.GHIRLANDO,D.S.LIBICH,  
*AUTHOR   2 G.M.CLORE                                                            
*REVDAT   1   13-FEB-19 6N8C    0                                                
# Restraints file 1: HttQ7_HN_gamma2_GB1-Q7-S12C_1to40_update-1.tbl

assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  3  and name HN) 14.762 0.011 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  4  and name HN) 5.361 0.039 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  5  and name HN) 8.389 0.031 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  6  and name HN) 9.930 0.031 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  7  and name HN) 7.774 0.025 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  8  and name HN) 7.194 0.032 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  9  and name HN) 10.858 0.012 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  10  and name HN) 11.636 0.023 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  11  and name HN) 8.767 0.035 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  12  and name HN) 7.154 0.015 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  13  and name HN) 12.337 0.026 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  14  and name HN) 10.333 0.032 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  15  and name HN) 7.412 0.022 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  16  and name HN) 8.767 0.012 


assign (segid 1T%A and resid 12 and name OS1)                           (not segid 1A and resid  17  and name HN) 8.347 0.019 

# Restraints file 2: HttQ7_HN_gamma2_GB1-Q7-S15C_1to40_update-1.tbl

assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  3  and name HN) 10.086 0.012 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  4  and name HN) 3.209 0.023 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  5  and name HN) 4.363 0.020 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  6  and name HN) 5.749 0.023 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  7  and name HN) 6.139 0.019 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  8  and name HN) 4.080 0.021 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  9  and name HN) 6.587 0.013 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  10  and name HN) 7.635 0.016 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  11  and name HN) 5.121 0.020 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  12  and name HN) 4.630 0.016 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  13  and name HN) 7.513 0.015 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  14  and name HN) 4.971 0.020 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  15  and name HN) 3.756 0.021 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  16  and name HN) 5.121 0.019 


assign (segid 1T%A and resid 15 and name OS1)                           (not segid 1A and resid  17  and name HN) 4.726 0.011 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1           HT1      ALA   1  14.473   8.791  -6.082
    2    H2   ALA   1           HT2      ALA   1  12.797   8.614  -6.290
    3    H3   ALA   1           HT3      ALA   1  13.873   7.629  -7.161
    4    HA   ALA   1           HA       ALA   1  14.641   6.626  -5.081
    5    HB1  ALA   1           HB1      ALA   1  13.389   7.092  -3.027
    6    HB2  ALA   1           HB2      ALA   1  12.367   8.243  -3.889
    7    HB3  ALA   1           HB3      ALA   1  14.081   8.588  -3.655
    8    H    THR   2           HN       THR   2  13.713   4.634  -4.581
    9    HA   THR   2           HA       THR   2  11.691   3.693  -6.336
   10    HB   THR   2           HB       THR   2  11.851   1.601  -5.041
   11    HG1  THR   2           HG1      THR   2  13.349   1.640  -3.262
   12   HG21  THR   2          HG21      THR   2  14.266   1.216  -5.382
   13   HG22  THR   2          HG22      THR   2  14.521   2.955  -5.520
   14   HG23  THR   2          HG23      THR   2  13.565   2.105  -6.734
   15    H    LEU   3           HN       LEU   3  11.683   4.648  -2.929
   16    HA   LEU   3           HA       LEU   3   9.112   3.786  -2.232
   17    HB2  LEU   3           HB2      LEU   3  10.736   6.154  -1.280
   18    HB3  LEU   3           HB1      LEU   3   9.225   5.643  -0.528
   19    HG   LEU   3           HG       LEU   3  11.583   3.784  -0.912
   20   HD11  LEU   3          HD11      LEU   3  10.796   5.426   1.516
   21   HD12  LEU   3          HD12      LEU   3  12.256   5.640   0.549
   22   HD13  LEU   3          HD13      LEU   3  12.035   4.171   1.500
   23   HD21  LEU   3          HD21      LEU   3   9.030   3.692   0.719
   24   HD22  LEU   3          HD22      LEU   3  10.361   2.557   0.938
   25   HD23  LEU   3          HD23      LEU   3   9.494   2.613  -0.596
   26    H    GLU   4           HN       GLU   4  10.187   6.899  -3.586
   27    HA   GLU   4           HA       GLU   4   7.704   8.190  -3.625
   28    HB2  GLU   4           HB2      GLU   4   9.837   9.341  -4.055
   29    HB3  GLU   4           HB1      GLU   4   9.994   8.477  -5.585
   30    HG2  GLU   4           HG2      GLU   4   7.908   9.488  -6.393
   31    HG3  GLU   4           HG1      GLU   4   7.706  10.326  -4.855
   32    H    LYS   5           HN       LYS   5   9.273   6.191  -6.117
   33    HA   LYS   5           HA       LYS   5   7.310   6.421  -8.098
   34    HB2  LYS   5           HB2      LYS   5   9.517   5.417  -8.503
   35    HB3  LYS   5           HB1      LYS   5   9.085   4.046  -7.480
   36    HG2  LYS   5           HG2      LYS   5   7.226   3.486  -8.991
   37    HG3  LYS   5           HG1      LYS   5   7.627   4.870 -10.008
   38    HD2  LYS   5           HD2      LYS   5   9.832   3.912 -10.488
   39    HD3  LYS   5           HD1      LYS   5   9.486   2.547  -9.426
   40    HE2  LYS   5           HE2      LYS   5   9.080   1.910 -11.758
   41    HE3  LYS   5           HE1      LYS   5   7.557   1.939 -10.868
   42    HZ1  LYS   5           HZ1      LYS   5   7.710   3.099 -13.151
   43    HZ2  LYS   5           HZ2      LYS   5   8.477   4.346 -12.289
   44    HZ3  LYS   5           HZ3      LYS   5   6.895   3.877 -11.883
   45    H    LEU   6           HN       LEU   6   7.644   4.023  -5.490
   46    HA   LEU   6           HA       LEU   6   5.426   2.440  -6.127
   47    HB2  LEU   6           HB2      LEU   6   7.090   1.756  -4.471
   48    HB3  LEU   6           HB1      LEU   6   6.600   3.075  -3.408
   49    HG   LEU   6           HG       LEU   6   4.322   2.108  -3.274
   50   HD11  LEU   6          HD11      LEU   6   4.121   0.973  -5.373
   51   HD12  LEU   6          HD12      LEU   6   4.094  -0.283  -4.136
   52   HD13  LEU   6          HD13      LEU   6   5.564   0.008  -5.065
   53   HD21  LEU   6          HD21      LEU   6   4.944   0.092  -1.954
   54   HD22  LEU   6          HD22      LEU   6   5.981   1.469  -1.584
   55   HD23  LEU   6          HD23      LEU   6   6.572   0.176  -2.627
   56    H    MET   7           HN       MET   7   5.665   5.280  -3.996
   57    HA   MET   7           HA       MET   7   3.006   5.333  -3.130
   58    HB2  MET   7           HB2      MET   7   5.117   7.444  -3.442
   59    HB3  MET   7           HB1      MET   7   3.481   7.885  -2.951
   60    HG2  MET   7           HG2      MET   7   5.007   5.680  -1.563
   61    HG3  MET   7           HG1      MET   7   5.161   7.366  -1.068
   62    HE1  MET   7           HE1      MET   7   2.492   4.326   0.253
   63    HE2  MET   7           HE2      MET   7   3.651   4.260  -1.071
   64    HE3  MET   7           HE3      MET   7   1.942   4.500  -1.418
   65    H    LYS   8           HN       LYS   8   4.513   6.908  -5.937
   66    HA   LYS   8           HA       LYS   8   2.253   8.258  -6.887
   67    HB2  LYS   8           HB2      LYS   8   4.515   8.654  -7.762
   68    HB3  LYS   8           HB1      LYS   8   4.526   7.041  -8.475
   69    HG2  LYS   8           HG2      LYS   8   2.692   7.604  -9.947
   70    HG3  LYS   8           HG1      LYS   8   2.458   9.154  -9.137
   71    HD2  LYS   8           HD2      LYS   8   3.688   9.604 -11.153
   72    HD3  LYS   8           HD1      LYS   8   4.828   9.749  -9.815
   73    HE2  LYS   8           HE2      LYS   8   5.859   8.448 -11.600
   74    HE3  LYS   8           HE1      LYS   8   5.546   7.391 -10.224
   75    HZ1  LYS   8           HZ1      LYS   8   3.668   6.485 -11.274
   76    HZ2  LYS   8           HZ2      LYS   8   4.872   6.523 -12.471
   77    HZ3  LYS   8           HZ3      LYS   8   3.638   7.690 -12.467
   78    H    ALA   9           HN       ALA   9   3.448   4.993  -7.648
   79    HA   ALA   9           HA       ALA   9   1.497   4.290  -9.530
   80    HB1  ALA   9           HB1      ALA   9   3.610   3.013  -8.928
   81    HB2  ALA   9           HB2      ALA   9   2.166   2.031  -9.174
   82    HB3  ALA   9           HB3      ALA   9   2.726   2.383  -7.538
   83    H    PHE  10           HN       PHE  10   1.527   3.840  -5.999
   84    HA   PHE  10           HA       PHE  10  -0.920   2.500  -5.752
   85    HB2  PHE  10           HB2      PHE  10   0.722   2.747  -3.921
   86    HB3  PHE  10           HB1      PHE  10   0.336   4.464  -3.820
   87    HD1  PHE  10           HD1      PHE  10  -1.048   1.041  -3.423
   88    HD2  PHE  10           HD2      PHE  10  -1.640   5.236  -2.716
   89    HE1  PHE  10           HE1      PHE  10  -2.965   0.520  -1.939
   90    HE2  PHE  10           HE2      PHE  10  -3.558   4.715  -1.233
   91    HZ   PHE  10           HZ       PHE  10  -4.219   2.357  -0.844
   92    H    GLU  11           HN       GLU  11  -0.208   5.988  -5.651
   93    HA   GLU  11           HA       GLU  11  -2.808   6.904  -5.156
   94    HB2  GLU  11           HB2      GLU  11  -0.513   8.160  -6.673
   95    HB3  GLU  11           HB1      GLU  11  -2.011   9.013  -6.301
   96    HG2  GLU  11           HG2      GLU  11  -0.154   7.749  -4.264
   97    HG3  GLU  11           HG1      GLU  11  -0.280   9.475  -4.601
   98    H    SER  12           HN       SER  12  -1.147   6.319  -8.250
   99    HA   SER  12           HA       SER  12  -3.212   7.148  -9.953
  100    HB2  SER  12           HB2      SER  12  -2.129   5.791 -11.672
  101    HB3  SER  12           HB1      SER  12  -0.916   6.648 -10.727
  102    HG   SER  12           HG       SER  12  -0.630   4.290 -11.148
  103    H    LEU  13           HN       LEU  13  -2.512   3.935  -8.590
  104    HA   LEU  13           HA       LEU  13  -4.593   2.518  -9.819
  105    HB2  LEU  13           HB2      LEU  13  -3.253   2.158  -7.131
  106    HB3  LEU  13           HB1      LEU  13  -4.390   0.995  -7.815
  107    HG   LEU  13           HG       LEU  13  -1.930   1.939  -9.300
  108   HD11  LEU  13          HD11      LEU  13  -1.041  -0.367  -8.624
  109   HD12  LEU  13          HD12      LEU  13  -2.309  -0.382  -7.398
  110   HD13  LEU  13          HD13      LEU  13  -1.059   0.861  -7.358
  111   HD21  LEU  13          HD21      LEU  13  -3.553   0.978 -10.771
  112   HD22  LEU  13          HD22      LEU  13  -3.929  -0.311  -9.628
  113   HD23  LEU  13          HD23      LEU  13  -2.376  -0.300 -10.464
  114    H    LYS  14           HN       LYS  14  -4.533   4.239  -6.704
  115    HA   LYS  14           HA       LYS  14  -7.140   3.640  -5.885
  116    HB2  LYS  14           HB2      LYS  14  -5.264   5.909  -5.290
  117    HB3  LYS  14           HB1      LYS  14  -6.914   5.932  -4.667
  118    HG2  LYS  14           HG2      LYS  14  -5.118   3.530  -4.307
  119    HG3  LYS  14           HG1      LYS  14  -5.122   4.868  -3.156
  120    HD2  LYS  14           HD2      LYS  14  -7.590   4.586  -2.894
  121    HD3  LYS  14           HD1      LYS  14  -7.513   3.179  -3.952
  122    HE2  LYS  14           HE2      LYS  14  -7.447   2.340  -1.710
  123    HE3  LYS  14           HE1      LYS  14  -5.807   2.203  -2.340
  124    HZ1  LYS  14           HZ1      LYS  14  -5.374   4.416  -1.295
  125    HZ2  LYS  14           HZ2      LYS  14  -5.658   3.153  -0.196
  126    HZ3  LYS  14           HZ3      LYS  14  -6.878   4.287  -0.525
  127    H    SER  15           HN       SER  15  -5.926   6.388  -7.787
  128    HA   SER  15           HA       SER  15  -8.352   7.756  -8.085
  129    HB2  SER  15           HB2      SER  15  -5.984   7.567  -9.961
  130    HB3  SER  15           HB1      SER  15  -7.308   8.713 -10.146
  131    HG   SER  15           HG       SER  15  -5.156   8.953  -8.650
  132    H    PHE  16           HN       PHE  16  -6.861   5.243 -10.116
  133    HA   PHE  16           HA       PHE  16  -8.819   5.135 -12.116
  134    HB2  PHE  16           HB2      PHE  16  -6.864   3.132 -11.018
  135    HB3  PHE  16           HB1      PHE  16  -8.034   2.654 -12.246
  136    HD1  PHE  16           HD1      PHE  16  -6.928   6.128 -12.254
  137    HD2  PHE  16           HD2      PHE  16  -6.101   2.197 -13.779
  138    HE1  PHE  16           HE1      PHE  16  -5.487   7.113 -14.013
  139    HE2  PHE  16           HE2      PHE  16  -4.661   3.184 -15.538
  140    HZ   PHE  16           HZ       PHE  16  -4.353   5.641 -15.655
  141    H    GLN  17           HN       GLN  17  -8.563   3.312  -9.073
  142    HA   GLN  17           HA       GLN  17 -10.839   1.712  -9.379
  143    HB2  GLN  17           HB2      GLN  17  -8.993   1.653  -7.559
  144    HB3  GLN  17           HB1      GLN  17 -10.008   2.819  -6.709
  145    HG2  GLN  17           HG2      GLN  17 -11.185   0.269  -7.795
  146    HG3  GLN  17           HG1      GLN  17 -10.374   0.288  -6.230
  147   HE21  GLN  17          HE21      GLN  17 -13.318  -0.054  -6.861
  148   HE22  GLN  17          HE22      GLN  17 -14.097   1.167  -5.977
  149    H1   ALA   1           HT1      ALA   1 -14.473  -8.791  -6.082
  150    H2   ALA   1           HT2      ALA   1 -12.797  -8.614  -6.290
  151    H3   ALA   1           HT3      ALA   1 -13.873  -7.629  -7.161
  152    HA   ALA   1           HA       ALA   1 -14.641  -6.626  -5.081
  153    HB1  ALA   1           HB1      ALA   1 -13.389  -7.092  -3.027
  154    HB2  ALA   1           HB2      ALA   1 -12.367  -8.243  -3.889
  155    HB3  ALA   1           HB3      ALA   1 -14.081  -8.588  -3.655
  156    H    THR   2           HN       THR   2 -13.713  -4.634  -4.581
  157    HA   THR   2           HA       THR   2 -11.691  -3.693  -6.336
  158    HB   THR   2           HB       THR   2 -11.851  -1.601  -5.041
  159    HG1  THR   2           HG1      THR   2 -13.349  -1.640  -3.262
  160   HG21  THR   2          HG21      THR   2 -14.266  -1.216  -5.382
  161   HG22  THR   2          HG22      THR   2 -14.521  -2.955  -5.520
  162   HG23  THR   2          HG23      THR   2 -13.565  -2.105  -6.734
  163    H    LEU   3           HN       LEU   3 -11.683  -4.648  -2.929
  164    HA   LEU   3           HA       LEU   3  -9.112  -3.786  -2.232
  165    HB2  LEU   3           HB2      LEU   3 -10.736  -6.154  -1.280
  166    HB3  LEU   3           HB1      LEU   3  -9.225  -5.643  -0.528
  167    HG   LEU   3           HG       LEU   3 -11.583  -3.784  -0.912
  168   HD11  LEU   3          HD11      LEU   3 -10.796  -5.426   1.516
  169   HD12  LEU   3          HD12      LEU   3 -12.256  -5.640   0.549
  170   HD13  LEU   3          HD13      LEU   3 -12.035  -4.171   1.500
  171   HD21  LEU   3          HD21      LEU   3  -9.030  -3.692   0.719
  172   HD22  LEU   3          HD22      LEU   3 -10.361  -2.557   0.938
  173   HD23  LEU   3          HD23      LEU   3  -9.494  -2.613  -0.596
  174    H    GLU   4           HN       GLU   4 -10.187  -6.899  -3.586
  175    HA   GLU   4           HA       GLU   4  -7.704  -8.190  -3.625
  176    HB2  GLU   4           HB2      GLU   4  -9.837  -9.341  -4.055
  177    HB3  GLU   4           HB1      GLU   4  -9.994  -8.477  -5.585
  178    HG2  GLU   4           HG2      GLU   4  -7.908  -9.488  -6.393
  179    HG3  GLU   4           HG1      GLU   4  -7.706 -10.326  -4.855
  180    H    LYS   5           HN       LYS   5  -9.273  -6.191  -6.117
  181    HA   LYS   5           HA       LYS   5  -7.310  -6.421  -8.098
  182    HB2  LYS   5           HB2      LYS   5  -9.517  -5.417  -8.503
  183    HB3  LYS   5           HB1      LYS   5  -9.085  -4.046  -7.480
  184    HG2  LYS   5           HG2      LYS   5  -7.226  -3.486  -8.991
  185    HG3  LYS   5           HG1      LYS   5  -7.627  -4.870 -10.008
  186    HD2  LYS   5           HD2      LYS   5  -9.832  -3.912 -10.488
  187    HD3  LYS   5           HD1      LYS   5  -9.486  -2.547  -9.426
  188    HE2  LYS   5           HE2      LYS   5  -9.080  -1.910 -11.758
  189    HE3  LYS   5           HE1      LYS   5  -7.557  -1.939 -10.868
  190    HZ1  LYS   5           HZ1      LYS   5  -7.710  -3.099 -13.151
  191    HZ2  LYS   5           HZ2      LYS   5  -8.477  -4.346 -12.289
  192    HZ3  LYS   5           HZ3      LYS   5  -6.895  -3.877 -11.883
  193    H    LEU   6           HN       LEU   6  -7.644  -4.023  -5.490
  194    HA   LEU   6           HA       LEU   6  -5.426  -2.440  -6.127
  195    HB2  LEU   6           HB2      LEU   6  -7.090  -1.756  -4.471
  196    HB3  LEU   6           HB1      LEU   6  -6.600  -3.075  -3.408
  197    HG   LEU   6           HG       LEU   6  -4.322  -2.108  -3.274
  198   HD11  LEU   6          HD11      LEU   6  -4.121  -0.973  -5.373
  199   HD12  LEU   6          HD12      LEU   6  -4.094   0.283  -4.136
  200   HD13  LEU   6          HD13      LEU   6  -5.564  -0.008  -5.065
  201   HD21  LEU   6          HD21      LEU   6  -4.944  -0.092  -1.954
  202   HD22  LEU   6          HD22      LEU   6  -5.981  -1.469  -1.584
  203   HD23  LEU   6          HD23      LEU   6  -6.572  -0.176  -2.627
  204    H    MET   7           HN       MET   7  -5.665  -5.280  -3.996
  205    HA   MET   7           HA       MET   7  -3.006  -5.333  -3.130
  206    HB2  MET   7           HB2      MET   7  -5.117  -7.444  -3.442
  207    HB3  MET   7           HB1      MET   7  -3.481  -7.885  -2.951
  208    HG2  MET   7           HG2      MET   7  -5.007  -5.680  -1.563
  209    HG3  MET   7           HG1      MET   7  -5.161  -7.366  -1.068
  210    HE1  MET   7           HE1      MET   7  -2.492  -4.326   0.253
  211    HE2  MET   7           HE2      MET   7  -3.651  -4.260  -1.071
  212    HE3  MET   7           HE3      MET   7  -1.942  -4.500  -1.418
  213    H    LYS   8           HN       LYS   8  -4.513  -6.908  -5.937
  214    HA   LYS   8           HA       LYS   8  -2.253  -8.258  -6.887
  215    HB2  LYS   8           HB2      LYS   8  -4.515  -8.654  -7.762
  216    HB3  LYS   8           HB1      LYS   8  -4.526  -7.041  -8.475
  217    HG2  LYS   8           HG2      LYS   8  -2.692  -7.604  -9.947
  218    HG3  LYS   8           HG1      LYS   8  -2.458  -9.154  -9.137
  219    HD2  LYS   8           HD2      LYS   8  -3.688  -9.604 -11.153
  220    HD3  LYS   8           HD1      LYS   8  -4.828  -9.749  -9.815
  221    HE2  LYS   8           HE2      LYS   8  -5.859  -8.448 -11.600
  222    HE3  LYS   8           HE1      LYS   8  -5.546  -7.391 -10.224
  223    HZ1  LYS   8           HZ1      LYS   8  -3.668  -6.485 -11.274
  224    HZ2  LYS   8           HZ2      LYS   8  -4.872  -6.523 -12.471
  225    HZ3  LYS   8           HZ3      LYS   8  -3.638  -7.690 -12.467
  226    H    ALA   9           HN       ALA   9  -3.448  -4.993  -7.648
  227    HA   ALA   9           HA       ALA   9  -1.497  -4.290  -9.530
  228    HB1  ALA   9           HB1      ALA   9  -3.610  -3.013  -8.928
  229    HB2  ALA   9           HB2      ALA   9  -2.166  -2.031  -9.174
  230    HB3  ALA   9           HB3      ALA   9  -2.726  -2.383  -7.538
  231    H    PHE  10           HN       PHE  10  -1.527  -3.840  -5.999
  232    HA   PHE  10           HA       PHE  10   0.920  -2.500  -5.752
  233    HB2  PHE  10           HB2      PHE  10  -0.722  -2.747  -3.921
  234    HB3  PHE  10           HB1      PHE  10  -0.336  -4.464  -3.820
  235    HD1  PHE  10           HD1      PHE  10   1.048  -1.041  -3.423
  236    HD2  PHE  10           HD2      PHE  10   1.640  -5.236  -2.716
  237    HE1  PHE  10           HE1      PHE  10   2.965  -0.520  -1.939
  238    HE2  PHE  10           HE2      PHE  10   3.558  -4.715  -1.233
  239    HZ   PHE  10           HZ       PHE  10   4.219  -2.357  -0.844
  240    H    GLU  11           HN       GLU  11   0.208  -5.988  -5.651
  241    HA   GLU  11           HA       GLU  11   2.808  -6.904  -5.156
  242    HB2  GLU  11           HB2      GLU  11   0.513  -8.160  -6.673
  243    HB3  GLU  11           HB1      GLU  11   2.011  -9.013  -6.301
  244    HG2  GLU  11           HG2      GLU  11   0.154  -7.749  -4.264
  245    HG3  GLU  11           HG1      GLU  11   0.280  -9.475  -4.601
  246    H    SER  12           HN       SER  12   1.147  -6.319  -8.250
  247    HA   SER  12           HA       SER  12   3.214  -7.148  -9.950
  248    HB2  SER  12           HB2      SER  12   2.132  -5.793 -11.673
  249    HB3  SER  12           HB1      SER  12   0.919  -6.655 -10.731
  250    HG   SER  12           HG       SER  12   1.711  -3.940 -10.528
  251    H    LEU  13           HN       LEU  13   2.512  -3.935  -8.590
  252    HA   LEU  13           HA       LEU  13   4.593  -2.518  -9.819
  253    HB2  LEU  13           HB2      LEU  13   3.253  -2.158  -7.131
  254    HB3  LEU  13           HB1      LEU  13   4.390  -0.995  -7.815
  255    HG   LEU  13           HG       LEU  13   1.930  -1.939  -9.300
  256   HD11  LEU  13          HD11      LEU  13   1.040   0.367  -8.624
  257   HD12  LEU  13          HD12      LEU  13   2.309   0.382  -7.398
  258   HD13  LEU  13          HD13      LEU  13   1.059  -0.861  -7.358
  259   HD21  LEU  13          HD21      LEU  13   3.553  -0.978 -10.771
  260   HD22  LEU  13          HD22      LEU  13   3.929   0.311  -9.628
  261   HD23  LEU  13          HD23      LEU  13   2.376   0.300 -10.464
  262    H    LYS  14           HN       LYS  14   4.533  -4.239  -6.704
  263    HA   LYS  14           HA       LYS  14   7.140  -3.640  -5.885
  264    HB2  LYS  14           HB2      LYS  14   5.264  -5.909  -5.290
  265    HB3  LYS  14           HB1      LYS  14   6.914  -5.932  -4.667
  266    HG2  LYS  14           HG2      LYS  14   5.118  -3.530  -4.307
  267    HG3  LYS  14           HG1      LYS  14   5.122  -4.868  -3.156
  268    HD2  LYS  14           HD2      LYS  14   7.590  -4.586  -2.894
  269    HD3  LYS  14           HD1      LYS  14   7.513  -3.179  -3.952
  270    HE2  LYS  14           HE2      LYS  14   7.447  -2.340  -1.710
  271    HE3  LYS  14           HE1      LYS  14   5.807  -2.203  -2.340
  272    HZ1  LYS  14           HZ1      LYS  14   5.374  -4.416  -1.295
  273    HZ2  LYS  14           HZ2      LYS  14   5.658  -3.153  -0.196
  274    HZ3  LYS  14           HZ3      LYS  14   6.878  -4.287  -0.525
  275    H    SER  15           HN       SER  15   5.926  -6.388  -7.787
  276    HA   SER  15           HA       SER  15   8.355  -7.750  -8.082
  277    HB2  SER  15           HB2      SER  15   7.335  -8.827 -10.023
  278    HB3  SER  15           HB1      SER  15   6.161  -8.705  -8.717
  279    HG   SER  15           HG       SER  15   5.463  -8.033 -10.891
  280    H    PHE  16           HN       PHE  16   6.861  -5.243 -10.116
  281    HA   PHE  16           HA       PHE  16   8.819  -5.135 -12.115
  282    HB2  PHE  16           HB2      PHE  16   7.059  -2.937 -11.001
  283    HB3  PHE  16           HB1      PHE  16   8.022  -2.789 -12.470
  284    HD1  PHE  16           HD1      PHE  16   4.828  -2.952 -11.740
  285    HD2  PHE  16           HD2      PHE  16   7.715  -5.481 -13.670
  286    HE1  PHE  16           HE1      PHE  16   3.013  -4.030 -13.040
  287    HE2  PHE  16           HE2      PHE  16   5.899  -6.559 -14.971
  288    HZ   PHE  16           HZ       PHE  16   3.548  -5.833 -14.656
  289    H    GLN  17           HN       GLN  17   8.563  -3.312  -9.073
  290    HA   GLN  17           HA       GLN  17  10.839  -1.712  -9.379
  291    HB2  GLN  17           HB2      GLN  17   8.993  -1.653  -7.559
  292    HB3  GLN  17           HB1      GLN  17  10.008  -2.819  -6.709
  293    HG2  GLN  17           HG2      GLN  17  11.185  -0.269  -7.795
  294    HG3  GLN  17           HG1      GLN  17  10.374  -0.288  -6.230
  295   HE21  GLN  17          HE21      GLN  17  13.318   0.054  -6.861
  296   HE22  GLN  17          HE22      GLN  17  14.097  -1.167  -5.977
  297    H1   ALA   1           HT1      ALA   1   8.791  14.473   6.082
  298    H2   ALA   1           HT2      ALA   1   8.614  12.797   6.290
  299    H3   ALA   1           HT3      ALA   1   7.629  13.873   7.161
  300    HA   ALA   1           HA       ALA   1   6.626  14.641   5.081
  301    HB1  ALA   1           HB1      ALA   1   7.092  13.389   3.027
  302    HB2  ALA   1           HB2      ALA   1   8.243  12.367   3.889
  303    HB3  ALA   1           HB3      ALA   1   8.588  14.081   3.655
  304    H    THR   2           HN       THR   2   4.634  13.713   4.581
  305    HA   THR   2           HA       THR   2   3.693  11.691   6.336
  306    HB   THR   2           HB       THR   2   1.601  11.851   5.041
  307    HG1  THR   2           HG1      THR   2   1.640  13.349   3.262
  308   HG21  THR   2          HG21      THR   2   1.216  14.266   5.382
  309   HG22  THR   2          HG22      THR   2   2.955  14.521   5.520
  310   HG23  THR   2          HG23      THR   2   2.105  13.565   6.734
  311    H    LEU   3           HN       LEU   3   4.648  11.683   2.929
  312    HA   LEU   3           HA       LEU   3   3.786   9.112   2.232
  313    HB2  LEU   3           HB2      LEU   3   6.154  10.736   1.280
  314    HB3  LEU   3           HB1      LEU   3   5.643   9.225   0.528
  315    HG   LEU   3           HG       LEU   3   3.784  11.583   0.912
  316   HD11  LEU   3          HD11      LEU   3   5.426  10.796  -1.516
  317   HD12  LEU   3          HD12      LEU   3   5.640  12.256  -0.549
  318   HD13  LEU   3          HD13      LEU   3   4.171  12.035  -1.500
  319   HD21  LEU   3          HD21      LEU   3   3.692   9.030  -0.719
  320   HD22  LEU   3          HD22      LEU   3   2.557  10.361  -0.938
  321   HD23  LEU   3          HD23      LEU   3   2.613   9.494   0.596
  322    H    GLU   4           HN       GLU   4   6.899  10.187   3.586
  323    HA   GLU   4           HA       GLU   4   8.190   7.704   3.625
  324    HB2  GLU   4           HB2      GLU   4   9.341   9.837   4.055
  325    HB3  GLU   4           HB1      GLU   4   8.477   9.994   5.585
  326    HG2  GLU   4           HG2      GLU   4   9.488   7.908   6.393
  327    HG3  GLU   4           HG1      GLU   4  10.326   7.706   4.855
  328    H    LYS   5           HN       LYS   5   6.191   9.273   6.117
  329    HA   LYS   5           HA       LYS   5   6.423   7.306   8.094
  330    HB2  LYS   5           HB2      LYS   5   5.421   9.538   8.468
  331    HB3  LYS   5           HB1      LYS   5   4.020   9.052   7.511
  332    HG2  LYS   5           HG2      LYS   5   3.540   7.237   9.084
  333    HG3  LYS   5           HG1      LYS   5   4.977   7.645  10.021
  334    HD2  LYS   5           HD2      LYS   5   4.042   9.878  10.495
  335    HD3  LYS   5           HD1      LYS   5   2.601   9.472   9.560
  336    HE2  LYS   5           HE2      LYS   5   2.172   9.129  11.951
  337    HE3  LYS   5           HE1      LYS   5   2.153   7.582  11.106
  338    HZ1  LYS   5           HZ1      LYS   5   3.495   7.796  13.270
  339    HZ2  LYS   5           HZ2      LYS   5   4.645   8.595  12.309
  340    HZ3  LYS   5           HZ3      LYS   5   4.202   6.994  11.954
  341    H    LEU   6           HN       LEU   6   4.023   7.644   5.490
  342    HA   LEU   6           HA       LEU   6   2.440   5.426   6.127
  343    HB2  LEU   6           HB2      LEU   6   1.756   7.090   4.471
  344    HB3  LEU   6           HB1      LEU   6   3.075   6.600   3.408
  345    HG   LEU   6           HG       LEU   6   2.108   4.322   3.274
  346   HD11  LEU   6          HD11      LEU   6   0.973   4.121   5.373
  347   HD12  LEU   6          HD12      LEU   6  -0.283   4.094   4.136
  348   HD13  LEU   6          HD13      LEU   6   0.008   5.564   5.065
  349   HD21  LEU   6          HD21      LEU   6   0.092   4.944   1.954
  350   HD22  LEU   6          HD22      LEU   6   1.469   5.981   1.584
  351   HD23  LEU   6          HD23      LEU   6   0.176   6.572   2.627
  352    H    MET   7           HN       MET   7   5.280   5.665   3.996
  353    HA   MET   7           HA       MET   7   5.333   3.006   3.130
  354    HB2  MET   7           HB2      MET   7   7.444   5.117   3.442
  355    HB3  MET   7           HB1      MET   7   7.885   3.481   2.951
  356    HG2  MET   7           HG2      MET   7   5.680   5.007   1.563
  357    HG3  MET   7           HG1      MET   7   7.366   5.161   1.068
  358    HE1  MET   7           HE1      MET   7   4.326   2.492  -0.253
  359    HE2  MET   7           HE2      MET   7   4.260   3.651   1.071
  360    HE3  MET   7           HE3      MET   7   4.500   1.942   1.418
  361    H    LYS   8           HN       LYS   8   6.908   4.513   5.937
  362    HA   LYS   8           HA       LYS   8   8.258   2.253   6.887
  363    HB2  LYS   8           HB2      LYS   8   8.654   4.515   7.762
  364    HB3  LYS   8           HB1      LYS   8   7.041   4.526   8.475
  365    HG2  LYS   8           HG2      LYS   8   7.604   2.692   9.947
  366    HG3  LYS   8           HG1      LYS   8   9.154   2.458   9.137
  367    HD2  LYS   8           HD2      LYS   8   9.604   3.688  11.153
  368    HD3  LYS   8           HD1      LYS   8   9.749   4.828   9.815
  369    HE2  LYS   8           HE2      LYS   8   8.448   5.859  11.600
  370    HE3  LYS   8           HE1      LYS   8   7.391   5.546  10.224
  371    HZ1  LYS   8           HZ1      LYS   8   6.485   3.668  11.274
  372    HZ2  LYS   8           HZ2      LYS   8   6.523   4.872  12.471
  373    HZ3  LYS   8           HZ3      LYS   8   7.690   3.638  12.467
  374    H    ALA   9           HN       ALA   9   4.993   3.448   7.648
  375    HA   ALA   9           HA       ALA   9   4.290   1.497   9.530
  376    HB1  ALA   9           HB1      ALA   9   3.013   3.610   8.928
  377    HB2  ALA   9           HB2      ALA   9   2.031   2.166   9.174
  378    HB3  ALA   9           HB3      ALA   9   2.383   2.726   7.538
  379    H    PHE  10           HN       PHE  10   3.840   1.527   5.999
  380    HA   PHE  10           HA       PHE  10   2.500  -0.920   5.752
  381    HB2  PHE  10           HB2      PHE  10   2.747   0.722   3.921
  382    HB3  PHE  10           HB1      PHE  10   4.464   0.336   3.820
  383    HD1  PHE  10           HD1      PHE  10   1.041  -1.048   3.423
  384    HD2  PHE  10           HD2      PHE  10   5.236  -1.640   2.716
  385    HE1  PHE  10           HE1      PHE  10   0.520  -2.965   1.939
  386    HE2  PHE  10           HE2      PHE  10   4.715  -3.558   1.233
  387    HZ   PHE  10           HZ       PHE  10   2.357  -4.219   0.844
  388    H    GLU  11           HN       GLU  11   5.988  -0.208   5.651
  389    HA   GLU  11           HA       GLU  11   6.904  -2.808   5.156
  390    HB2  GLU  11           HB2      GLU  11   8.160  -0.513   6.673
  391    HB3  GLU  11           HB1      GLU  11   9.013  -2.011   6.301
  392    HG2  GLU  11           HG2      GLU  11   7.749  -0.154   4.264
  393    HG3  GLU  11           HG1      GLU  11   9.475  -0.280   4.601
  394    H    SER  12           HN       SER  12   6.319  -1.147   8.250
  395    HA   SER  12           HA       SER  12   7.148  -3.205   9.962
  396    HB2  SER  12           HB2      SER  12   5.002  -1.104  10.339
  397    HB3  SER  12           HB1      SER  12   5.613  -2.138  11.627
  398    HG   SER  12           HG       SER  12   6.612   0.124  10.863
  399    H    LEU  13           HN       LEU  13   3.935  -2.512   8.590
  400    HA   LEU  13           HA       LEU  13   2.518  -4.593   9.819
  401    HB2  LEU  13           HB2      LEU  13   2.158  -3.253   7.131
  402    HB3  LEU  13           HB1      LEU  13   0.995  -4.390   7.815
  403    HG   LEU  13           HG       LEU  13   1.939  -1.930   9.300
  404   HD11  LEU  13          HD11      LEU  13  -0.367  -1.041   8.624
  405   HD12  LEU  13          HD12      LEU  13  -0.382  -2.309   7.398
  406   HD13  LEU  13          HD13      LEU  13   0.861  -1.059   7.358
  407   HD21  LEU  13          HD21      LEU  13   0.978  -3.553  10.771
  408   HD22  LEU  13          HD22      LEU  13  -0.311  -3.929   9.628
  409   HD23  LEU  13          HD23      LEU  13  -0.300  -2.376  10.464
  410    H    LYS  14           HN       LYS  14   4.239  -4.533   6.704
  411    HA   LYS  14           HA       LYS  14   3.640  -7.140   5.885
  412    HB2  LYS  14           HB2      LYS  14   5.909  -5.264   5.290
  413    HB3  LYS  14           HB1      LYS  14   5.932  -6.914   4.667
  414    HG2  LYS  14           HG2      LYS  14   3.530  -5.118   4.307
  415    HG3  LYS  14           HG1      LYS  14   4.868  -5.122   3.156
  416    HD2  LYS  14           HD2      LYS  14   4.586  -7.590   2.894
  417    HD3  LYS  14           HD1      LYS  14   3.179  -7.513   3.952
  418    HE2  LYS  14           HE2      LYS  14   2.340  -7.447   1.710
  419    HE3  LYS  14           HE1      LYS  14   2.203  -5.807   2.340
  420    HZ1  LYS  14           HZ1      LYS  14   4.416  -5.374   1.295
  421    HZ2  LYS  14           HZ2      LYS  14   3.153  -5.658   0.196
  422    HZ3  LYS  14           HZ3      LYS  14   4.287  -6.878   0.525
  423    H    SER  15           HN       SER  15   6.388  -5.926   7.787
  424    HA   SER  15           HA       SER  15   7.750  -8.355   8.082
  425    HB2  SER  15           HB2      SER  15   8.827  -7.335  10.024
  426    HB3  SER  15           HB1      SER  15   8.705  -6.162   8.717
  427    HG   SER  15           HG       SER  15   8.038  -5.426  10.858
  428    H    PHE  16           HN       PHE  16   5.243  -6.861  10.116
  429    HA   PHE  16           HA       PHE  16   5.134  -8.815  12.118
  430    HB2  PHE  16           HB2      PHE  16   4.002  -6.656  12.313
  431    HB3  PHE  16           HB1      PHE  16   2.916  -7.086  10.993
  432    HD1  PHE  16           HD1      PHE  16   3.982  -8.078  14.427
  433    HD2  PHE  16           HD2      PHE  16   0.964  -8.368  11.385
  434    HE1  PHE  16           HE1      PHE  16   2.460  -9.184  16.043
  435    HE2  PHE  16           HE2      PHE  16  -0.558  -9.473  13.002
  436    HZ   PHE  16           HZ       PHE  16   0.189  -9.881  15.330
  437    H    GLN  17           HN       GLN  17   3.312  -8.563   9.073
  438    HA   GLN  17           HA       GLN  17   1.712 -10.839   9.379
  439    HB2  GLN  17           HB2      GLN  17   1.653  -8.993   7.559
  440    HB3  GLN  17           HB1      GLN  17   2.819 -10.008   6.709
  441    HG2  GLN  17           HG2      GLN  17   0.269 -11.185   7.795
  442    HG3  GLN  17           HG1      GLN  17   0.288 -10.374   6.230
  443   HE21  GLN  17          HE21      GLN  17  -0.054 -13.318   6.861
  444   HE22  GLN  17          HE22      GLN  17   1.167 -14.097   5.977
  445    H1   ALA   1           HT1      ALA   1  -8.791 -14.473   6.082
  446    H2   ALA   1           HT2      ALA   1  -8.614 -12.797   6.290
  447    H3   ALA   1           HT3      ALA   1  -7.629 -13.873   7.161
  448    HA   ALA   1           HA       ALA   1  -6.626 -14.641   5.081
  449    HB1  ALA   1           HB1      ALA   1  -7.092 -13.389   3.027
  450    HB2  ALA   1           HB2      ALA   1  -8.243 -12.367   3.889
  451    HB3  ALA   1           HB3      ALA   1  -8.588 -14.081   3.655
  452    H    THR   2           HN       THR   2  -4.634 -13.713   4.581
  453    HA   THR   2           HA       THR   2  -3.693 -11.691   6.336
  454    HB   THR   2           HB       THR   2  -1.601 -11.851   5.041
  455    HG1  THR   2           HG1      THR   2  -1.640 -13.349   3.262
  456   HG21  THR   2          HG21      THR   2  -1.216 -14.266   5.382
  457   HG22  THR   2          HG22      THR   2  -2.955 -14.521   5.520
  458   HG23  THR   2          HG23      THR   2  -2.105 -13.565   6.734
  459    H    LEU   3           HN       LEU   3  -4.648 -11.683   2.929
  460    HA   LEU   3           HA       LEU   3  -3.786  -9.112   2.232
  461    HB2  LEU   3           HB2      LEU   3  -6.154 -10.736   1.280
  462    HB3  LEU   3           HB1      LEU   3  -5.643  -9.225   0.528
  463    HG   LEU   3           HG       LEU   3  -3.784 -11.583   0.912
  464   HD11  LEU   3          HD11      LEU   3  -5.426 -10.796  -1.516
  465   HD12  LEU   3          HD12      LEU   3  -5.640 -12.256  -0.549
  466   HD13  LEU   3          HD13      LEU   3  -4.171 -12.035  -1.500
  467   HD21  LEU   3          HD21      LEU   3  -3.692  -9.030  -0.719
  468   HD22  LEU   3          HD22      LEU   3  -2.557 -10.361  -0.938
  469   HD23  LEU   3          HD23      LEU   3  -2.613  -9.494   0.596
  470    H    GLU   4           HN       GLU   4  -6.899 -10.187   3.586
  471    HA   GLU   4           HA       GLU   4  -8.190  -7.704   3.625
  472    HB2  GLU   4           HB2      GLU   4  -9.341  -9.837   4.055
  473    HB3  GLU   4           HB1      GLU   4  -8.477  -9.994   5.585
  474    HG2  GLU   4           HG2      GLU   4  -9.488  -7.908   6.393
  475    HG3  GLU   4           HG1      GLU   4 -10.326  -7.706   4.855
  476    H    LYS   5           HN       LYS   5  -6.191  -9.273   6.117
  477    HA   LYS   5           HA       LYS   5  -6.421  -7.311   8.099
  478    HB2  LYS   5           HB2      LYS   5  -5.420  -9.520   8.498
  479    HB3  LYS   5           HB1      LYS   5  -4.049  -9.087   7.476
  480    HG2  LYS   5           HG2      LYS   5  -3.478  -7.240   8.992
  481    HG3  LYS   5           HG1      LYS   5  -4.869  -7.630  10.006
  482    HD2  LYS   5           HD2      LYS   5  -3.933  -9.843  10.486
  483    HD3  LYS   5           HD1      LYS   5  -2.564  -9.512   9.424
  484    HE2  LYS   5           HE2      LYS   5  -1.930  -9.116  11.759
  485    HE3  LYS   5           HE1      LYS   5  -1.930  -7.595  10.867
  486    HZ1  LYS   5           HZ1      LYS   5  -3.098  -7.718  13.145
  487    HZ2  LYS   5           HZ2      LYS   5  -4.354  -8.477  12.288
  488    HZ3  LYS   5           HZ3      LYS   5  -3.867  -6.903  11.872
  489    H    LEU   6           HN       LEU   6  -4.023  -7.644   5.490
  490    HA   LEU   6           HA       LEU   6  -2.440  -5.426   6.127
  491    HB2  LEU   6           HB2      LEU   6  -1.756  -7.090   4.471
  492    HB3  LEU   6           HB1      LEU   6  -3.075  -6.600   3.408
  493    HG   LEU   6           HG       LEU   6  -2.108  -4.322   3.274
  494   HD11  LEU   6          HD11      LEU   6  -0.973  -4.121   5.373
  495   HD12  LEU   6          HD12      LEU   6   0.283  -4.094   4.136
  496   HD13  LEU   6          HD13      LEU   6  -0.008  -5.564   5.065
  497   HD21  LEU   6          HD21      LEU   6  -0.092  -4.944   1.954
  498   HD22  LEU   6          HD22      LEU   6  -1.469  -5.981   1.584
  499   HD23  LEU   6          HD23      LEU   6  -0.176  -6.572   2.627
  500    H    MET   7           HN       MET   7  -5.280  -5.665   3.996
  501    HA   MET   7           HA       MET   7  -5.333  -3.006   3.130
  502    HB2  MET   7           HB2      MET   7  -7.444  -5.117   3.442
  503    HB3  MET   7           HB1      MET   7  -7.885  -3.481   2.951
  504    HG2  MET   7           HG2      MET   7  -5.680  -5.007   1.563
  505    HG3  MET   7           HG1      MET   7  -7.366  -5.161   1.068
  506    HE1  MET   7           HE1      MET   7  -4.326  -2.492  -0.253
  507    HE2  MET   7           HE2      MET   7  -4.260  -3.651   1.071
  508    HE3  MET   7           HE3      MET   7  -4.500  -1.942   1.418
  509    H    LYS   8           HN       LYS   8  -6.908  -4.513   5.937
  510    HA   LYS   8           HA       LYS   8  -8.258  -2.253   6.887
  511    HB2  LYS   8           HB2      LYS   8  -8.654  -4.515   7.762
  512    HB3  LYS   8           HB1      LYS   8  -7.041  -4.526   8.475
  513    HG2  LYS   8           HG2      LYS   8  -7.604  -2.692   9.947
  514    HG3  LYS   8           HG1      LYS   8  -9.154  -2.458   9.137
  515    HD2  LYS   8           HD2      LYS   8  -9.604  -3.688  11.153
  516    HD3  LYS   8           HD1      LYS   8  -9.749  -4.828   9.815
  517    HE2  LYS   8           HE2      LYS   8  -8.448  -5.859  11.600
  518    HE3  LYS   8           HE1      LYS   8  -7.391  -5.546  10.224
  519    HZ1  LYS   8           HZ1      LYS   8  -6.485  -3.668  11.274
  520    HZ2  LYS   8           HZ2      LYS   8  -6.523  -4.872  12.471
  521    HZ3  LYS   8           HZ3      LYS   8  -7.690  -3.638  12.467
  522    H    ALA   9           HN       ALA   9  -4.993  -3.448   7.648
  523    HA   ALA   9           HA       ALA   9  -4.290  -1.497   9.530
  524    HB1  ALA   9           HB1      ALA   9  -3.013  -3.610   8.928
  525    HB2  ALA   9           HB2      ALA   9  -2.031  -2.166   9.174
  526    HB3  ALA   9           HB3      ALA   9  -2.383  -2.726   7.538
  527    H    PHE  10           HN       PHE  10  -3.840  -1.527   5.999
  528    HA   PHE  10           HA       PHE  10  -2.500   0.920   5.752
  529    HB2  PHE  10           HB2      PHE  10  -2.747  -0.722   3.921
  530    HB3  PHE  10           HB1      PHE  10  -4.464  -0.336   3.820
  531    HD1  PHE  10           HD1      PHE  10  -1.041   1.048   3.423
  532    HD2  PHE  10           HD2      PHE  10  -5.236   1.640   2.716
  533    HE1  PHE  10           HE1      PHE  10  -0.520   2.965   1.939
  534    HE2  PHE  10           HE2      PHE  10  -4.715   3.558   1.233
  535    HZ   PHE  10           HZ       PHE  10  -2.357   4.219   0.844
  536    H    GLU  11           HN       GLU  11  -5.988   0.208   5.651
  537    HA   GLU  11           HA       GLU  11  -6.904   2.808   5.156
  538    HB2  GLU  11           HB2      GLU  11  -8.160   0.513   6.673
  539    HB3  GLU  11           HB1      GLU  11  -9.013   2.011   6.301
  540    HG2  GLU  11           HG2      GLU  11  -7.749   0.154   4.264
  541    HG3  GLU  11           HG1      GLU  11  -9.475   0.280   4.601
  542    H    SER  12           HN       SER  12  -6.319   1.147   8.250
  543    HA   SER  12           HA       SER  12  -7.148   3.205   9.962
  544    HB2  SER  12           HB2      SER  12  -6.650   0.936  10.760
  545    HB3  SER  12           HB1      SER  12  -4.946   1.164  10.376
  546    HG   SER  12           HG       SER  12  -4.729   2.454  12.060
  547    H    LEU  13           HN       LEU  13  -3.935   2.512   8.590
  548    HA   LEU  13           HA       LEU  13  -2.518   4.593   9.819
  549    HB2  LEU  13           HB2      LEU  13  -2.158   3.253   7.131
  550    HB3  LEU  13           HB1      LEU  13  -0.995   4.390   7.815
  551    HG   LEU  13           HG       LEU  13  -1.939   1.930   9.300
  552   HD11  LEU  13          HD11      LEU  13   0.367   1.041   8.624
  553   HD12  LEU  13          HD12      LEU  13   0.382   2.309   7.398
  554   HD13  LEU  13          HD13      LEU  13  -0.861   1.059   7.358
  555   HD21  LEU  13          HD21      LEU  13  -0.978   3.553  10.771
  556   HD22  LEU  13          HD22      LEU  13   0.311   3.929   9.628
  557   HD23  LEU  13          HD23      LEU  13   0.300   2.376  10.464
  558    H    LYS  14           HN       LYS  14  -4.239   4.533   6.704
  559    HA   LYS  14           HA       LYS  14  -3.640   7.140   5.885
  560    HB2  LYS  14           HB2      LYS  14  -5.909   5.264   5.290
  561    HB3  LYS  14           HB1      LYS  14  -5.932   6.914   4.667
  562    HG2  LYS  14           HG2      LYS  14  -3.530   5.118   4.307
  563    HG3  LYS  14           HG1      LYS  14  -4.868   5.122   3.156
  564    HD2  LYS  14           HD2      LYS  14  -4.586   7.590   2.894
  565    HD3  LYS  14           HD1      LYS  14  -3.179   7.513   3.952
  566    HE2  LYS  14           HE2      LYS  14  -2.340   7.447   1.710
  567    HE3  LYS  14           HE1      LYS  14  -2.203   5.807   2.340
  568    HZ1  LYS  14           HZ1      LYS  14  -4.416   5.374   1.295
  569    HZ2  LYS  14           HZ2      LYS  14  -3.153   5.658   0.196
  570    HZ3  LYS  14           HZ3      LYS  14  -4.287   6.878   0.525
  571    H    SER  15           HN       SER  15  -6.388   5.926   7.787
  572    HA   SER  15           HA       SER  15  -7.759   8.350   8.086
  573    HB2  SER  15           HB2      SER  15  -7.558   5.980   9.959
  574    HB3  SER  15           HB1      SER  15  -8.704   7.303  10.156
  575    HG   SER  15           HG       SER  15  -8.620   5.247   8.284
  576    H    PHE  16           HN       PHE  16  -5.243   6.861  10.116
  577    HA   PHE  16           HA       PHE  16  -5.138   8.819  12.114
  578    HB2  PHE  16           HB2      PHE  16  -3.994   6.688  12.361
  579    HB3  PHE  16           HB1      PHE  16  -2.925   7.072  11.012
  580    HD1  PHE  16           HD1      PHE  16  -3.927   8.139  14.437
  581    HD2  PHE  16           HD2      PHE  16  -0.987   8.419  11.318
  582    HE1  PHE  16           HE1      PHE  16  -2.394   9.321  15.988
  583    HE2  PHE  16           HE2      PHE  16   0.545   9.600  12.870
  584    HZ   PHE  16           HZ       PHE  16  -0.158  10.051  15.203
  585    H    GLN  17           HN       GLN  17  -3.312   8.563   9.073
  586    HA   GLN  17           HA       GLN  17  -1.712  10.839   9.379
  587    HB2  GLN  17           HB2      GLN  17  -1.653   8.993   7.559
  588    HB3  GLN  17           HB1      GLN  17  -2.819  10.008   6.709
  589    HG2  GLN  17           HG2      GLN  17  -0.269  11.185   7.795
  590    HG3  GLN  17           HG1      GLN  17  -0.288  10.374   6.230
  591   HE21  GLN  17          HE21      GLN  17   0.054  13.318   6.861
  592   HE22  GLN  17          HE22      GLN  17  -1.167  14.097   5.977
  Start of MODEL    2
    1    H1   ALA   1           HT1      ALA   1  12.174  -0.915  -1.860
    2    H2   ALA   1           HT2      ALA   1  11.690   0.562  -1.174
    3    H3   ALA   1           HT3      ALA   1  13.117   0.475  -2.093
    4    HA   ALA   1           HA       ALA   1  11.925   0.102  -4.095
    5    HB1  ALA   1           HB1      ALA   1  10.184  -1.344  -3.036
    6    HB2  ALA   1           HB2      ALA   1   9.495  -0.125  -4.107
    7    HB3  ALA   1           HB3      ALA   1   9.437   0.103  -2.359
    8    H    THR   2           HN       THR   2  11.257   1.878  -5.311
    9    HA   THR   2           HA       THR   2  11.758   4.430  -4.291
   10    HB   THR   2           HB       THR   2  10.381   5.132  -6.405
   11    HG1  THR   2           HG1      THR   2   9.494   2.872  -6.392
   12   HG21  THR   2          HG21      THR   2  12.831   3.376  -6.703
   13   HG22  THR   2          HG22      THR   2  12.874   5.057  -6.172
   14   HG23  THR   2          HG23      THR   2  12.313   4.659  -7.796
   15    H    LEU   3           HN       LEU   3  10.641   5.365  -2.695
   16    HA   LEU   3           HA       LEU   3   8.007   4.786  -1.940
   17    HB2  LEU   3           HB2      LEU   3   9.658   7.288  -1.515
   18    HB3  LEU   3           HB1      LEU   3   8.130   6.956  -0.699
   19    HG   LEU   3           HG       LEU   3  10.533   5.114  -0.592
   20   HD11  LEU   3          HD11      LEU   3  10.699   5.987   1.781
   21   HD12  LEU   3          HD12      LEU   3   9.569   7.259   1.318
   22   HD13  LEU   3          HD13      LEU   3  11.145   7.152   0.535
   23   HD21  LEU   3          HD21      LEU   3   9.219   4.255   1.419
   24   HD22  LEU   3          HD22      LEU   3   8.509   3.906  -0.155
   25   HD23  LEU   3          HD23      LEU   3   7.862   5.216   0.832
   26    H    GLU   4           HN       GLU   4   9.275   7.435  -3.953
   27    HA   GLU   4           HA       GLU   4   6.857   8.762  -4.427
   28    HB2  GLU   4           HB2      GLU   4   9.337   8.486  -6.135
   29    HB3  GLU   4           HB1      GLU   4   7.997   9.562  -6.533
   30    HG2  GLU   4           HG2      GLU   4   9.570   9.638  -3.942
   31    HG3  GLU   4           HG1      GLU   4   9.807  10.738  -5.299
   32    H    LYS   5           HN       LYS   5   8.430   6.160  -6.278
   33    HA   LYS   5           HA       LYS   5   6.559   5.965  -8.349
   34    HB2  LYS   5           HB2      LYS   5   8.860   4.779  -8.014
   35    HB3  LYS   5           HB1      LYS   5   7.900   3.527  -7.224
   36    HG2  LYS   5           HG2      LYS   5   6.888   4.529  -9.838
   37    HG3  LYS   5           HG1      LYS   5   8.348   3.540  -9.881
   38    HD2  LYS   5           HD2      LYS   5   7.255   1.704  -8.818
   39    HD3  LYS   5           HD1      LYS   5   5.873   2.699  -8.362
   40    HE2  LYS   5           HE2      LYS   5   5.252   1.341 -10.281
   41    HE3  LYS   5           HE1      LYS   5   5.367   3.025 -10.791
   42    HZ1  LYS   5           HZ1      LYS   5   7.830   2.310 -11.269
   43    HZ2  LYS   5           HZ2      LYS   5   6.598   2.032 -12.405
   44    HZ3  LYS   5           HZ3      LYS   5   7.131   0.771 -11.399
   45    H    LEU   6           HN       LEU   6   6.683   4.268  -5.223
   46    HA   LEU   6           HA       LEU   6   4.419   2.655  -5.565
   47    HB2  LEU   6           HB2      LEU   6   5.983   2.339  -3.712
   48    HB3  LEU   6           HB1      LEU   6   5.507   3.892  -3.025
   49    HG   LEU   6           HG       LEU   6   3.264   2.059  -3.602
   50   HD11  LEU   6          HD11      LEU   6   4.925   0.431  -2.816
   51   HD12  LEU   6          HD12      LEU   6   3.697   0.691  -1.576
   52   HD13  LEU   6          HD13      LEU   6   5.282   1.449  -1.420
   53   HD21  LEU   6          HD21      LEU   6   4.156   3.834  -1.316
   54   HD22  LEU   6          HD22      LEU   6   2.711   2.827  -1.227
   55   HD23  LEU   6          HD23      LEU   6   2.821   4.106  -2.436
   56    H    MET   7           HN       MET   7   4.704   5.919  -4.178
   57    HA   MET   7           HA       MET   7   2.020   6.284  -3.473
   58    HB2  MET   7           HB2      MET   7   3.897   7.794  -2.834
   59    HB3  MET   7           HB1      MET   7   3.929   8.400  -4.490
   60    HG2  MET   7           HG2      MET   7   2.581   9.938  -3.239
   61    HG3  MET   7           HG1      MET   7   1.464   8.970  -4.202
   62    HE1  MET   7           HE1      MET   7  -0.810   9.036  -2.733
   63    HE2  MET   7           HE2      MET   7  -0.858   7.454  -1.959
   64    HE3  MET   7           HE3      MET   7  -0.161   7.618  -3.569
   65    H    LYS   8           HN       LYS   8   3.703   7.060  -6.510
   66    HA   LYS   8           HA       LYS   8   1.544   8.212  -7.869
   67    HB2  LYS   8           HB2      LYS   8   3.941   6.666  -8.865
   68    HB3  LYS   8           HB1      LYS   8   2.783   7.441  -9.947
   69    HG2  LYS   8           HG2      LYS   8   3.245   9.616  -8.980
   70    HG3  LYS   8           HG1      LYS   8   4.267   8.892  -7.738
   71    HD2  LYS   8           HD2      LYS   8   5.711   9.787  -9.465
   72    HD3  LYS   8           HD1      LYS   8   5.761   8.027  -9.569
   73    HE2  LYS   8           HE2      LYS   8   4.135   8.058 -11.398
   74    HE3  LYS   8           HE1      LYS   8   3.989   9.810 -11.266
   75    HZ1  LYS   8           HZ1      LYS   8   6.569   9.680 -11.569
   76    HZ2  LYS   8           HZ2      LYS   8   5.532   9.640 -12.915
   77    HZ3  LYS   8           HZ3      LYS   8   6.203   8.200 -12.312
   78    H    ALA   9           HN       ALA   9   2.621   4.821  -7.755
   79    HA   ALA   9           HA       ALA   9   0.718   3.746  -9.504
   80    HB1  ALA   9           HB1      ALA   9   2.174   2.573  -7.135
   81    HB2  ALA   9           HB2      ALA   9   2.527   2.354  -8.849
   82    HB3  ALA   9           HB3      ALA   9   1.088   1.618  -8.145
   83    H    PHE  10           HN       PHE  10   0.587   4.174  -5.973
   84    HA   PHE  10           HA       PHE  10  -1.925   3.020  -5.534
   85    HB2  PHE  10           HB2      PHE  10  -0.282   3.696  -3.766
   86    HB3  PHE  10           HB1      PHE  10  -0.753   5.374  -4.040
   87    HD1  PHE  10           HD1      PHE  10  -2.492   2.068  -3.632
   88    HD2  PHE  10           HD2      PHE  10  -2.307   6.216  -2.534
   89    HE1  PHE  10           HE1      PHE  10  -4.444   1.758  -2.136
   90    HE2  PHE  10           HE2      PHE  10  -4.261   5.907  -1.040
   91    HZ   PHE  10           HZ       PHE  10  -5.329   3.678  -0.840
   92    H    GLU  11           HN       GLU  11  -1.062   6.399  -6.243
   93    HA   GLU  11           HA       GLU  11  -3.635   7.497  -6.112
   94    HB2  GLU  11           HB2      GLU  11  -1.221   8.264  -7.761
   95    HB3  GLU  11           HB1      GLU  11  -2.697   9.229  -7.705
   96    HG2  GLU  11           HG2      GLU  11  -2.480   9.534  -5.312
   97    HG3  GLU  11           HG1      GLU  11  -1.117   8.417  -5.251
   98    H    SER  12           HN       SER  12  -1.882   6.115  -8.887
   99    HA   SER  12           HA       SER  12  -3.838   6.572 -10.838
  100    HB2  SER  12           HB2      SER  12  -2.752   4.801 -12.123
  101    HB3  SER  12           HB1      SER  12  -1.540   5.822 -11.357
  102    HG   SER  12           HG       SER  12  -1.108   4.252  -9.925
  103    H    LEU  13           HN       LEU  13  -3.338   3.769  -8.704
  104    HA   LEU  13           HA       LEU  13  -5.433   2.170  -9.655
  105    HB2  LEU  13           HB2      LEU  13  -3.742   1.316  -8.115
  106    HB3  LEU  13           HB1      LEU  13  -4.319   2.399  -6.848
  107    HG   LEU  13           HG       LEU  13  -6.403   0.698  -8.074
  108   HD11  LEU  13          HD11      LEU  13  -4.567  -0.915  -8.033
  109   HD12  LEU  13          HD12      LEU  13  -5.702  -1.287  -6.736
  110   HD13  LEU  13          HD13      LEU  13  -4.182  -0.471  -6.370
  111   HD21  LEU  13          HD21      LEU  13  -5.559   1.534  -5.288
  112   HD22  LEU  13          HD22      LEU  13  -6.874   0.394  -5.574
  113   HD23  LEU  13          HD23      LEU  13  -6.990   2.044  -6.184
  114    H    LYS  14           HN       LYS  14  -5.415   4.595  -7.050
  115    HA   LYS  14           HA       LYS  14  -8.076   4.310  -6.228
  116    HB2  LYS  14           HB2      LYS  14  -6.218   6.688  -6.215
  117    HB3  LYS  14           HB1      LYS  14  -7.840   6.750  -5.527
  118    HG2  LYS  14           HG2      LYS  14  -7.219   4.730  -4.132
  119    HG3  LYS  14           HG1      LYS  14  -5.559   4.946  -4.690
  120    HD2  LYS  14           HD2      LYS  14  -7.160   7.133  -3.339
  121    HD3  LYS  14           HD1      LYS  14  -6.065   6.056  -2.474
  122    HE2  LYS  14           HE2      LYS  14  -4.212   6.787  -3.972
  123    HE3  LYS  14           HE1      LYS  14  -5.319   7.921  -4.746
  124    HZ1  LYS  14           HZ1      LYS  14  -5.586   9.103  -2.731
  125    HZ2  LYS  14           HZ2      LYS  14  -3.914   8.878  -2.939
  126    HZ3  LYS  14           HZ3      LYS  14  -4.773   7.916  -1.833
  127    H    SER  15           HN       SER  15  -6.666   6.458  -8.689
  128    HA   SER  15           HA       SER  15  -9.014   7.796  -9.433
  129    HB2  SER  15           HB2      SER  15  -6.584   7.062 -11.082
  130    HB3  SER  15           HB1      SER  15  -7.846   8.168 -11.616
  131    HG   SER  15           HG       SER  15  -7.382   9.333  -9.601
  132    H    PHE  16           HN       PHE  16  -7.561   4.811 -10.714
  133    HA   PHE  16           HA       PHE  16  -9.437   4.282 -12.722
  134    HB2  PHE  16           HB2      PHE  16  -7.363   3.042 -12.593
  135    HB3  PHE  16           HB1      PHE  16  -7.808   2.385 -11.018
  136    HD1  PHE  16           HD1      PHE  16  -8.841   2.484 -14.604
  137    HD2  PHE  16           HD2      PHE  16  -9.119   0.425 -10.845
  138    HE1  PHE  16           HE1      PHE  16 -10.016   0.606 -15.719
  139    HE2  PHE  16           HE2      PHE  16 -10.293  -1.453 -11.960
  140    HZ   PHE  16           HZ       PHE  16 -10.742  -1.363 -14.397
  141    H    GLN  17           HN       GLN  17  -9.386   3.251  -9.318
  142    HA   GLN  17           HA       GLN  17 -11.719   1.704  -9.336
  143    HB2  GLN  17           HB2      GLN  17 -10.290   3.261  -7.197
  144    HB3  GLN  17           HB1      GLN  17 -11.813   2.444  -6.847
  145    HG2  GLN  17           HG2      GLN  17  -9.392   1.089  -8.066
  146    HG3  GLN  17           HG1      GLN  17  -9.804   1.032  -6.353
  147   HE21  GLN  17          HE21      GLN  17 -10.068  -0.787  -9.102
  148   HE22  GLN  17          HE22      GLN  17 -11.492  -1.641  -8.744
  149    H1   ALA   1           HT1      ALA   1 -12.174   0.915  -1.860
  150    H2   ALA   1           HT2      ALA   1 -11.690  -0.562  -1.174
  151    H3   ALA   1           HT3      ALA   1 -13.117  -0.475  -2.093
  152    HA   ALA   1           HA       ALA   1 -11.925  -0.102  -4.095
  153    HB1  ALA   1           HB1      ALA   1 -10.184   1.344  -3.036
  154    HB2  ALA   1           HB2      ALA   1  -9.495   0.125  -4.107
  155    HB3  ALA   1           HB3      ALA   1  -9.437  -0.103  -2.359
  156    H    THR   2           HN       THR   2 -11.257  -1.878  -5.311
  157    HA   THR   2           HA       THR   2 -11.758  -4.430  -4.291
  158    HB   THR   2           HB       THR   2 -10.382  -5.132  -6.404
  159    HG1  THR   2           HG1      THR   2  -9.498  -2.869  -6.391
  160   HG21  THR   2          HG21      THR   2 -12.846  -3.387  -6.662
  161   HG22  THR   2          HG22      THR   2 -12.862  -5.088  -6.198
  162   HG23  THR   2          HG23      THR   2 -12.313  -4.618  -7.807
  163    H    LEU   3           HN       LEU   3 -10.641  -5.365  -2.695
  164    HA   LEU   3           HA       LEU   3  -8.007  -4.786  -1.940
  165    HB2  LEU   3           HB2      LEU   3  -9.658  -7.288  -1.515
  166    HB3  LEU   3           HB1      LEU   3  -8.130  -6.956  -0.699
  167    HG   LEU   3           HG       LEU   3 -10.533  -5.114  -0.592
  168   HD11  LEU   3          HD11      LEU   3 -10.699  -5.987   1.781
  169   HD12  LEU   3          HD12      LEU   3  -9.569  -7.259   1.318
  170   HD13  LEU   3          HD13      LEU   3 -11.145  -7.152   0.535
  171   HD21  LEU   3          HD21      LEU   3  -9.219  -4.255   1.419
  172   HD22  LEU   3          HD22      LEU   3  -8.509  -3.906  -0.155
  173   HD23  LEU   3          HD23      LEU   3  -7.862  -5.216   0.832
  174    H    GLU   4           HN       GLU   4  -9.275  -7.435  -3.953
  175    HA   GLU   4           HA       GLU   4  -6.857  -8.762  -4.427
  176    HB2  GLU   4           HB2      GLU   4  -9.337  -8.486  -6.135
  177    HB3  GLU   4           HB1      GLU   4  -7.997  -9.562  -6.533
  178    HG2  GLU   4           HG2      GLU   4  -9.570  -9.638  -3.942
  179    HG3  GLU   4           HG1      GLU   4  -9.807 -10.738  -5.299
  180    H    LYS   5           HN       LYS   5  -8.430  -6.160  -6.278
  181    HA   LYS   5           HA       LYS   5  -6.558  -5.965  -8.349
  182    HB2  LYS   5           HB2      LYS   5  -8.859  -4.781  -8.022
  183    HB3  LYS   5           HB1      LYS   5  -7.906  -3.532  -7.220
  184    HG2  LYS   5           HG2      LYS   5  -6.872  -4.515  -9.830
  185    HG3  LYS   5           HG1      LYS   5  -8.338  -3.535  -9.881
  186    HD2  LYS   5           HD2      LYS   5  -7.267  -1.695  -8.807
  187    HD3  LYS   5           HD1      LYS   5  -5.883  -2.682  -8.338
  188    HE2  LYS   5           HE2      LYS   5  -5.258  -1.312 -10.251
  189    HE3  LYS   5           HE1      LYS   5  -5.343  -2.998 -10.758
  190    HZ1  LYS   5           HZ1      LYS   5  -7.765  -2.405 -11.341
  191    HZ2  LYS   5           HZ2      LYS   5  -6.524  -1.915 -12.392
  192    HZ3  LYS   5           HZ3      LYS   5  -7.220  -0.800 -11.316
  193    H    LEU   6           HN       LEU   6  -6.683  -4.268  -5.223
  194    HA   LEU   6           HA       LEU   6  -4.419  -2.655  -5.565
  195    HB2  LEU   6           HB2      LEU   6  -5.983  -2.339  -3.712
  196    HB3  LEU   6           HB1      LEU   6  -5.507  -3.892  -3.025
  197    HG   LEU   6           HG       LEU   6  -3.264  -2.059  -3.602
  198   HD11  LEU   6          HD11      LEU   6  -4.925  -0.431  -2.816
  199   HD12  LEU   6          HD12      LEU   6  -3.697  -0.691  -1.576
  200   HD13  LEU   6          HD13      LEU   6  -5.282  -1.449  -1.420
  201   HD21  LEU   6          HD21      LEU   6  -4.156  -3.834  -1.316
  202   HD22  LEU   6          HD22      LEU   6  -2.711  -2.827  -1.227
  203   HD23  LEU   6          HD23      LEU   6  -2.821  -4.106  -2.436
  204    H    MET   7           HN       MET   7  -4.704  -5.919  -4.178
  205    HA   MET   7           HA       MET   7  -2.020  -6.284  -3.473
  206    HB2  MET   7           HB2      MET   7  -3.897  -7.794  -2.834
  207    HB3  MET   7           HB1      MET   7  -3.929  -8.400  -4.490
  208    HG2  MET   7           HG2      MET   7  -2.581  -9.938  -3.239
  209    HG3  MET   7           HG1      MET   7  -1.464  -8.970  -4.202
  210    HE1  MET   7           HE1      MET   7   0.810  -9.036  -2.733
  211    HE2  MET   7           HE2      MET   7   0.858  -7.454  -1.959
  212    HE3  MET   7           HE3      MET   7   0.161  -7.618  -3.569
  213    H    LYS   8           HN       LYS   8  -3.703  -7.060  -6.510
  214    HA   LYS   8           HA       LYS   8  -1.544  -8.212  -7.869
  215    HB2  LYS   8           HB2      LYS   8  -3.941  -6.666  -8.865
  216    HB3  LYS   8           HB1      LYS   8  -2.783  -7.441  -9.947
  217    HG2  LYS   8           HG2      LYS   8  -3.245  -9.616  -8.980
  218    HG3  LYS   8           HG1      LYS   8  -4.267  -8.892  -7.738
  219    HD2  LYS   8           HD2      LYS   8  -5.711  -9.787  -9.465
  220    HD3  LYS   8           HD1      LYS   8  -5.761  -8.027  -9.569
  221    HE2  LYS   8           HE2      LYS   8  -4.135  -8.058 -11.398
  222    HE3  LYS   8           HE1      LYS   8  -3.989  -9.810 -11.266
  223    HZ1  LYS   8           HZ1      LYS   8  -6.569  -9.680 -11.569
  224    HZ2  LYS   8           HZ2      LYS   8  -5.532  -9.640 -12.915
  225    HZ3  LYS   8           HZ3      LYS   8  -6.203  -8.200 -12.312
  226    H    ALA   9           HN       ALA   9  -2.621  -4.821  -7.755
  227    HA   ALA   9           HA       ALA   9  -0.718  -3.746  -9.504
  228    HB1  ALA   9           HB1      ALA   9  -2.174  -2.573  -7.136
  229    HB2  ALA   9           HB2      ALA   9  -2.527  -2.354  -8.850
  230    HB3  ALA   9           HB3      ALA   9  -1.088  -1.618  -8.145
  231    H    PHE  10           HN       PHE  10  -0.587  -4.174  -5.973
  232    HA   PHE  10           HA       PHE  10   1.925  -3.020  -5.534
  233    HB2  PHE  10           HB2      PHE  10   0.282  -3.696  -3.766
  234    HB3  PHE  10           HB1      PHE  10   0.753  -5.374  -4.040
  235    HD1  PHE  10           HD1      PHE  10   2.492  -2.068  -3.632
  236    HD2  PHE  10           HD2      PHE  10   2.307  -6.216  -2.534
  237    HE1  PHE  10           HE1      PHE  10   4.444  -1.758  -2.136
  238    HE2  PHE  10           HE2      PHE  10   4.261  -5.907  -1.040
  239    HZ   PHE  10           HZ       PHE  10   5.329  -3.678  -0.840
  240    H    GLU  11           HN       GLU  11   1.062  -6.399  -6.243
  241    HA   GLU  11           HA       GLU  11   3.635  -7.497  -6.112
  242    HB2  GLU  11           HB2      GLU  11   1.221  -8.264  -7.761
  243    HB3  GLU  11           HB1      GLU  11   2.697  -9.229  -7.705
  244    HG2  GLU  11           HG2      GLU  11   2.480  -9.534  -5.312
  245    HG3  GLU  11           HG1      GLU  11   1.117  -8.417  -5.251
  246    H    SER  12           HN       SER  12   1.882  -6.115  -8.887
  247    HA   SER  12           HA       SER  12   3.828  -6.569 -10.851
  248    HB2  SER  12           HB2      SER  12   1.551  -5.805 -11.379
  249    HB3  SER  12           HB1      SER  12   1.881  -4.259 -10.603
  250    HG   SER  12           HG       SER  12   3.406  -5.319 -12.748
  251    H    LEU  13           HN       LEU  13   3.338  -3.769  -8.704
  252    HA   LEU  13           HA       LEU  13   5.433  -2.171  -9.655
  253    HB2  LEU  13           HB2      LEU  13   3.751  -1.304  -8.121
  254    HB3  LEU  13           HB1      LEU  13   4.304  -2.399  -6.854
  255    HG   LEU  13           HG       LEU  13   6.435  -0.738  -8.038
  256   HD11  LEU  13          HD11      LEU  13   4.617   0.904  -8.073
  257   HD12  LEU  13          HD12      LEU  13   5.737   1.285  -6.766
  258   HD13  LEU  13          HD13      LEU  13   4.197   0.504  -6.408
  259   HD21  LEU  13          HD21      LEU  13   5.563  -1.066  -5.156
  260   HD22  LEU  13          HD22      LEU  13   7.166  -0.641  -5.758
  261   HD23  LEU  13          HD23      LEU  13   6.539  -2.273  -5.994
  262    H    LYS  14           HN       LYS  14   5.415  -4.595  -7.050
  263    HA   LYS  14           HA       LYS  14   8.076  -4.310  -6.228
  264    HB2  LYS  14           HB2      LYS  14   6.218  -6.688  -6.215
  265    HB3  LYS  14           HB1      LYS  14   7.840  -6.750  -5.527
  266    HG2  LYS  14           HG2      LYS  14   7.219  -4.730  -4.132
  267    HG3  LYS  14           HG1      LYS  14   5.559  -4.946  -4.690
  268    HD2  LYS  14           HD2      LYS  14   7.160  -7.133  -3.339
  269    HD3  LYS  14           HD1      LYS  14   6.065  -6.056  -2.474
  270    HE2  LYS  14           HE2      LYS  14   4.212  -6.787  -3.972
  271    HE3  LYS  14           HE1      LYS  14   5.319  -7.921  -4.746
  272    HZ1  LYS  14           HZ1      LYS  14   5.586  -9.103  -2.731
  273    HZ2  LYS  14           HZ2      LYS  14   3.914  -8.878  -2.939
  274    HZ3  LYS  14           HZ3      LYS  14   4.773  -7.916  -1.833
  275    H    SER  15           HN       SER  15   6.666  -6.458  -8.689
  276    HA   SER  15           HA       SER  15   9.020  -7.787  -9.426
  277    HB2  SER  15           HB2      SER  15   7.878  -8.325 -11.518
  278    HB3  SER  15           HB1      SER  15   6.765  -8.489 -10.164
  279    HG   SER  15           HG       SER  15   6.942  -6.463 -12.117
  280    H    PHE  16           HN       PHE  16   7.561  -4.811 -10.714
  281    HA   PHE  16           HA       PHE  16   9.439  -4.285 -12.721
  282    HB2  PHE  16           HB2      PHE  16   7.387  -3.025 -12.626
  283    HB3  PHE  16           HB1      PHE  16   7.792  -2.393 -11.030
  284    HD1  PHE  16           HD1      PHE  16   8.925  -2.446 -14.587
  285    HD2  PHE  16           HD2      PHE  16   9.115  -0.445 -10.790
  286    HE1  PHE  16           HE1      PHE  16  10.153  -0.566 -15.639
  287    HE2  PHE  16           HE2      PHE  16  10.344   1.435 -11.842
  288    HZ   PHE  16           HZ       PHE  16  10.864   1.374 -14.266
  289    H    GLN  17           HN       GLN  17   9.386  -3.251  -9.318
  290    HA   GLN  17           HA       GLN  17  11.719  -1.704  -9.334
  291    HB2  GLN  17           HB2      GLN  17  10.123  -3.119  -7.267
  292    HB3  GLN  17           HB1      GLN  17  11.771  -2.671  -6.829
  293    HG2  GLN  17           HG2      GLN  17   9.764  -0.746  -8.029
  294    HG3  GLN  17           HG1      GLN  17  10.062  -0.901  -6.299
  295   HE21  GLN  17          HE21      GLN  17  10.842   1.087  -8.771
  296   HE22  GLN  17          HE22      GLN  17  12.412   1.543  -8.314
  297    H1   ALA   1           HT1      ALA   1  -0.915  12.174   1.860
  298    H2   ALA   1           HT2      ALA   1   0.562  11.690   1.174
  299    H3   ALA   1           HT3      ALA   1   0.475  13.117   2.093
  300    HA   ALA   1           HA       ALA   1   0.102  11.925   4.095
  301    HB1  ALA   1           HB1      ALA   1  -1.344  10.184   3.036
  302    HB2  ALA   1           HB2      ALA   1  -0.125   9.495   4.107
  303    HB3  ALA   1           HB3      ALA   1   0.103   9.437   2.359
  304    H    THR   2           HN       THR   2   1.878  11.257   5.311
  305    HA   THR   2           HA       THR   2   4.430  11.758   4.291
  306    HB   THR   2           HB       THR   2   5.131  10.379   6.405
  307    HG1  THR   2           HG1      THR   2   2.851   9.512   6.381
  308   HG21  THR   2          HG21      THR   2   3.379  12.832   6.703
  309   HG22  THR   2          HG22      THR   2   5.060  12.872   6.171
  310   HG23  THR   2          HG23      THR   2   4.662  12.312   7.795
  311    H    LEU   3           HN       LEU   3   5.365  10.641   2.695
  312    HA   LEU   3           HA       LEU   3   4.786   8.007   1.940
  313    HB2  LEU   3           HB2      LEU   3   7.288   9.658   1.515
  314    HB3  LEU   3           HB1      LEU   3   6.956   8.130   0.699
  315    HG   LEU   3           HG       LEU   3   5.114  10.533   0.592
  316   HD11  LEU   3          HD11      LEU   3   5.987  10.699  -1.781
  317   HD12  LEU   3          HD12      LEU   3   7.259   9.569  -1.318
  318   HD13  LEU   3          HD13      LEU   3   7.152  11.145  -0.535
  319   HD21  LEU   3          HD21      LEU   3   4.255   9.219  -1.419
  320   HD22  LEU   3          HD22      LEU   3   3.906   8.509   0.155
  321   HD23  LEU   3          HD23      LEU   3   5.216   7.862  -0.832
  322    H    GLU   4           HN       GLU   4   7.435   9.275   3.953
  323    HA   GLU   4           HA       GLU   4   8.762   6.857   4.427
  324    HB2  GLU   4           HB2      GLU   4   8.486   9.337   6.135
  325    HB3  GLU   4           HB1      GLU   4   9.562   7.997   6.533
  326    HG2  GLU   4           HG2      GLU   4   9.638   9.570   3.942
  327    HG3  GLU   4           HG1      GLU   4  10.738   9.807   5.299
  328    H    LYS   5           HN       LYS   5   6.160   8.430   6.278
  329    HA   LYS   5           HA       LYS   5   5.965   6.559   8.349
  330    HB2  LYS   5           HB2      LYS   5   4.788   8.853   8.056
  331    HB3  LYS   5           HB1      LYS   5   3.550   7.934   7.199
  332    HG2  LYS   5           HG2      LYS   5   4.454   6.829   9.809
  333    HG3  LYS   5           HG1      LYS   5   3.485   8.302   9.868
  334    HD2  LYS   5           HD2      LYS   5   1.739   7.227   8.510
  335    HD3  LYS   5           HD1      LYS   5   2.709   5.757   8.413
  336    HE2  LYS   5           HE2      LYS   5   1.026   5.517  10.174
  337    HE3  LYS   5           HE1      LYS   5   2.635   5.574  10.892
  338    HZ1  LYS   5           HZ1      LYS   5   2.333   7.806  11.524
  339    HZ2  LYS   5           HZ2      LYS   5   0.900   7.009  11.970
  340    HZ3  LYS   5           HZ3      LYS   5   0.937   7.979  10.575
  341    H    LEU   6           HN       LEU   6   4.268   6.683   5.223
  342    HA   LEU   6           HA       LEU   6   2.655   4.419   5.565
  343    HB2  LEU   6           HB2      LEU   6   2.339   5.983   3.712
  344    HB3  LEU   6           HB1      LEU   6   3.892   5.507   3.025
  345    HG   LEU   6           HG       LEU   6   2.059   3.264   3.602
  346   HD11  LEU   6          HD11      LEU   6   0.431   4.925   2.816
  347   HD12  LEU   6          HD12      LEU   6   0.691   3.697   1.576
  348   HD13  LEU   6          HD13      LEU   6   1.449   5.282   1.420
  349   HD21  LEU   6          HD21      LEU   6   3.834   4.156   1.316
  350   HD22  LEU   6          HD22      LEU   6   2.827   2.711   1.227
  351   HD23  LEU   6          HD23      LEU   6   4.106   2.821   2.436
  352    H    MET   7           HN       MET   7   5.919   4.704   4.178
  353    HA   MET   7           HA       MET   7   6.284   2.020   3.473
  354    HB2  MET   7           HB2      MET   7   7.794   3.897   2.834
  355    HB3  MET   7           HB1      MET   7   8.400   3.929   4.490
  356    HG2  MET   7           HG2      MET   7   9.938   2.581   3.239
  357    HG3  MET   7           HG1      MET   7   8.970   1.464   4.202
  358    HE1  MET   7           HE1      MET   7   9.036  -0.810   2.733
  359    HE2  MET   7           HE2      MET   7   7.454  -0.858   1.959
  360    HE3  MET   7           HE3      MET   7   7.618  -0.161   3.569
  361    H    LYS   8           HN       LYS   8   7.060   3.703   6.510
  362    HA   LYS   8           HA       LYS   8   8.212   1.544   7.869
  363    HB2  LYS   8           HB2      LYS   8   6.666   3.941   8.865
  364    HB3  LYS   8           HB1      LYS   8   7.441   2.783   9.947
  365    HG2  LYS   8           HG2      LYS   8   9.616   3.245   8.980
  366    HG3  LYS   8           HG1      LYS   8   8.892   4.267   7.738
  367    HD2  LYS   8           HD2      LYS   8   9.787   5.711   9.465
  368    HD3  LYS   8           HD1      LYS   8   8.027   5.761   9.569
  369    HE2  LYS   8           HE2      LYS   8   8.058   4.135  11.398
  370    HE3  LYS   8           HE1      LYS   8   9.810   3.989  11.266
  371    HZ1  LYS   8           HZ1      LYS   8   9.680   6.569  11.569
  372    HZ2  LYS   8           HZ2      LYS   8   9.640   5.532  12.915
  373    HZ3  LYS   8           HZ3      LYS   8   8.200   6.203  12.312
  374    H    ALA   9           HN       ALA   9   4.821   2.621   7.755
  375    HA   ALA   9           HA       ALA   9   3.746   0.718   9.504
  376    HB1  ALA   9           HB1      ALA   9   2.573   2.174   7.135
  377    HB2  ALA   9           HB2      ALA   9   2.354   2.527   8.849
  378    HB3  ALA   9           HB3      ALA   9   1.618   1.088   8.145
  379    H    PHE  10           HN       PHE  10   4.174   0.587   5.973
  380    HA   PHE  10           HA       PHE  10   3.020  -1.925   5.534
  381    HB2  PHE  10           HB2      PHE  10   3.696  -0.282   3.766
  382    HB3  PHE  10           HB1      PHE  10   5.374  -0.753   4.040
  383    HD1  PHE  10           HD1      PHE  10   2.068  -2.492   3.632
  384    HD2  PHE  10           HD2      PHE  10   6.216  -2.307   2.534
  385    HE1  PHE  10           HE1      PHE  10   1.758  -4.444   2.136
  386    HE2  PHE  10           HE2      PHE  10   5.907  -4.261   1.040
  387    HZ   PHE  10           HZ       PHE  10   3.678  -5.329   0.840
  388    H    GLU  11           HN       GLU  11   6.399  -1.062   6.243
  389    HA   GLU  11           HA       GLU  11   7.497  -3.635   6.112
  390    HB2  GLU  11           HB2      GLU  11   8.264  -1.221   7.761
  391    HB3  GLU  11           HB1      GLU  11   9.229  -2.697   7.705
  392    HG2  GLU  11           HG2      GLU  11   9.534  -2.480   5.312
  393    HG3  GLU  11           HG1      GLU  11   8.417  -1.117   5.251
  394    H    SER  12           HN       SER  12   6.115  -1.882   8.887
  395    HA   SER  12           HA       SER  12   6.572  -3.838  10.838
  396    HB2  SER  12           HB2      SER  12   4.801  -2.752  12.123
  397    HB3  SER  12           HB1      SER  12   5.822  -1.540  11.357
  398    HG   SER  12           HG       SER  12   4.252  -1.108   9.925
  399    H    LEU  13           HN       LEU  13   3.769  -3.338   8.704
  400    HA   LEU  13           HA       LEU  13   2.170  -5.433   9.655
  401    HB2  LEU  13           HB2      LEU  13   1.316  -3.742   8.115
  402    HB3  LEU  13           HB1      LEU  13   2.399  -4.318   6.848
  403    HG   LEU  13           HG       LEU  13   0.697  -6.402   8.073
  404   HD11  LEU  13          HD11      LEU  13  -0.897  -4.530   8.017
  405   HD12  LEU  13          HD12      LEU  13  -1.296  -5.709   6.768
  406   HD13  LEU  13          HD13      LEU  13  -0.477  -4.209   6.335
  407   HD21  LEU  13          HD21      LEU  13   1.543  -5.562   5.290
  408   HD22  LEU  13          HD22      LEU  13   0.397  -6.873   5.570
  409   HD23  LEU  13          HD23      LEU  13   2.044  -6.995   6.188
  410    H    LYS  14           HN       LYS  14   4.595  -5.415   7.050
  411    HA   LYS  14           HA       LYS  14   4.310  -8.076   6.228
  412    HB2  LYS  14           HB2      LYS  14   6.688  -6.218   6.215
  413    HB3  LYS  14           HB1      LYS  14   6.750  -7.840   5.527
  414    HG2  LYS  14           HG2      LYS  14   4.730  -7.219   4.132
  415    HG3  LYS  14           HG1      LYS  14   4.946  -5.559   4.690
  416    HD2  LYS  14           HD2      LYS  14   7.133  -7.160   3.339
  417    HD3  LYS  14           HD1      LYS  14   6.056  -6.065   2.474
  418    HE2  LYS  14           HE2      LYS  14   6.787  -4.212   3.972
  419    HE3  LYS  14           HE1      LYS  14   7.921  -5.319   4.746
  420    HZ1  LYS  14           HZ1      LYS  14   9.103  -5.586   2.731
  421    HZ2  LYS  14           HZ2      LYS  14   8.878  -3.914   2.939
  422    HZ3  LYS  14           HZ3      LYS  14   7.916  -4.773   1.833
  423    H    SER  15           HN       SER  15   6.458  -6.666   8.689
  424    HA   SER  15           HA       SER  15   7.796  -9.014   9.433
  425    HB2  SER  15           HB2      SER  15   8.505  -6.787  10.189
  426    HB3  SER  15           HB1      SER  15   7.038  -6.635  11.151
  427    HG   SER  15           HG       SER  15   9.354  -7.908  11.718
  428    H    PHE  16           HN       PHE  16   4.811  -7.561  10.714
  429    HA   PHE  16           HA       PHE  16   4.295  -9.442  12.715
  430    HB2  PHE  16           HB2      PHE  16   3.102  -7.266  12.414
  431    HB3  PHE  16           HB1      PHE  16   2.238  -7.973  11.052
  432    HD1  PHE  16           HD1      PHE  16   2.961 -10.441  13.546
  433    HD2  PHE  16           HD2      PHE  16   0.237  -7.265  12.569
  434    HE1  PHE  16           HE1      PHE  16   1.291 -11.391  15.109
  435    HE2  PHE  16           HE2      PHE  16  -1.433  -8.220  14.130
  436    HZ   PHE  16           HZ       PHE  16  -0.907 -10.282  15.401
  437    H    GLN  17           HN       GLN  17   3.251  -9.386   9.318
  438    HA   GLN  17           HA       GLN  17   1.705 -11.720   9.337
  439    HB2  GLN  17           HB2      GLN  17   3.346 -10.462   7.130
  440    HB3  GLN  17           HB1      GLN  17   2.240 -11.812   6.877
  441    HG2  GLN  17           HG2      GLN  17   1.467  -9.121   8.039
  442    HG3  GLN  17           HG1      GLN  17   1.159  -9.635   6.382
  443   HE21  GLN  17          HE21      GLN  17  -0.547  -9.183   9.070
  444   HE22  GLN  17          HE22      GLN  17  -1.616 -10.500   9.012
  445    H1   ALA   1           HT1      ALA   1   0.915 -12.174   1.860
  446    H2   ALA   1           HT2      ALA   1  -0.562 -11.690   1.174
  447    H3   ALA   1           HT3      ALA   1  -0.475 -13.117   2.093
  448    HA   ALA   1           HA       ALA   1  -0.102 -11.925   4.095
  449    HB1  ALA   1           HB1      ALA   1   1.344 -10.184   3.036
  450    HB2  ALA   1           HB2      ALA   1   0.125  -9.495   4.107
  451    HB3  ALA   1           HB3      ALA   1  -0.103  -9.437   2.359
  452    H    THR   2           HN       THR   2  -1.878 -11.257   5.311
  453    HA   THR   2           HA       THR   2  -4.430 -11.758   4.291
  454    HB   THR   2           HB       THR   2  -5.131 -10.378   6.405
  455    HG1  THR   2           HG1      THR   2  -2.857  -9.507   6.386
  456   HG21  THR   2          HG21      THR   2  -3.382 -12.833   6.703
  457   HG22  THR   2          HG22      THR   2  -5.062 -12.871   6.170
  458   HG23  THR   2          HG23      THR   2  -4.665 -12.312   7.795
  459    H    LEU   3           HN       LEU   3  -5.365 -10.641   2.695
  460    HA   LEU   3           HA       LEU   3  -4.786  -8.007   1.940
  461    HB2  LEU   3           HB2      LEU   3  -7.288  -9.658   1.515
  462    HB3  LEU   3           HB1      LEU   3  -6.956  -8.130   0.699
  463    HG   LEU   3           HG       LEU   3  -5.114 -10.533   0.592
  464   HD11  LEU   3          HD11      LEU   3  -5.987 -10.699  -1.781
  465   HD12  LEU   3          HD12      LEU   3  -7.259  -9.569  -1.318
  466   HD13  LEU   3          HD13      LEU   3  -7.152 -11.145  -0.535
  467   HD21  LEU   3          HD21      LEU   3  -4.255  -9.219  -1.419
  468   HD22  LEU   3          HD22      LEU   3  -3.906  -8.509   0.155
  469   HD23  LEU   3          HD23      LEU   3  -5.216  -7.862  -0.832
  470    H    GLU   4           HN       GLU   4  -7.435  -9.275   3.953
  471    HA   GLU   4           HA       GLU   4  -8.762  -6.857   4.427
  472    HB2  GLU   4           HB2      GLU   4  -8.486  -9.337   6.135
  473    HB3  GLU   4           HB1      GLU   4  -9.562  -7.997   6.533
  474    HG2  GLU   4           HG2      GLU   4  -9.638  -9.570   3.942
  475    HG3  GLU   4           HG1      GLU   4 -10.738  -9.807   5.299
  476    H    LYS   5           HN       LYS   5  -6.160  -8.430   6.278
  477    HA   LYS   5           HA       LYS   5  -5.964  -6.560   8.350
  478    HB2  LYS   5           HB2      LYS   5  -4.787  -8.856   8.037
  479    HB3  LYS   5           HB1      LYS   5  -3.543  -7.921   7.206
  480    HG2  LYS   5           HG2      LYS   5  -4.483  -6.845   9.812
  481    HG3  LYS   5           HG1      LYS   5  -3.517  -8.320   9.872
  482    HD2  LYS   5           HD2      LYS   5  -1.714  -7.264   8.650
  483    HD3  LYS   5           HD1      LYS   5  -2.692  -5.824   8.365
  484    HE2  LYS   5           HE2      LYS   5  -1.159  -5.398  10.216
  485    HE3  LYS   5           HE1      LYS   5  -2.811  -5.460  10.830
  486    HZ1  LYS   5           HZ1      LYS   5  -2.391  -7.846  11.347
  487    HZ2  LYS   5           HZ2      LYS   5  -1.465  -6.756  12.263
  488    HZ3  LYS   5           HZ3      LYS   5  -0.758  -7.595  10.966
  489    H    LEU   6           HN       LEU   6  -4.268  -6.683   5.223
  490    HA   LEU   6           HA       LEU   6  -2.655  -4.419   5.565
  491    HB2  LEU   6           HB2      LEU   6  -2.339  -5.983   3.712
  492    HB3  LEU   6           HB1      LEU   6  -3.892  -5.507   3.025
  493    HG   LEU   6           HG       LEU   6  -2.059  -3.264   3.602
  494   HD11  LEU   6          HD11      LEU   6  -0.431  -4.925   2.816
  495   HD12  LEU   6          HD12      LEU   6  -0.691  -3.697   1.576
  496   HD13  LEU   6          HD13      LEU   6  -1.449  -5.282   1.420
  497   HD21  LEU   6          HD21      LEU   6  -3.834  -4.156   1.316
  498   HD22  LEU   6          HD22      LEU   6  -2.827  -2.711   1.227
  499   HD23  LEU   6          HD23      LEU   6  -4.106  -2.821   2.436
  500    H    MET   7           HN       MET   7  -5.919  -4.704   4.178
  501    HA   MET   7           HA       MET   7  -6.284  -2.020   3.473
  502    HB2  MET   7           HB2      MET   7  -7.794  -3.897   2.834
  503    HB3  MET   7           HB1      MET   7  -8.400  -3.929   4.490
  504    HG2  MET   7           HG2      MET   7  -9.938  -2.581   3.239
  505    HG3  MET   7           HG1      MET   7  -8.970  -1.464   4.202
  506    HE1  MET   7           HE1      MET   7  -9.036   0.810   2.733
  507    HE2  MET   7           HE2      MET   7  -7.454   0.858   1.959
  508    HE3  MET   7           HE3      MET   7  -7.618   0.161   3.569
  509    H    LYS   8           HN       LYS   8  -7.060  -3.703   6.510
  510    HA   LYS   8           HA       LYS   8  -8.212  -1.544   7.869
  511    HB2  LYS   8           HB2      LYS   8  -6.666  -3.941   8.865
  512    HB3  LYS   8           HB1      LYS   8  -7.441  -2.783   9.947
  513    HG2  LYS   8           HG2      LYS   8  -9.616  -3.245   8.980
  514    HG3  LYS   8           HG1      LYS   8  -8.892  -4.267   7.738
  515    HD2  LYS   8           HD2      LYS   8  -9.787  -5.711   9.465
  516    HD3  LYS   8           HD1      LYS   8  -8.027  -5.761   9.569
  517    HE2  LYS   8           HE2      LYS   8  -8.058  -4.135  11.398
  518    HE3  LYS   8           HE1      LYS   8  -9.810  -3.989  11.266
  519    HZ1  LYS   8           HZ1      LYS   8  -9.680  -6.569  11.569
  520    HZ2  LYS   8           HZ2      LYS   8  -9.640  -5.532  12.915
  521    HZ3  LYS   8           HZ3      LYS   8  -8.200  -6.203  12.312
  522    H    ALA   9           HN       ALA   9  -4.821  -2.621   7.755
  523    HA   ALA   9           HA       ALA   9  -3.746  -0.718   9.504
  524    HB1  ALA   9           HB1      ALA   9  -2.573  -2.174   7.136
  525    HB2  ALA   9           HB2      ALA   9  -2.354  -2.527   8.850
  526    HB3  ALA   9           HB3      ALA   9  -1.618  -1.088   8.145
  527    H    PHE  10           HN       PHE  10  -4.174  -0.587   5.973
  528    HA   PHE  10           HA       PHE  10  -3.020   1.925   5.534
  529    HB2  PHE  10           HB2      PHE  10  -3.696   0.282   3.766
  530    HB3  PHE  10           HB1      PHE  10  -5.374   0.753   4.040
  531    HD1  PHE  10           HD1      PHE  10  -2.068   2.492   3.632
  532    HD2  PHE  10           HD2      PHE  10  -6.216   2.307   2.534
  533    HE1  PHE  10           HE1      PHE  10  -1.758   4.444   2.136
  534    HE2  PHE  10           HE2      PHE  10  -5.907   4.261   1.040
  535    HZ   PHE  10           HZ       PHE  10  -3.678   5.329   0.840
  536    H    GLU  11           HN       GLU  11  -6.399   1.062   6.243
  537    HA   GLU  11           HA       GLU  11  -7.497   3.635   6.112
  538    HB2  GLU  11           HB2      GLU  11  -8.264   1.221   7.761
  539    HB3  GLU  11           HB1      GLU  11  -9.229   2.697   7.705
  540    HG2  GLU  11           HG2      GLU  11  -9.534   2.480   5.312
  541    HG3  GLU  11           HG1      GLU  11  -8.417   1.117   5.251
  542    H    SER  12           HN       SER  12  -6.115   1.882   8.887
  543    HA   SER  12           HA       SER  12  -6.573   3.839  10.837
  544    HB2  SER  12           HB2      SER  12  -4.801   2.753  12.124
  545    HB3  SER  12           HB1      SER  12  -5.823   1.541  11.360
  546    HG   SER  12           HG       SER  12  -3.258   1.709  11.178
  547    H    LEU  13           HN       LEU  13  -3.769   3.338   8.704
  548    HA   LEU  13           HA       LEU  13  -2.171   5.433   9.655
  549    HB2  LEU  13           HB2      LEU  13  -1.319   3.740   8.115
  550    HB3  LEU  13           HB1      LEU  13  -2.395   4.324   6.846
  551    HG   LEU  13           HG       LEU  13  -0.697   6.402   8.083
  552   HD11  LEU  13          HD11      LEU  13   0.893   4.524   8.044
  553   HD12  LEU  13          HD12      LEU  13   1.308   5.706   6.803
  554   HD13  LEU  13          HD13      LEU  13   0.492   4.208   6.356
  555   HD21  LEU  13          HD21      LEU  13  -1.501   5.558   5.288
  556   HD22  LEU  13          HD22      LEU  13  -0.377   6.882   5.592
  557   HD23  LEU  13          HD23      LEU  13  -2.036   6.981   6.181
  558    H    LYS  14           HN       LYS  14  -4.595   5.415   7.050
  559    HA   LYS  14           HA       LYS  14  -4.310   8.076   6.228
  560    HB2  LYS  14           HB2      LYS  14  -6.688   6.218   6.215
  561    HB3  LYS  14           HB1      LYS  14  -6.750   7.840   5.527
  562    HG2  LYS  14           HG2      LYS  14  -4.730   7.219   4.132
  563    HG3  LYS  14           HG1      LYS  14  -4.946   5.559   4.690
  564    HD2  LYS  14           HD2      LYS  14  -7.133   7.160   3.339
  565    HD3  LYS  14           HD1      LYS  14  -6.056   6.065   2.474
  566    HE2  LYS  14           HE2      LYS  14  -6.787   4.212   3.972
  567    HE3  LYS  14           HE1      LYS  14  -7.921   5.319   4.746
  568    HZ1  LYS  14           HZ1      LYS  14  -9.103   5.586   2.731
  569    HZ2  LYS  14           HZ2      LYS  14  -8.878   3.914   2.939
  570    HZ3  LYS  14           HZ3      LYS  14  -7.916   4.773   1.833
  571    H    SER  15           HN       SER  15  -6.458   6.666   8.689
  572    HA   SER  15           HA       SER  15  -7.796   9.014   9.433
  573    HB2  SER  15           HB2      SER  15  -8.505   6.786  10.190
  574    HB3  SER  15           HB1      SER  15  -7.038   6.635  11.152
  575    HG   SER  15           HG       SER  15  -7.732   8.494  12.312
  576    H    PHE  16           HN       PHE  16  -4.811   7.561  10.714
  577    HA   PHE  16           HA       PHE  16  -4.290   9.443  12.718
  578    HB2  PHE  16           HB2      PHE  16  -3.034   7.357  12.572
  579    HB3  PHE  16           HB1      PHE  16  -2.317   7.872  11.044
  580    HD1  PHE  16           HD1      PHE  16  -2.596   8.739  14.658
  581    HD2  PHE  16           HD2      PHE  16  -0.430   9.321  10.994
  582    HE1  PHE  16           HE1      PHE  16  -0.836   9.972  15.895
  583    HE2  PHE  16           HE2      PHE  16   1.332  10.553  12.233
  584    HZ   PHE  16           HZ       PHE  16   1.128  10.879  14.683
  585    H    GLN  17           HN       GLN  17  -3.251   9.386   9.318
  586    HA   GLN  17           HA       GLN  17  -1.705  11.720   9.337
  587    HB2  GLN  17           HB2      GLN  17  -3.346  10.462   7.130
  588    HB3  GLN  17           HB1      GLN  17  -2.240  11.812   6.877
  589    HG2  GLN  17           HG2      GLN  17  -1.467   9.121   8.039
  590    HG3  GLN  17           HG1      GLN  17  -1.160   9.634   6.382
  591   HE21  GLN  17          HE21      GLN  17   0.547   9.183   9.071
  592   HE22  GLN  17          HE22      GLN  17   1.616  10.500   9.011
  Start of MODEL    3
    1    H1   ALA   1           HT1      ALA   1  12.720  -0.674  -2.615
    2    H2   ALA   1           HT2      ALA   1  11.915   0.465  -1.645
    3    H3   ALA   1           HT3      ALA   1  13.331   0.902  -2.475
    4    HA   ALA   1           HA       ALA   1  12.175   0.510  -4.602
    5    HB1  ALA   1           HB1      ALA   1  10.489  -1.056  -3.628
    6    HB2  ALA   1           HB2      ALA   1   9.749   0.247  -4.558
    7    HB3  ALA   1           HB3      ALA   1   9.746   0.309  -2.796
    8    H    THR   2           HN       THR   2  11.478   2.387  -5.623
    9    HA   THR   2           HA       THR   2  11.942   4.835  -4.340
   10    HB   THR   2           HB       THR   2  10.566   5.710  -6.400
   11    HG1  THR   2           HG1      THR   2  10.646   4.019  -8.037
   12   HG21  THR   2          HG21      THR   2  12.539   5.523  -7.751
   13   HG22  THR   2          HG22      THR   2  13.060   4.072  -6.895
   14   HG23  THR   2          HG23      THR   2  13.081   5.633  -6.076
   15    H    LEU   3           HN       LEU   3  10.782   5.694  -2.743
   16    HA   LEU   3           HA       LEU   3   8.181   4.956  -2.010
   17    HB2  LEU   3           HB2      LEU   3   9.747   7.487  -1.462
   18    HB3  LEU   3           HB1      LEU   3   8.208   7.101  -0.692
   19    HG   LEU   3           HG       LEU   3  10.620   5.272  -0.607
   20   HD11  LEU   3          HD11      LEU   3  10.955   7.523   0.526
   21   HD12  LEU   3          HD12      LEU   3  11.087   6.123   1.591
   22   HD13  LEU   3          HD13      LEU   3   9.616   7.096   1.592
   23   HD21  LEU   3          HD21      LEU   3   7.936   5.347   0.792
   24   HD22  LEU   3          HD22      LEU   3   9.285   4.380   1.385
   25   HD23  LEU   3          HD23      LEU   3   8.600   4.053  -0.205
   26    H    GLU   4           HN       GLU   4   9.312   7.751  -3.900
   27    HA   GLU   4           HA       GLU   4   6.825   8.970  -4.301
   28    HB2  GLU   4           HB2      GLU   4   7.880  10.024  -6.289
   29    HB3  GLU   4           HB1      GLU   4   8.890  10.123  -4.848
   30    HG2  GLU   4           HG2      GLU   4  10.053   8.010  -5.666
   31    HG3  GLU   4           HG1      GLU   4   9.196   8.232  -7.190
   32    H    LYS   5           HN       LYS   5   8.517   6.544  -6.279
   33    HA   LYS   5           HA       LYS   5   6.639   6.360  -8.344
   34    HB2  LYS   5           HB2      LYS   5   8.926   5.314  -8.327
   35    HB3  LYS   5           HB1      LYS   5   8.275   4.064  -7.264
   36    HG2  LYS   5           HG2      LYS   5   6.871   3.198  -8.913
   37    HG3  LYS   5           HG1      LYS   5   6.849   4.706  -9.827
   38    HD2  LYS   5           HD2      LYS   5   9.300   4.336 -10.323
   39    HD3  LYS   5           HD1      LYS   5   9.135   2.733  -9.606
   40    HE2  LYS   5           HE2      LYS   5   7.367   3.711 -11.859
   41    HE3  LYS   5           HE1      LYS   5   8.867   2.824 -12.135
   42    HZ1  LYS   5           HZ1      LYS   5   7.888   1.124 -10.534
   43    HZ2  LYS   5           HZ2      LYS   5   7.227   1.196 -12.097
   44    HZ3  LYS   5           HZ3      LYS   5   6.404   1.902 -10.790
   45    H    LEU   6           HN       LEU   6   6.866   4.526  -5.305
   46    HA   LEU   6           HA       LEU   6   4.680   2.825  -5.715
   47    HB2  LEU   6           HB2      LEU   6   6.263   2.487  -3.886
   48    HB3  LEU   6           HB1      LEU   6   5.732   3.987  -3.126
   49    HG   LEU   6           HG       LEU   6   3.558   2.095  -3.771
   50   HD11  LEU   6          HD11      LEU   6   5.224   0.468  -3.075
   51   HD12  LEU   6          HD12      LEU   6   4.078   0.694  -1.754
   52   HD13  LEU   6          HD13      LEU   6   5.665   1.459  -1.685
   53   HD21  LEU   6          HD21      LEU   6   3.045   4.068  -2.511
   54   HD22  LEU   6          HD22      LEU   6   4.398   3.798  -1.413
   55   HD23  LEU   6          HD23      LEU   6   2.994   2.732  -1.361
   56    H    MET   7           HN       MET   7   4.818   6.030  -4.181
   57    HA   MET   7           HA       MET   7   2.123   6.231  -3.451
   58    HB2  MET   7           HB2      MET   7   3.913   7.801  -2.735
   59    HB3  MET   7           HB1      MET   7   3.938   8.475  -4.364
   60    HG2  MET   7           HG2      MET   7   2.512   9.903  -3.069
   61    HG3  MET   7           HG1      MET   7   1.447   8.931  -4.083
   62    HE1  MET   7           HE1      MET   7  -0.881   7.327  -1.876
   63    HE2  MET   7           HE2      MET   7  -0.145   7.410  -3.474
   64    HE3  MET   7           HE3      MET   7  -0.795   8.871  -2.734
   65    H    LYS   8           HN       LYS   8   3.751   7.227  -6.455
   66    HA   LYS   8           HA       LYS   8   1.532   8.334  -7.755
   67    HB2  LYS   8           HB2      LYS   8   3.981   6.936  -8.842
   68    HB3  LYS   8           HB1      LYS   8   2.792   7.741  -9.867
   69    HG2  LYS   8           HG2      LYS   8   3.166   9.853  -8.646
   70    HG3  LYS   8           HG1      LYS   8   4.359   9.051  -7.625
   71    HD2  LYS   8           HD2      LYS   8   5.752   8.572  -9.584
   72    HD3  LYS   8           HD1      LYS   8   4.546   9.307 -10.641
   73    HE2  LYS   8           HE2      LYS   8   6.341  10.913 -10.184
   74    HE3  LYS   8           HE1      LYS   8   4.839  11.463  -9.440
   75    HZ1  LYS   8           HZ1      LYS   8   5.593  11.013  -7.355
   76    HZ2  LYS   8           HZ2      LYS   8   7.071  11.398  -8.100
   77    HZ3  LYS   8           HZ3      LYS   8   6.634   9.773  -7.860
   78    H    ALA   9           HN       ALA   9   2.770   4.998  -7.797
   79    HA   ALA   9           HA       ALA   9   0.910   3.913  -9.587
   80    HB1  ALA   9           HB1      ALA   9   2.321   2.634  -7.235
   81    HB2  ALA   9           HB2      ALA   9   2.864   2.653  -8.912
   82    HB3  ALA   9           HB3      ALA   9   1.423   1.741  -8.462
   83    H    PHE  10           HN       PHE  10   0.779   4.174  -6.039
   84    HA   PHE  10           HA       PHE  10  -1.671   2.881  -5.633
   85    HB2  PHE  10           HB2      PHE  10  -0.116   3.501  -3.824
   86    HB3  PHE  10           HB1      PHE  10  -0.482   5.203  -4.096
   87    HD1  PHE  10           HD1      PHE  10  -1.982   1.937  -3.121
   88    HD2  PHE  10           HD2      PHE  10  -2.424   6.209  -3.174
   89    HE1  PHE  10           HE1      PHE  10  -3.948   1.753  -1.620
   90    HE2  PHE  10           HE2      PHE  10  -4.390   6.025  -1.675
   91    HZ   PHE  10           HZ       PHE  10  -5.151   3.797  -0.897
   92    H    GLU  11           HN       GLU  11  -0.976   6.328  -6.202
   93    HA   GLU  11           HA       GLU  11  -3.599   7.291  -6.014
   94    HB2  GLU  11           HB2      GLU  11  -1.232   8.251  -7.630
   95    HB3  GLU  11           HB1      GLU  11  -2.752   9.140  -7.525
   96    HG2  GLU  11           HG2      GLU  11  -2.540   9.339  -5.120
   97    HG3  GLU  11           HG1      GLU  11  -1.124   8.289  -5.116
   98    H    SER  12           HN       SER  12  -1.795   6.125  -8.854
   99    HA   SER  12           HA       SER  12  -3.775   6.574 -10.786
  100    HB2  SER  12           HB2      SER  12  -1.655   4.419 -10.636
  101    HB3  SER  12           HB1      SER  12  -2.629   4.752 -12.065
  102    HG   SER  12           HG       SER  12  -0.983   6.629 -10.706
  103    H    LEU  13           HN       LEU  13  -3.138   3.706  -8.774
  104    HA   LEU  13           HA       LEU  13  -5.156   2.051  -9.789
  105    HB2  LEU  13           HB2      LEU  13  -3.429   1.204  -8.295
  106    HB3  LEU  13           HB1      LEU  13  -4.025   2.223  -6.985
  107    HG   LEU  13           HG       LEU  13  -6.201   1.028  -7.070
  108   HD11  LEU  13          HD11      LEU  13  -4.760  -0.571  -9.202
  109   HD12  LEU  13          HD12      LEU  13  -6.269   0.327  -9.371
  110   HD13  LEU  13          HD13      LEU  13  -6.220  -1.138  -8.391
  111   HD21  LEU  13          HD21      LEU  13  -3.956  -0.987  -6.868
  112   HD22  LEU  13          HD22      LEU  13  -5.450  -0.920  -5.933
  113   HD23  LEU  13          HD23      LEU  13  -4.185   0.277  -5.660
  114    H    LYS  14           HN       LYS  14  -5.242   4.355  -7.077
  115    HA   LYS  14           HA       LYS  14  -7.884   3.900  -6.273
  116    HB2  LYS  14           HB2      LYS  14  -6.076   6.300  -6.085
  117    HB3  LYS  14           HB1      LYS  14  -7.734   6.357  -5.486
  118    HG2  LYS  14           HG2      LYS  14  -5.772   4.201  -4.667
  119    HG3  LYS  14           HG1      LYS  14  -5.977   5.702  -3.763
  120    HD2  LYS  14           HD2      LYS  14  -8.411   5.196  -3.543
  121    HD3  LYS  14           HD1      LYS  14  -8.134   3.650  -4.344
  122    HE2  LYS  14           HE2      LYS  14  -6.556   3.004  -2.565
  123    HE3  LYS  14           HE1      LYS  14  -6.834   4.548  -1.758
  124    HZ1  LYS  14           HZ1      LYS  14  -8.225   2.933  -0.745
  125    HZ2  LYS  14           HZ2      LYS  14  -8.810   2.390  -2.245
  126    HZ3  LYS  14           HZ3      LYS  14  -9.227   3.936  -1.676
  127    H    SER  15           HN       SER  15  -6.590   6.229  -8.626
  128    HA   SER  15           HA       SER  15  -9.003   7.484  -9.299
  129    HB2  SER  15           HB2      SER  15  -6.550   6.945 -10.988
  130    HB3  SER  15           HB1      SER  15  -7.866   8.012 -11.466
  131    HG   SER  15           HG       SER  15  -6.644   9.407 -10.426
  132    H    PHE  16           HN       PHE  16  -7.415   4.634 -10.722
  133    HA   PHE  16           HA       PHE  16  -9.283   4.111 -12.740
  134    HB2  PHE  16           HB2      PHE  16  -7.562   2.191 -11.151
  135    HB3  PHE  16           HB1      PHE  16  -8.442   1.763 -12.618
  136    HD1  PHE  16           HD1      PHE  16  -5.286   2.155 -11.750
  137    HD2  PHE  16           HD2      PHE  16  -8.110   4.176 -14.279
  138    HE1  PHE  16           HE1      PHE  16  -3.422   3.047 -13.120
  139    HE2  PHE  16           HE2      PHE  16  -6.246   5.068 -15.648
  140    HZ   PHE  16           HZ       PHE  16  -3.901   4.504 -15.068
  141    H    GLN  17           HN       GLN  17  -9.157   2.927  -9.390
  142    HA   GLN  17           HA       GLN  17 -11.413   1.272  -9.473
  143    HB2  GLN  17           HB2      GLN  17  -9.647   1.611  -7.596
  144    HB3  GLN  17           HB1      GLN  17 -10.724   2.892  -7.037
  145    HG2  GLN  17           HG2      GLN  17 -11.812   0.158  -7.669
  146    HG3  GLN  17           HG1      GLN  17 -11.067   0.481  -6.105
  147   HE21  GLN  17          HE21      GLN  17 -13.960  -0.057  -6.695
  148   HE22  GLN  17          HE22      GLN  17 -14.799   1.299  -6.115
  149    H1   ALA   1           HT1      ALA   1 -12.720   0.674  -2.615
  150    H2   ALA   1           HT2      ALA   1 -11.915  -0.465  -1.645
  151    H3   ALA   1           HT3      ALA   1 -13.331  -0.902  -2.475
  152    HA   ALA   1           HA       ALA   1 -12.175  -0.510  -4.602
  153    HB1  ALA   1           HB1      ALA   1 -10.489   1.056  -3.628
  154    HB2  ALA   1           HB2      ALA   1  -9.749  -0.247  -4.558
  155    HB3  ALA   1           HB3      ALA   1  -9.746  -0.309  -2.796
  156    H    THR   2           HN       THR   2 -11.478  -2.387  -5.623
  157    HA   THR   2           HA       THR   2 -11.942  -4.835  -4.340
  158    HB   THR   2           HB       THR   2 -10.547  -5.701  -6.400
  159    HG1  THR   2           HG1      THR   2 -10.650  -4.026  -8.040
  160   HG21  THR   2          HG21      THR   2 -12.529  -5.559  -7.741
  161   HG22  THR   2          HG22      THR   2 -13.073  -4.112  -6.893
  162   HG23  THR   2          HG23      THR   2 -13.063  -5.668  -6.064
  163    H    LEU   3           HN       LEU   3 -10.782  -5.694  -2.743
  164    HA   LEU   3           HA       LEU   3  -8.181  -4.956  -2.010
  165    HB2  LEU   3           HB2      LEU   3  -9.747  -7.487  -1.462
  166    HB3  LEU   3           HB1      LEU   3  -8.208  -7.101  -0.692
  167    HG   LEU   3           HG       LEU   3 -10.620  -5.272  -0.607
  168   HD11  LEU   3          HD11      LEU   3 -10.955  -7.523   0.526
  169   HD12  LEU   3          HD12      LEU   3 -11.087  -6.123   1.591
  170   HD13  LEU   3          HD13      LEU   3  -9.616  -7.096   1.592
  171   HD21  LEU   3          HD21      LEU   3  -7.936  -5.347   0.792
  172   HD22  LEU   3          HD22      LEU   3  -9.285  -4.380   1.385
  173   HD23  LEU   3          HD23      LEU   3  -8.600  -4.053  -0.205
  174    H    GLU   4           HN       GLU   4  -9.312  -7.751  -3.900
  175    HA   GLU   4           HA       GLU   4  -6.825  -8.970  -4.301
  176    HB2  GLU   4           HB2      GLU   4  -7.880 -10.024  -6.289
  177    HB3  GLU   4           HB1      GLU   4  -8.890 -10.123  -4.848
  178    HG2  GLU   4           HG2      GLU   4 -10.053  -8.010  -5.666
  179    HG3  GLU   4           HG1      GLU   4  -9.196  -8.232  -7.190
  180    H    LYS   5           HN       LYS   5  -8.517  -6.544  -6.279
  181    HA   LYS   5           HA       LYS   5  -6.644  -6.356  -8.348
  182    HB2  LYS   5           HB2      LYS   5  -8.937  -5.317  -8.304
  183    HB3  LYS   5           HB1      LYS   5  -8.281  -4.070  -7.243
  184    HG2  LYS   5           HG2      LYS   5  -6.665  -3.408  -8.939
  185    HG3  LYS   5           HG1      LYS   5  -7.179  -4.728  -9.990
  186    HD2  LYS   5           HD2      LYS   5  -9.498  -3.721  -9.971
  187    HD3  LYS   5           HD1      LYS   5  -8.815  -2.326  -9.136
  188    HE2  LYS   5           HE2      LYS   5  -7.861  -3.356 -11.824
  189    HE3  LYS   5           HE1      LYS   5  -8.957  -1.992 -11.607
  190    HZ1  LYS   5           HZ1      LYS   5  -7.313  -0.735 -10.583
  191    HZ2  LYS   5           HZ2      LYS   5  -6.484  -1.504 -11.850
  192    HZ3  LYS   5           HZ3      LYS   5  -6.331  -2.078 -10.260
  193    H    LEU   6           HN       LEU   6  -6.866  -4.526  -5.305
  194    HA   LEU   6           HA       LEU   6  -4.680  -2.825  -5.714
  195    HB2  LEU   6           HB2      LEU   6  -6.263  -2.488  -3.886
  196    HB3  LEU   6           HB1      LEU   6  -5.732  -3.988  -3.126
  197    HG   LEU   6           HG       LEU   6  -3.558  -2.095  -3.771
  198   HD11  LEU   6          HD11      LEU   6  -5.225  -0.468  -3.075
  199   HD12  LEU   6          HD12      LEU   6  -4.078  -0.695  -1.754
  200   HD13  LEU   6          HD13      LEU   6  -5.666  -1.460  -1.685
  201   HD21  LEU   6          HD21      LEU   6  -3.045  -4.068  -2.511
  202   HD22  LEU   6          HD22      LEU   6  -4.398  -3.798  -1.413
  203   HD23  LEU   6          HD23      LEU   6  -2.994  -2.732  -1.360
  204    H    MET   7           HN       MET   7  -4.818  -6.030  -4.181
  205    HA   MET   7           HA       MET   7  -2.123  -6.231  -3.451
  206    HB2  MET   7           HB2      MET   7  -3.913  -7.801  -2.735
  207    HB3  MET   7           HB1      MET   7  -3.938  -8.475  -4.364
  208    HG2  MET   7           HG2      MET   7  -2.512  -9.903  -3.069
  209    HG3  MET   7           HG1      MET   7  -1.447  -8.931  -4.083
  210    HE1  MET   7           HE1      MET   7   0.881  -7.327  -1.876
  211    HE2  MET   7           HE2      MET   7   0.145  -7.410  -3.474
  212    HE3  MET   7           HE3      MET   7   0.795  -8.871  -2.734
  213    H    LYS   8           HN       LYS   8  -3.751  -7.227  -6.455
  214    HA   LYS   8           HA       LYS   8  -1.532  -8.334  -7.755
  215    HB2  LYS   8           HB2      LYS   8  -3.981  -6.936  -8.842
  216    HB3  LYS   8           HB1      LYS   8  -2.792  -7.741  -9.867
  217    HG2  LYS   8           HG2      LYS   8  -3.166  -9.853  -8.646
  218    HG3  LYS   8           HG1      LYS   8  -4.359  -9.051  -7.625
  219    HD2  LYS   8           HD2      LYS   8  -5.752  -8.572  -9.584
  220    HD3  LYS   8           HD1      LYS   8  -4.546  -9.307 -10.641
  221    HE2  LYS   8           HE2      LYS   8  -6.341 -10.913 -10.184
  222    HE3  LYS   8           HE1      LYS   8  -4.839 -11.463  -9.440
  223    HZ1  LYS   8           HZ1      LYS   8  -5.593 -11.013  -7.355
  224    HZ2  LYS   8           HZ2      LYS   8  -7.071 -11.398  -8.100
  225    HZ3  LYS   8           HZ3      LYS   8  -6.634  -9.773  -7.860
  226    H    ALA   9           HN       ALA   9  -2.770  -4.998  -7.797
  227    HA   ALA   9           HA       ALA   9  -0.910  -3.913  -9.587
  228    HB1  ALA   9           HB1      ALA   9  -2.321  -2.634  -7.235
  229    HB2  ALA   9           HB2      ALA   9  -2.864  -2.653  -8.912
  230    HB3  ALA   9           HB3      ALA   9  -1.423  -1.741  -8.462
  231    H    PHE  10           HN       PHE  10  -0.779  -4.174  -6.039
  232    HA   PHE  10           HA       PHE  10   1.671  -2.881  -5.633
  233    HB2  PHE  10           HB2      PHE  10   0.116  -3.501  -3.824
  234    HB3  PHE  10           HB1      PHE  10   0.482  -5.203  -4.096
  235    HD1  PHE  10           HD1      PHE  10   1.982  -1.937  -3.121
  236    HD2  PHE  10           HD2      PHE  10   2.424  -6.209  -3.174
  237    HE1  PHE  10           HE1      PHE  10   3.948  -1.753  -1.620
  238    HE2  PHE  10           HE2      PHE  10   4.390  -6.025  -1.675
  239    HZ   PHE  10           HZ       PHE  10   5.151  -3.797  -0.897
  240    H    GLU  11           HN       GLU  11   0.976  -6.328  -6.202
  241    HA   GLU  11           HA       GLU  11   3.599  -7.291  -6.014
  242    HB2  GLU  11           HB2      GLU  11   1.232  -8.251  -7.630
  243    HB3  GLU  11           HB1      GLU  11   2.752  -9.140  -7.525
  244    HG2  GLU  11           HG2      GLU  11   2.540  -9.339  -5.120
  245    HG3  GLU  11           HG1      GLU  11   1.124  -8.289  -5.116
  246    H    SER  12           HN       SER  12   1.795  -6.125  -8.854
  247    HA   SER  12           HA       SER  12   3.783  -6.576 -10.777
  248    HB2  SER  12           HB2      SER  12   2.618  -4.920 -12.146
  249    HB3  SER  12           HB1      SER  12   1.451  -5.960 -11.336
  250    HG   SER  12           HG       SER  12   2.176  -3.292 -10.791
  251    H    LEU  13           HN       LEU  13   3.138  -3.706  -8.774
  252    HA   LEU  13           HA       LEU  13   5.157  -2.054  -9.790
  253    HB2  LEU  13           HB2      LEU  13   3.427  -1.206  -8.297
  254    HB3  LEU  13           HB1      LEU  13   4.035  -2.212  -6.982
  255    HG   LEU  13           HG       LEU  13   6.208  -1.010  -7.096
  256   HD11  LEU  13          HD11      LEU  13   4.740   0.548  -9.237
  257   HD12  LEU  13          HD12      LEU  13   6.275  -0.308  -9.387
  258   HD13  LEU  13          HD13      LEU  13   6.177   1.166  -8.423
  259   HD21  LEU  13          HD21      LEU  13   3.959   0.999  -6.879
  260   HD22  LEU  13          HD22      LEU  13   5.459   0.935  -5.955
  261   HD23  LEU  13          HD23      LEU  13   4.198  -0.264  -5.670
  262    H    LYS  14           HN       LYS  14   5.242  -4.355  -7.077
  263    HA   LYS  14           HA       LYS  14   7.884  -3.900  -6.273
  264    HB2  LYS  14           HB2      LYS  14   6.076  -6.300  -6.085
  265    HB3  LYS  14           HB1      LYS  14   7.734  -6.357  -5.486
  266    HG2  LYS  14           HG2      LYS  14   5.772  -4.201  -4.667
  267    HG3  LYS  14           HG1      LYS  14   5.977  -5.702  -3.763
  268    HD2  LYS  14           HD2      LYS  14   8.411  -5.196  -3.543
  269    HD3  LYS  14           HD1      LYS  14   8.134  -3.650  -4.344
  270    HE2  LYS  14           HE2      LYS  14   6.556  -3.004  -2.565
  271    HE3  LYS  14           HE1      LYS  14   6.834  -4.548  -1.758
  272    HZ1  LYS  14           HZ1      LYS  14   8.225  -2.933  -0.745
  273    HZ2  LYS  14           HZ2      LYS  14   8.810  -2.390  -2.245
  274    HZ3  LYS  14           HZ3      LYS  14   9.227  -3.936  -1.676
  275    H    SER  15           HN       SER  15   6.590  -6.229  -8.626
  276    HA   SER  15           HA       SER  15   9.003  -7.484  -9.299
  277    HB2  SER  15           HB2      SER  15   6.816  -8.334 -10.029
  278    HB3  SER  15           HB1      SER  15   6.600  -6.921 -11.059
  279    HG   SER  15           HG       SER  15   8.799  -8.706 -11.249
  280    H    PHE  16           HN       PHE  16   7.415  -4.634 -10.722
  281    HA   PHE  16           HA       PHE  16   9.276  -4.108 -12.744
  282    HB2  PHE  16           HB2      PHE  16   7.098  -2.976 -12.590
  283    HB3  PHE  16           HB1      PHE  16   7.637  -2.131 -11.139
  284    HD1  PHE  16           HD1      PHE  16   8.170  -2.515 -14.784
  285    HD2  PHE  16           HD2      PHE  16   9.157  -0.265 -11.261
  286    HE1  PHE  16           HE1      PHE  16   9.226  -0.771 -16.194
  287    HE2  PHE  16           HE2      PHE  16  10.214   1.480 -12.672
  288    HZ   PHE  16           HZ       PHE  16  10.248   1.227 -15.139
  289    H    GLN  17           HN       GLN  17   9.157  -2.927  -9.390
  290    HA   GLN  17           HA       GLN  17  11.413  -1.272  -9.473
  291    HB2  GLN  17           HB2      GLN  17   9.647  -1.611  -7.596
  292    HB3  GLN  17           HB1      GLN  17  10.724  -2.892  -7.037
  293    HG2  GLN  17           HG2      GLN  17  11.812  -0.158  -7.669
  294    HG3  GLN  17           HG1      GLN  17  11.067  -0.481  -6.105
  295   HE21  GLN  17          HE21      GLN  17  13.960   0.058  -6.695
  296   HE22  GLN  17          HE22      GLN  17  14.799  -1.299  -6.115
  297    H1   ALA   1           HT1      ALA   1  -0.674  12.720   2.615
  298    H2   ALA   1           HT2      ALA   1   0.465  11.915   1.645
  299    H3   ALA   1           HT3      ALA   1   0.902  13.331   2.475
  300    HA   ALA   1           HA       ALA   1   0.509  12.175   4.602
  301    HB1  ALA   1           HB1      ALA   1  -1.056  10.489   3.628
  302    HB2  ALA   1           HB2      ALA   1   0.247   9.749   4.558
  303    HB3  ALA   1           HB3      ALA   1   0.310   9.746   2.796
  304    H    THR   2           HN       THR   2   2.387  11.478   5.623
  305    HA   THR   2           HA       THR   2   4.835  11.942   4.341
  306    HB   THR   2           HB       THR   2   5.706  10.550   6.397
  307    HG1  THR   2           HG1      THR   2   4.023  10.647   8.038
  308   HG21  THR   2          HG21      THR   2   5.548  12.526   7.747
  309   HG22  THR   2          HG22      THR   2   4.100  13.064   6.897
  310   HG23  THR   2          HG23      THR   2   5.658  13.066   6.072
  311    H    LEU   3           HN       LEU   3   5.694  10.782   2.743
  312    HA   LEU   3           HA       LEU   3   4.956   8.181   2.010
  313    HB2  LEU   3           HB2      LEU   3   7.487   9.747   1.462
  314    HB3  LEU   3           HB1      LEU   3   7.101   8.208   0.692
  315    HG   LEU   3           HG       LEU   3   5.272  10.620   0.607
  316   HD11  LEU   3          HD11      LEU   3   7.523  10.955  -0.526
  317   HD12  LEU   3          HD12      LEU   3   6.123  11.087  -1.591
  318   HD13  LEU   3          HD13      LEU   3   7.096   9.616  -1.592
  319   HD21  LEU   3          HD21      LEU   3   5.347   7.936  -0.792
  320   HD22  LEU   3          HD22      LEU   3   4.380   9.285  -1.385
  321   HD23  LEU   3          HD23      LEU   3   4.053   8.600   0.205
  322    H    GLU   4           HN       GLU   4   7.751   9.312   3.900
  323    HA   GLU   4           HA       GLU   4   8.970   6.825   4.301
  324    HB2  GLU   4           HB2      GLU   4  10.024   7.880   6.289
  325    HB3  GLU   4           HB1      GLU   4  10.123   8.890   4.848
  326    HG2  GLU   4           HG2      GLU   4   8.010  10.053   5.666
  327    HG3  GLU   4           HG1      GLU   4   8.232   9.196   7.190
  328    H    LYS   5           HN       LYS   5   6.544   8.517   6.279
  329    HA   LYS   5           HA       LYS   5   6.362   6.638   8.343
  330    HB2  LYS   5           HB2      LYS   5   5.319   8.941   8.296
  331    HB3  LYS   5           HB1      LYS   5   4.045   8.256   7.285
  332    HG2  LYS   5           HG2      LYS   5   3.211   6.921   8.989
  333    HG3  LYS   5           HG1      LYS   5   4.759   6.854   9.833
  334    HD2  LYS   5           HD2      LYS   5   4.482   9.319  10.337
  335    HD3  LYS   5           HD1      LYS   5   2.839   9.192   9.706
  336    HE2  LYS   5           HE2      LYS   5   3.916   7.442  11.932
  337    HE3  LYS   5           HE1      LYS   5   3.009   8.927  12.213
  338    HZ1  LYS   5           HZ1      LYS   5   1.327   7.823  10.598
  339    HZ2  LYS   5           HZ2      LYS   5   1.356   7.359  12.232
  340    HZ3  LYS   5           HZ3      LYS   5   2.099   6.384  11.056
  341    H    LEU   6           HN       LEU   6   4.526   6.866   5.305
  342    HA   LEU   6           HA       LEU   6   2.825   4.680   5.715
  343    HB2  LEU   6           HB2      LEU   6   2.487   6.263   3.886
  344    HB3  LEU   6           HB1      LEU   6   3.987   5.732   3.126
  345    HG   LEU   6           HG       LEU   6   2.095   3.558   3.772
  346   HD11  LEU   6          HD11      LEU   6   0.467   5.224   3.075
  347   HD12  LEU   6          HD12      LEU   6   0.694   4.077   1.755
  348   HD13  LEU   6          HD13      LEU   6   1.459   5.665   1.685
  349   HD21  LEU   6          HD21      LEU   6   4.068   3.044   2.511
  350   HD22  LEU   6          HD22      LEU   6   3.798   4.398   1.413
  351   HD23  LEU   6          HD23      LEU   6   2.732   2.994   1.361
  352    H    MET   7           HN       MET   7   6.030   4.818   4.181
  353    HA   MET   7           HA       MET   7   6.231   2.123   3.451
  354    HB2  MET   7           HB2      MET   7   7.801   3.913   2.735
  355    HB3  MET   7           HB1      MET   7   8.475   3.938   4.364
  356    HG2  MET   7           HG2      MET   7   9.903   2.512   3.069
  357    HG3  MET   7           HG1      MET   7   8.931   1.447   4.083
  358    HE1  MET   7           HE1      MET   7   7.327  -0.881   1.876
  359    HE2  MET   7           HE2      MET   7   7.410  -0.145   3.474
  360    HE3  MET   7           HE3      MET   7   8.871  -0.795   2.734
  361    H    LYS   8           HN       LYS   8   7.227   3.751   6.455
  362    HA   LYS   8           HA       LYS   8   8.334   1.532   7.755
  363    HB2  LYS   8           HB2      LYS   8   6.936   3.981   8.842
  364    HB3  LYS   8           HB1      LYS   8   7.741   2.792   9.867
  365    HG2  LYS   8           HG2      LYS   8   9.853   3.166   8.646
  366    HG3  LYS   8           HG1      LYS   8   9.051   4.359   7.625
  367    HD2  LYS   8           HD2      LYS   8   8.572   5.752   9.584
  368    HD3  LYS   8           HD1      LYS   8   9.307   4.546  10.641
  369    HE2  LYS   8           HE2      LYS   8  10.913   6.341  10.184
  370    HE3  LYS   8           HE1      LYS   8  11.463   4.839   9.440
  371    HZ1  LYS   8           HZ1      LYS   8  11.013   5.593   7.355
  372    HZ2  LYS   8           HZ2      LYS   8  11.398   7.071   8.100
  373    HZ3  LYS   8           HZ3      LYS   8   9.773   6.634   7.860
  374    H    ALA   9           HN       ALA   9   4.998   2.770   7.797
  375    HA   ALA   9           HA       ALA   9   3.913   0.910   9.587
  376    HB1  ALA   9           HB1      ALA   9   2.616   2.292   7.226
  377    HB2  ALA   9           HB2      ALA   9   2.670   2.881   8.888
  378    HB3  ALA   9           HB3      ALA   9   1.742   1.434   8.495
  379    H    PHE  10           HN       PHE  10   4.174   0.779   6.039
  380    HA   PHE  10           HA       PHE  10   2.881  -1.671   5.633
  381    HB2  PHE  10           HB2      PHE  10   3.501  -0.116   3.824
  382    HB3  PHE  10           HB1      PHE  10   5.203  -0.482   4.096
  383    HD1  PHE  10           HD1      PHE  10   1.937  -1.982   3.121
  384    HD2  PHE  10           HD2      PHE  10   6.209  -2.424   3.174
  385    HE1  PHE  10           HE1      PHE  10   1.753  -3.948   1.620
  386    HE2  PHE  10           HE2      PHE  10   6.025  -4.390   1.675
  387    HZ   PHE  10           HZ       PHE  10   3.797  -5.151   0.897
  388    H    GLU  11           HN       GLU  11   6.328  -0.976   6.202
  389    HA   GLU  11           HA       GLU  11   7.291  -3.599   6.014
  390    HB2  GLU  11           HB2      GLU  11   8.251  -1.232   7.630
  391    HB3  GLU  11           HB1      GLU  11   9.140  -2.752   7.525
  392    HG2  GLU  11           HG2      GLU  11   9.339  -2.540   5.120
  393    HG3  GLU  11           HG1      GLU  11   8.289  -1.124   5.116
  394    H    SER  12           HN       SER  12   6.125  -1.795   8.854
  395    HA   SER  12           HA       SER  12   6.574  -3.775  10.786
  396    HB2  SER  12           HB2      SER  12   5.954  -1.469  11.365
  397    HB3  SER  12           HB1      SER  12   4.357  -1.713  10.662
  398    HG   SER  12           HG       SER  12   4.637  -2.032  13.030
  399    H    LEU  13           HN       LEU  13   3.706  -3.138   8.774
  400    HA   LEU  13           HA       LEU  13   2.051  -5.156   9.789
  401    HB2  LEU  13           HB2      LEU  13   1.204  -3.429   8.295
  402    HB3  LEU  13           HB1      LEU  13   2.223  -4.025   6.985
  403    HG   LEU  13           HG       LEU  13   1.028  -6.201   7.071
  404   HD11  LEU  13          HD11      LEU  13  -0.571  -4.761   9.202
  405   HD12  LEU  13          HD12      LEU  13   0.327  -6.269   9.371
  406   HD13  LEU  13          HD13      LEU  13  -1.138  -6.220   8.391
  407   HD21  LEU  13          HD21      LEU  13  -0.987  -3.956   6.867
  408   HD22  LEU  13          HD22      LEU  13  -0.920  -5.449   5.933
  409   HD23  LEU  13          HD23      LEU  13   0.277  -4.185   5.659
  410    H    LYS  14           HN       LYS  14   4.355  -5.242   7.077
  411    HA   LYS  14           HA       LYS  14   3.900  -7.884   6.273
  412    HB2  LYS  14           HB2      LYS  14   6.300  -6.076   6.085
  413    HB3  LYS  14           HB1      LYS  14   6.357  -7.734   5.486
  414    HG2  LYS  14           HG2      LYS  14   4.201  -5.772   4.667
  415    HG3  LYS  14           HG1      LYS  14   5.702  -5.977   3.763
  416    HD2  LYS  14           HD2      LYS  14   5.196  -8.411   3.543
  417    HD3  LYS  14           HD1      LYS  14   3.650  -8.134   4.344
  418    HE2  LYS  14           HE2      LYS  14   3.004  -6.556   2.565
  419    HE3  LYS  14           HE1      LYS  14   4.548  -6.834   1.758
  420    HZ1  LYS  14           HZ1      LYS  14   2.933  -8.225   0.745
  421    HZ2  LYS  14           HZ2      LYS  14   2.390  -8.810   2.245
  422    HZ3  LYS  14           HZ3      LYS  14   3.936  -9.227   1.676
  423    H    SER  15           HN       SER  15   6.229  -6.590   8.626
  424    HA   SER  15           HA       SER  15   7.484  -9.003   9.299
  425    HB2  SER  15           HB2      SER  15   8.334  -6.817  10.029
  426    HB3  SER  15           HB1      SER  15   6.921  -6.600  11.058
  427    HG   SER  15           HG       SER  15   9.163  -7.761  11.695
  428    H    PHE  16           HN       PHE  16   4.634  -7.415  10.722
  429    HA   PHE  16           HA       PHE  16   4.113  -9.280  12.741
  430    HB2  PHE  16           HB2      PHE  16   2.402  -7.346  11.212
  431    HB3  PHE  16           HB1      PHE  16   1.656  -8.485  12.333
  432    HD1  PHE  16           HD1      PHE  16   3.146  -5.299  12.047
  433    HD2  PHE  16           HD2      PHE  16   2.868  -8.669  14.695
  434    HE1  PHE  16           HE1      PHE  16   3.803  -3.856  13.954
  435    HE2  PHE  16           HE2      PHE  16   3.523  -7.226  16.602
  436    HZ   PHE  16           HZ       PHE  16   3.991  -4.819  16.231
  437    H    GLN  17           HN       GLN  17   2.927  -9.157   9.390
  438    HA   GLN  17           HA       GLN  17   1.272 -11.413   9.473
  439    HB2  GLN  17           HB2      GLN  17   1.611  -9.647   7.596
  440    HB3  GLN  17           HB1      GLN  17   2.892 -10.724   7.037
  441    HG2  GLN  17           HG2      GLN  17   0.158 -11.812   7.669
  442    HG3  GLN  17           HG1      GLN  17   0.481 -11.067   6.105
  443   HE21  GLN  17          HE21      GLN  17  -0.057 -13.960   6.695
  444   HE22  GLN  17          HE22      GLN  17   1.299 -14.799   6.115
  445    H1   ALA   1           HT1      ALA   1   0.674 -12.720   2.615
  446    H2   ALA   1           HT2      ALA   1  -0.465 -11.915   1.645
  447    H3   ALA   1           HT3      ALA   1  -0.902 -13.331   2.475
  448    HA   ALA   1           HA       ALA   1  -0.510 -12.175   4.602
  449    HB1  ALA   1           HB1      ALA   1   1.056 -10.489   3.628
  450    HB2  ALA   1           HB2      ALA   1  -0.247  -9.749   4.558
  451    HB3  ALA   1           HB3      ALA   1  -0.309  -9.746   2.796
  452    H    THR   2           HN       THR   2  -2.387 -11.478   5.623
  453    HA   THR   2           HA       THR   2  -4.835 -11.942   4.340
  454    HB   THR   2           HB       THR   2  -5.701 -10.547   6.400
  455    HG1  THR   2           HG1      THR   2  -4.026 -10.650   8.040
  456   HG21  THR   2          HG21      THR   2  -5.559 -12.529   7.741
  457   HG22  THR   2          HG22      THR   2  -4.112 -13.073   6.893
  458   HG23  THR   2          HG23      THR   2  -5.668 -13.063   6.064
  459    H    LEU   3           HN       LEU   3  -5.694 -10.782   2.743
  460    HA   LEU   3           HA       LEU   3  -4.956  -8.181   2.010
  461    HB2  LEU   3           HB2      LEU   3  -7.487  -9.747   1.462
  462    HB3  LEU   3           HB1      LEU   3  -7.101  -8.208   0.692
  463    HG   LEU   3           HG       LEU   3  -5.272 -10.620   0.607
  464   HD11  LEU   3          HD11      LEU   3  -7.523 -10.955  -0.526
  465   HD12  LEU   3          HD12      LEU   3  -6.123 -11.087  -1.591
  466   HD13  LEU   3          HD13      LEU   3  -7.096  -9.616  -1.592
  467   HD21  LEU   3          HD21      LEU   3  -5.347  -7.936  -0.792
  468   HD22  LEU   3          HD22      LEU   3  -4.380  -9.285  -1.385
  469   HD23  LEU   3          HD23      LEU   3  -4.053  -8.600   0.205
  470    H    GLU   4           HN       GLU   4  -7.751  -9.312   3.900
  471    HA   GLU   4           HA       GLU   4  -8.970  -6.825   4.301
  472    HB2  GLU   4           HB2      GLU   4 -10.024  -7.880   6.289
  473    HB3  GLU   4           HB1      GLU   4 -10.123  -8.890   4.848
  474    HG2  GLU   4           HG2      GLU   4  -8.010 -10.053   5.666
  475    HG3  GLU   4           HG1      GLU   4  -8.232  -9.196   7.190
  476    H    LYS   5           HN       LYS   5  -6.544  -8.517   6.279
  477    HA   LYS   5           HA       LYS   5  -6.356  -6.644   8.348
  478    HB2  LYS   5           HB2      LYS   5  -5.317  -8.937   8.304
  479    HB3  LYS   5           HB1      LYS   5  -4.070  -8.281   7.243
  480    HG2  LYS   5           HG2      LYS   5  -3.408  -6.665   8.939
  481    HG3  LYS   5           HG1      LYS   5  -4.728  -7.179   9.990
  482    HD2  LYS   5           HD2      LYS   5  -3.721  -9.498   9.971
  483    HD3  LYS   5           HD1      LYS   5  -2.326  -8.815   9.136
  484    HE2  LYS   5           HE2      LYS   5  -3.356  -7.861  11.824
  485    HE3  LYS   5           HE1      LYS   5  -1.992  -8.957  11.607
  486    HZ1  LYS   5           HZ1      LYS   5  -0.735  -7.313  10.583
  487    HZ2  LYS   5           HZ2      LYS   5  -1.504  -6.484  11.850
  488    HZ3  LYS   5           HZ3      LYS   5  -2.078  -6.331  10.260
  489    H    LEU   6           HN       LEU   6  -4.526  -6.866   5.305
  490    HA   LEU   6           HA       LEU   6  -2.825  -4.680   5.714
  491    HB2  LEU   6           HB2      LEU   6  -2.488  -6.263   3.886
  492    HB3  LEU   6           HB1      LEU   6  -3.988  -5.732   3.126
  493    HG   LEU   6           HG       LEU   6  -2.095  -3.558   3.771
  494   HD11  LEU   6          HD11      LEU   6  -0.468  -5.225   3.075
  495   HD12  LEU   6          HD12      LEU   6  -0.695  -4.078   1.754
  496   HD13  LEU   6          HD13      LEU   6  -1.460  -5.666   1.685
  497   HD21  LEU   6          HD21      LEU   6  -4.068  -3.045   2.511
  498   HD22  LEU   6          HD22      LEU   6  -3.798  -4.398   1.413
  499   HD23  LEU   6          HD23      LEU   6  -2.732  -2.994   1.360
  500    H    MET   7           HN       MET   7  -6.030  -4.818   4.181
  501    HA   MET   7           HA       MET   7  -6.231  -2.123   3.451
  502    HB2  MET   7           HB2      MET   7  -7.801  -3.913   2.735
  503    HB3  MET   7           HB1      MET   7  -8.475  -3.938   4.364
  504    HG2  MET   7           HG2      MET   7  -9.903  -2.512   3.069
  505    HG3  MET   7           HG1      MET   7  -8.931  -1.447   4.083
  506    HE1  MET   7           HE1      MET   7  -7.327   0.881   1.876
  507    HE2  MET   7           HE2      MET   7  -7.410   0.145   3.474
  508    HE3  MET   7           HE3      MET   7  -8.871   0.795   2.734
  509    H    LYS   8           HN       LYS   8  -7.227  -3.751   6.455
  510    HA   LYS   8           HA       LYS   8  -8.334  -1.532   7.755
  511    HB2  LYS   8           HB2      LYS   8  -6.936  -3.981   8.842
  512    HB3  LYS   8           HB1      LYS   8  -7.741  -2.792   9.867
  513    HG2  LYS   8           HG2      LYS   8  -9.853  -3.166   8.646
  514    HG3  LYS   8           HG1      LYS   8  -9.051  -4.359   7.625
  515    HD2  LYS   8           HD2      LYS   8  -8.572  -5.752   9.584
  516    HD3  LYS   8           HD1      LYS   8  -9.307  -4.546  10.641
  517    HE2  LYS   8           HE2      LYS   8 -10.913  -6.341  10.184
  518    HE3  LYS   8           HE1      LYS   8 -11.463  -4.839   9.440
  519    HZ1  LYS   8           HZ1      LYS   8 -11.013  -5.593   7.355
  520    HZ2  LYS   8           HZ2      LYS   8 -11.398  -7.071   8.100
  521    HZ3  LYS   8           HZ3      LYS   8  -9.773  -6.634   7.860
  522    H    ALA   9           HN       ALA   9  -4.998  -2.770   7.797
  523    HA   ALA   9           HA       ALA   9  -3.913  -0.910   9.587
  524    HB1  ALA   9           HB1      ALA   9  -2.634  -2.321   7.235
  525    HB2  ALA   9           HB2      ALA   9  -2.653  -2.864   8.912
  526    HB3  ALA   9           HB3      ALA   9  -1.741  -1.423   8.462
  527    H    PHE  10           HN       PHE  10  -4.174  -0.779   6.039
  528    HA   PHE  10           HA       PHE  10  -2.881   1.671   5.633
  529    HB2  PHE  10           HB2      PHE  10  -3.501   0.116   3.824
  530    HB3  PHE  10           HB1      PHE  10  -5.203   0.482   4.096
  531    HD1  PHE  10           HD1      PHE  10  -1.937   1.982   3.121
  532    HD2  PHE  10           HD2      PHE  10  -6.209   2.424   3.174
  533    HE1  PHE  10           HE1      PHE  10  -1.753   3.948   1.620
  534    HE2  PHE  10           HE2      PHE  10  -6.025   4.390   1.675
  535    HZ   PHE  10           HZ       PHE  10  -3.797   5.151   0.897
  536    H    GLU  11           HN       GLU  11  -6.328   0.976   6.202
  537    HA   GLU  11           HA       GLU  11  -7.291   3.599   6.014
  538    HB2  GLU  11           HB2      GLU  11  -8.251   1.232   7.630
  539    HB3  GLU  11           HB1      GLU  11  -9.140   2.752   7.525
  540    HG2  GLU  11           HG2      GLU  11  -9.339   2.540   5.120
  541    HG3  GLU  11           HG1      GLU  11  -8.289   1.124   5.116
  542    H    SER  12           HN       SER  12  -6.125   1.795   8.854
  543    HA   SER  12           HA       SER  12  -6.577   3.785  10.774
  544    HB2  SER  12           HB2      SER  12  -4.924   2.623  12.148
  545    HB3  SER  12           HB1      SER  12  -5.966   1.455  11.341
  546    HG   SER  12           HG       SER  12  -3.308   1.750  11.190
  547    H    LEU  13           HN       LEU  13  -3.706   3.138   8.774
  548    HA   LEU  13           HA       LEU  13  -2.053   5.157   9.790
  549    HB2  LEU  13           HB2      LEU  13  -1.207   3.428   8.295
  550    HB3  LEU  13           HB1      LEU  13  -2.213   4.038   6.982
  551    HG   LEU  13           HG       LEU  13  -1.011   6.211   7.097
  552   HD11  LEU  13          HD11      LEU  13   0.545   4.742   9.238
  553   HD12  LEU  13          HD12      LEU  13  -0.312   6.275   9.389
  554   HD13  LEU  13          HD13      LEU  13   1.163   6.181   8.427
  555   HD21  LEU  13          HD21      LEU  13   0.995   3.959   6.879
  556   HD22  LEU  13          HD22      LEU  13   0.940   5.464   5.961
  557   HD23  LEU  13          HD23      LEU  13  -0.263   4.208   5.667
  558    H    LYS  14           HN       LYS  14  -4.355   5.242   7.077
  559    HA   LYS  14           HA       LYS  14  -3.900   7.884   6.273
  560    HB2  LYS  14           HB2      LYS  14  -6.300   6.076   6.085
  561    HB3  LYS  14           HB1      LYS  14  -6.357   7.734   5.486
  562    HG2  LYS  14           HG2      LYS  14  -4.201   5.772   4.667
  563    HG3  LYS  14           HG1      LYS  14  -5.702   5.977   3.763
  564    HD2  LYS  14           HD2      LYS  14  -5.196   8.411   3.543
  565    HD3  LYS  14           HD1      LYS  14  -3.650   8.134   4.344
  566    HE2  LYS  14           HE2      LYS  14  -3.004   6.556   2.565
  567    HE3  LYS  14           HE1      LYS  14  -4.548   6.834   1.758
  568    HZ1  LYS  14           HZ1      LYS  14  -2.933   8.225   0.745
  569    HZ2  LYS  14           HZ2      LYS  14  -2.390   8.810   2.245
  570    HZ3  LYS  14           HZ3      LYS  14  -3.936   9.227   1.676
  571    H    SER  15           HN       SER  15  -6.229   6.590   8.626
  572    HA   SER  15           HA       SER  15  -7.484   9.003   9.299
  573    HB2  SER  15           HB2      SER  15  -8.334   6.817  10.029
  574    HB3  SER  15           HB1      SER  15  -6.921   6.600  11.058
  575    HG   SER  15           HG       SER  15  -7.657   8.106  12.407
  576    H    PHE  16           HN       PHE  16  -4.634   7.415  10.722
  577    HA   PHE  16           HA       PHE  16  -4.110   9.278  12.743
  578    HB2  PHE  16           HB2      PHE  16  -2.946   7.142  12.664
  579    HB3  PHE  16           HB1      PHE  16  -2.165   7.593  11.147
  580    HD1  PHE  16           HD1      PHE  16  -2.431   8.423  14.759
  581    HD2  PHE  16           HD2      PHE  16  -0.257   9.046  11.106
  582    HE1  PHE  16           HE1      PHE  16  -0.638   9.578  16.023
  583    HE2  PHE  16           HE2      PHE  16   1.537  10.200  12.371
  584    HZ   PHE  16           HZ       PHE  16   1.346  10.466  14.830
  585    H    GLN  17           HN       GLN  17  -2.927   9.157   9.390
  586    HA   GLN  17           HA       GLN  17  -1.272  11.413   9.472
  587    HB2  GLN  17           HB2      GLN  17  -1.612   9.647   7.596
  588    HB3  GLN  17           HB1      GLN  17  -2.893  10.724   7.037
  589    HG2  GLN  17           HG2      GLN  17  -0.158  11.811   7.668
  590    HG3  GLN  17           HG1      GLN  17  -0.482  11.066   6.105
  591   HE21  GLN  17          HE21      GLN  17   0.057  13.959   6.695
  592   HE22  GLN  17          HE22      GLN  17  -1.300  14.798   6.115
  Start of MODEL    4
    1    H1   ALA   1           HT1      ALA   1  13.162   1.558  -6.074
    2    H2   ALA   1           HT2      ALA   1  13.712   0.368  -4.993
    3    H3   ALA   1           HT3      ALA   1  13.861   2.014  -4.598
    4    HA   ALA   1           HA       ALA   1  11.375   0.410  -4.781
    5    HB1  ALA   1           HB1      ALA   1  12.313   0.148  -2.635
    6    HB2  ALA   1           HB2      ALA   1  11.181   1.484  -2.421
    7    HB3  ALA   1           HB3      ALA   1  12.906   1.808  -2.593
    8    H    THR   2           HN       THR   2  12.816   3.642  -4.563
    9    HA   THR   2           HA       THR   2  11.903   5.743  -4.818
   10    HB   THR   2           HB       THR   2  10.271   5.826  -6.813
   11    HG1  THR   2           HG1      THR   2  10.160   3.938  -7.991
   12   HG21  THR   2          HG21      THR   2  12.095   5.550  -8.381
   13   HG22  THR   2          HG22      THR   2  12.969   4.522  -7.246
   14   HG23  THR   2          HG23      THR   2  12.746   6.235  -6.892
   15    H    LEU   3           HN       LEU   3  10.861   5.979  -2.822
   16    HA   LEU   3           HA       LEU   3   8.363   4.931  -2.117
   17    HB2  LEU   3           HB2      LEU   3   9.757   7.480  -1.278
   18    HB3  LEU   3           HB1      LEU   3   8.267   6.899  -0.535
   19    HG   LEU   3           HG       LEU   3  10.787   5.231  -0.733
   20   HD11  LEU   3          HD11      LEU   3   9.752   6.980   1.516
   21   HD12  LEU   3          HD12      LEU   3  11.290   7.142   0.668
   22   HD13  LEU   3          HD13      LEU   3  11.005   5.756   1.721
   23   HD21  LEU   3          HD21      LEU   3   8.889   3.827  -0.430
   24   HD22  LEU   3          HD22      LEU   3   8.129   4.963   0.684
   25   HD23  LEU   3          HD23      LEU   3   9.547   4.046   1.190
   26    H    GLU   4           HN       GLU   4   9.183   8.038  -3.645
   27    HA   GLU   4           HA       GLU   4   6.596   9.094  -3.806
   28    HB2  GLU   4           HB2      GLU   4   8.638  10.394  -4.267
   29    HB3  GLU   4           HB1      GLU   4   8.896   9.459  -5.741
   30    HG2  GLU   4           HG2      GLU   4   6.766  10.257  -6.650
   31    HG3  GLU   4           HG1      GLU   4   6.445  11.146  -5.162
   32    H    LYS   5           HN       LYS   5   8.391   7.095  -6.140
   33    HA   LYS   5           HA       LYS   5   6.457   7.021  -8.161
   34    HB2  LYS   5           HB2      LYS   5   8.750   6.205  -8.478
   35    HB3  LYS   5           HB1      LYS   5   8.439   4.875  -7.363
   36    HG2  LYS   5           HG2      LYS   5   8.191   4.078  -9.657
   37    HG3  LYS   5           HG1      LYS   5   6.614   4.084  -8.869
   38    HD2  LYS   5           HD2      LYS   5   5.973   6.116  -9.974
   39    HD3  LYS   5           HD1      LYS   5   7.615   6.387 -10.560
   40    HE2  LYS   5           HE2      LYS   5   6.294   5.499 -12.390
   41    HE3  LYS   5           HE1      LYS   5   7.430   4.254 -11.873
   42    HZ1  LYS   5           HZ1      LYS   5   5.431   3.628 -10.313
   43    HZ2  LYS   5           HZ2      LYS   5   5.518   3.053 -11.909
   44    HZ3  LYS   5           HZ3      LYS   5   4.527   4.381 -11.534
   45    H    LEU   6           HN       LEU   6   6.951   4.830  -5.402
   46    HA   LEU   6           HA       LEU   6   4.898   3.015  -5.974
   47    HB2  LEU   6           HB2      LEU   6   6.580   2.588  -4.251
   48    HB3  LEU   6           HB1      LEU   6   5.950   3.919  -3.281
   49    HG   LEU   6           HG       LEU   6   3.765   2.758  -3.126
   50   HD11  LEU   6          HD11      LEU   6   3.718   1.483  -5.153
   51   HD12  LEU   6          HD12      LEU   6   3.772   0.309  -3.838
   52   HD13  LEU   6          HD13      LEU   6   5.234   0.673  -4.756
   53   HD21  LEU   6          HD21      LEU   6   4.489   0.995  -1.599
   54   HD22  LEU   6          HD22      LEU   6   5.558   2.387  -1.422
   55   HD23  LEU   6          HD23      LEU   6   6.091   0.976  -2.336
   56    H    MET   7           HN       MET   7   4.835   5.991  -4.023
   57    HA   MET   7           HA       MET   7   2.165   5.860  -3.194
   58    HB2  MET   7           HB2      MET   7   3.798   7.469  -2.288
   59    HB3  MET   7           HB1      MET   7   3.801   8.328  -3.828
   60    HG2  MET   7           HG2      MET   7   2.283   9.463  -2.297
   61    HG3  MET   7           HG1      MET   7   1.339   8.698  -3.574
   62    HE1  MET   7           HE1      MET   7   0.006   9.670  -0.985
   63    HE2  MET   7           HE2      MET   7  -1.049   8.311  -0.603
   64    HE3  MET   7           HE3      MET   7  -0.833   8.805  -2.281
   65    H    LYS   8           HN       LYS   8   3.583   7.383  -6.081
   66    HA   LYS   8           HA       LYS   8   1.227   8.454  -7.147
   67    HB2  LYS   8           HB2      LYS   8   3.786   7.511  -8.424
   68    HB3  LYS   8           HB1      LYS   8   2.457   8.154  -9.388
   69    HG2  LYS   8           HG2      LYS   8   2.488  10.218  -7.984
   70    HG3  LYS   8           HG1      LYS   8   3.894   9.579  -7.131
   71    HD2  LYS   8           HD2      LYS   8   5.227   9.608  -9.126
   72    HD3  LYS   8           HD1      LYS   8   3.819   9.935 -10.136
   73    HE2  LYS   8           HE2      LYS   8   5.063  12.006  -9.816
   74    HE3  LYS   8           HE1      LYS   8   3.529  12.117  -8.953
   75    HZ1  LYS   8           HZ1      LYS   8   5.037  12.839  -7.394
   76    HZ2  LYS   8           HZ2      LYS   8   6.241  11.743  -7.878
   77    HZ3  LYS   8           HZ3      LYS   8   4.900  11.197  -6.992
   78    H    ALA   9           HN       ALA   9   2.732   5.275  -7.684
   79    HA   ALA   9           HA       ALA   9   0.894   4.283  -9.549
   80    HB1  ALA   9           HB1      ALA   9   1.886   2.220  -9.206
   81    HB2  ALA   9           HB2      ALA   9   2.074   2.481  -7.472
   82    HB3  ALA   9           HB3      ALA   9   3.145   3.299  -8.609
   83    H    PHE  10           HN       PHE  10   0.888   4.057  -5.996
   84    HA   PHE  10           HA       PHE  10  -1.432   2.517  -5.703
   85    HB2  PHE  10           HB2      PHE  10   0.071   2.961  -3.834
   86    HB3  PHE  10           HB1      PHE  10  -0.321   4.679  -3.898
   87    HD1  PHE  10           HD1      PHE  10  -1.801   1.299  -3.351
   88    HD2  PHE  10           HD2      PHE  10  -2.244   5.538  -2.811
   89    HE1  PHE  10           HE1      PHE  10  -3.763   0.908  -1.887
   90    HE2  PHE  10           HE2      PHE  10  -4.207   5.146  -1.347
   91    HZ   PHE  10           HZ       PHE  10  -4.966   2.831  -0.885
   92    H    GLU  11           HN       GLU  11  -1.042   6.055  -5.813
   93    HA   GLU  11           HA       GLU  11  -3.723   6.758  -5.418
   94    HB2  GLU  11           HB2      GLU  11  -1.518   8.122  -6.973
   95    HB3  GLU  11           HB1      GLU  11  -3.094   8.857  -6.682
   96    HG2  GLU  11           HG2      GLU  11  -1.176   7.897  -4.537
   97    HG3  GLU  11           HG1      GLU  11  -1.451   9.579  -4.986
   98    H    SER  12           HN       SER  12  -1.951   6.137  -8.441
   99    HA   SER  12           HA       SER  12  -4.035   6.668 -10.236
  100    HB2  SER  12           HB2      SER  12  -1.743   4.700 -10.440
  101    HB3  SER  12           HB1      SER  12  -2.797   5.135 -11.782
  102    HG   SER  12           HG       SER  12  -0.826   6.609 -10.479
  103    H    LEU  13           HN       LEU  13  -3.087   3.622  -8.650
  104    HA   LEU  13           HA       LEU  13  -5.003   1.946  -9.818
  105    HB2  LEU  13           HB2      LEU  13  -3.713   1.882  -7.083
  106    HB3  LEU  13           HB1      LEU  13  -4.698   0.571  -7.732
  107    HG   LEU  13           HG       LEU  13  -2.301   1.685  -9.203
  108   HD11  LEU  13          HD11      LEU  13  -2.494  -0.526  -7.150
  109   HD12  LEU  13          HD12      LEU  13  -1.374   0.835  -7.183
  110   HD13  LEU  13          HD13      LEU  13  -1.202  -0.475  -8.349
  111   HD21  LEU  13          HD21      LEU  13  -3.867   0.442 -10.592
  112   HD22  LEU  13          HD22      LEU  13  -3.932  -0.867  -9.412
  113   HD23  LEU  13          HD23      LEU  13  -2.447  -0.565 -10.314
  114    H    LYS  14           HN       LYS  14  -5.166   3.857  -6.820
  115    HA   LYS  14           HA       LYS  14  -7.723   3.077  -5.995
  116    HB2  LYS  14           HB2      LYS  14  -6.181   4.354  -4.570
  117    HB3  LYS  14           HB1      LYS  14  -6.356   5.754  -5.628
  118    HG2  LYS  14           HG2      LYS  14  -7.834   6.035  -3.718
  119    HG3  LYS  14           HG1      LYS  14  -8.817   5.741  -5.151
  120    HD2  LYS  14           HD2      LYS  14  -9.095   3.401  -4.539
  121    HD3  LYS  14           HD1      LYS  14  -7.994   3.594  -3.174
  122    HE2  LYS  14           HE2      LYS  14  -9.541   5.227  -2.157
  123    HE3  LYS  14           HE1      LYS  14 -10.644   5.030  -3.519
  124    HZ1  LYS  14           HZ1      LYS  14  -9.829   2.940  -1.576
  125    HZ2  LYS  14           HZ2      LYS  14 -10.764   2.645  -2.963
  126    HZ3  LYS  14           HZ3      LYS  14 -11.364   3.644  -1.726
  127    H    SER  15           HN       SER  15  -6.724   5.797  -8.060
  128    HA   SER  15           HA       SER  15  -9.256   6.921  -8.484
  129    HB2  SER  15           HB2      SER  15  -7.177   8.043  -9.157
  130    HB3  SER  15           HB1      SER  15  -6.890   6.803 -10.375
  131    HG   SER  15           HG       SER  15  -8.202   7.840 -11.633
  132    H    PHE  16           HN       PHE  16  -7.502   4.430 -10.326
  133    HA   PHE  16           HA       PHE  16  -9.398   4.021 -12.345
  134    HB2  PHE  16           HB2      PHE  16  -7.128   3.072 -12.412
  135    HB3  PHE  16           HB1      PHE  16  -7.539   1.994 -11.078
  136    HD1  PHE  16           HD1      PHE  16  -8.385   2.877 -14.591
  137    HD2  PHE  16           HD2      PHE  16  -8.768  -0.018 -11.441
  138    HE1  PHE  16           HE1      PHE  16  -9.349   1.255 -16.200
  139    HE2  PHE  16           HE2      PHE  16  -9.732  -1.640 -13.050
  140    HZ   PHE  16           HZ       PHE  16 -10.022  -1.004 -15.429
  141    H    GLN  17           HN       GLN  17  -9.044   2.419  -9.188
  142    HA   GLN  17           HA       GLN  17 -11.159   0.601  -9.425
  143    HB2  GLN  17           HB2      GLN  17  -9.487   1.661  -7.293
  144    HB3  GLN  17           HB1      GLN  17 -11.134   1.346  -6.744
  145    HG2  GLN  17           HG2      GLN  17  -9.967  -0.707  -6.443
  146    HG3  GLN  17           HG1      GLN  17 -10.930  -0.926  -7.903
  147   HE21  GLN  17          HE21      GLN  17  -7.659   0.377  -7.063
  148   HE22  GLN  17          HE22      GLN  17  -6.875  -0.375  -8.367
  149    H1   ALA   1           HT1      ALA   1 -13.162  -1.558  -6.074
  150    H2   ALA   1           HT2      ALA   1 -13.712  -0.368  -4.993
  151    H3   ALA   1           HT3      ALA   1 -13.861  -2.014  -4.598
  152    HA   ALA   1           HA       ALA   1 -11.375  -0.410  -4.781
  153    HB1  ALA   1           HB1      ALA   1 -12.313  -0.148  -2.635
  154    HB2  ALA   1           HB2      ALA   1 -11.181  -1.484  -2.421
  155    HB3  ALA   1           HB3      ALA   1 -12.906  -1.808  -2.593
  156    H    THR   2           HN       THR   2 -12.816  -3.642  -4.563
  157    HA   THR   2           HA       THR   2 -11.903  -5.743  -4.818
  158    HB   THR   2           HB       THR   2 -10.271  -5.826  -6.813
  159    HG1  THR   2           HG1      THR   2 -10.160  -3.938  -7.991
  160   HG21  THR   2          HG21      THR   2 -12.095  -5.550  -8.381
  161   HG22  THR   2          HG22      THR   2 -12.969  -4.522  -7.246
  162   HG23  THR   2          HG23      THR   2 -12.746  -6.235  -6.892
  163    H    LEU   3           HN       LEU   3 -10.861  -5.979  -2.822
  164    HA   LEU   3           HA       LEU   3  -8.363  -4.931  -2.117
  165    HB2  LEU   3           HB2      LEU   3  -9.757  -7.480  -1.278
  166    HB3  LEU   3           HB1      LEU   3  -8.267  -6.899  -0.535
  167    HG   LEU   3           HG       LEU   3 -10.787  -5.231  -0.733
  168   HD11  LEU   3          HD11      LEU   3  -9.752  -6.980   1.516
  169   HD12  LEU   3          HD12      LEU   3 -11.290  -7.142   0.668
  170   HD13  LEU   3          HD13      LEU   3 -11.005  -5.756   1.721
  171   HD21  LEU   3          HD21      LEU   3  -8.889  -3.827  -0.430
  172   HD22  LEU   3          HD22      LEU   3  -8.129  -4.963   0.684
  173   HD23  LEU   3          HD23      LEU   3  -9.547  -4.046   1.190
  174    H    GLU   4           HN       GLU   4  -9.183  -8.038  -3.645
  175    HA   GLU   4           HA       GLU   4  -6.596  -9.094  -3.806
  176    HB2  GLU   4           HB2      GLU   4  -8.638 -10.394  -4.267
  177    HB3  GLU   4           HB1      GLU   4  -8.896  -9.459  -5.741
  178    HG2  GLU   4           HG2      GLU   4  -6.766 -10.257  -6.650
  179    HG3  GLU   4           HG1      GLU   4  -6.445 -11.146  -5.162
  180    H    LYS   5           HN       LYS   5  -8.391  -7.095  -6.140
  181    HA   LYS   5           HA       LYS   5  -6.457  -7.021  -8.161
  182    HB2  LYS   5           HB2      LYS   5  -8.750  -6.205  -8.478
  183    HB3  LYS   5           HB1      LYS   5  -8.439  -4.875  -7.363
  184    HG2  LYS   5           HG2      LYS   5  -8.191  -4.078  -9.657
  185    HG3  LYS   5           HG1      LYS   5  -6.614  -4.084  -8.869
  186    HD2  LYS   5           HD2      LYS   5  -5.973  -6.116  -9.974
  187    HD3  LYS   5           HD1      LYS   5  -7.615  -6.387 -10.560
  188    HE2  LYS   5           HE2      LYS   5  -6.294  -5.499 -12.390
  189    HE3  LYS   5           HE1      LYS   5  -7.430  -4.254 -11.873
  190    HZ1  LYS   5           HZ1      LYS   5  -5.431  -3.628 -10.313
  191    HZ2  LYS   5           HZ2      LYS   5  -5.518  -3.053 -11.909
  192    HZ3  LYS   5           HZ3      LYS   5  -4.527  -4.381 -11.534
  193    H    LEU   6           HN       LEU   6  -6.951  -4.830  -5.402
  194    HA   LEU   6           HA       LEU   6  -4.898  -3.015  -5.974
  195    HB2  LEU   6           HB2      LEU   6  -6.580  -2.588  -4.251
  196    HB3  LEU   6           HB1      LEU   6  -5.950  -3.919  -3.281
  197    HG   LEU   6           HG       LEU   6  -3.765  -2.758  -3.126
  198   HD11  LEU   6          HD11      LEU   6  -3.718  -1.483  -5.153
  199   HD12  LEU   6          HD12      LEU   6  -3.772  -0.309  -3.838
  200   HD13  LEU   6          HD13      LEU   6  -5.234  -0.673  -4.756
  201   HD21  LEU   6          HD21      LEU   6  -4.489  -0.995  -1.599
  202   HD22  LEU   6          HD22      LEU   6  -5.558  -2.387  -1.422
  203   HD23  LEU   6          HD23      LEU   6  -6.091  -0.976  -2.336
  204    H    MET   7           HN       MET   7  -4.835  -5.991  -4.023
  205    HA   MET   7           HA       MET   7  -2.165  -5.860  -3.194
  206    HB2  MET   7           HB2      MET   7  -3.798  -7.469  -2.288
  207    HB3  MET   7           HB1      MET   7  -3.801  -8.328  -3.828
  208    HG2  MET   7           HG2      MET   7  -2.283  -9.463  -2.297
  209    HG3  MET   7           HG1      MET   7  -1.339  -8.698  -3.574
  210    HE1  MET   7           HE1      MET   7  -0.006  -9.670  -0.985
  211    HE2  MET   7           HE2      MET   7   1.049  -8.311  -0.603
  212    HE3  MET   7           HE3      MET   7   0.833  -8.805  -2.281
  213    H    LYS   8           HN       LYS   8  -3.583  -7.383  -6.081
  214    HA   LYS   8           HA       LYS   8  -1.227  -8.454  -7.147
  215    HB2  LYS   8           HB2      LYS   8  -3.786  -7.511  -8.424
  216    HB3  LYS   8           HB1      LYS   8  -2.457  -8.154  -9.388
  217    HG2  LYS   8           HG2      LYS   8  -2.488 -10.218  -7.984
  218    HG3  LYS   8           HG1      LYS   8  -3.894  -9.579  -7.131
  219    HD2  LYS   8           HD2      LYS   8  -5.227  -9.608  -9.126
  220    HD3  LYS   8           HD1      LYS   8  -3.819  -9.935 -10.136
  221    HE2  LYS   8           HE2      LYS   8  -5.063 -12.006  -9.816
  222    HE3  LYS   8           HE1      LYS   8  -3.529 -12.117  -8.953
  223    HZ1  LYS   8           HZ1      LYS   8  -5.037 -12.839  -7.394
  224    HZ2  LYS   8           HZ2      LYS   8  -6.241 -11.743  -7.878
  225    HZ3  LYS   8           HZ3      LYS   8  -4.900 -11.197  -6.992
  226    H    ALA   9           HN       ALA   9  -2.732  -5.275  -7.684
  227    HA   ALA   9           HA       ALA   9  -0.894  -4.283  -9.549
  228    HB1  ALA   9           HB1      ALA   9  -1.886  -2.220  -9.206
  229    HB2  ALA   9           HB2      ALA   9  -2.074  -2.481  -7.472
  230    HB3  ALA   9           HB3      ALA   9  -3.145  -3.299  -8.609
  231    H    PHE  10           HN       PHE  10  -0.888  -4.057  -5.996
  232    HA   PHE  10           HA       PHE  10   1.432  -2.517  -5.703
  233    HB2  PHE  10           HB2      PHE  10  -0.071  -2.961  -3.834
  234    HB3  PHE  10           HB1      PHE  10   0.321  -4.679  -3.898
  235    HD1  PHE  10           HD1      PHE  10   1.801  -1.299  -3.351
  236    HD2  PHE  10           HD2      PHE  10   2.244  -5.538  -2.811
  237    HE1  PHE  10           HE1      PHE  10   3.763  -0.908  -1.887
  238    HE2  PHE  10           HE2      PHE  10   4.207  -5.146  -1.347
  239    HZ   PHE  10           HZ       PHE  10   4.966  -2.831  -0.885
  240    H    GLU  11           HN       GLU  11   1.042  -6.055  -5.813
  241    HA   GLU  11           HA       GLU  11   3.723  -6.758  -5.418
  242    HB2  GLU  11           HB2      GLU  11   1.518  -8.122  -6.973
  243    HB3  GLU  11           HB1      GLU  11   3.094  -8.857  -6.682
  244    HG2  GLU  11           HG2      GLU  11   1.176  -7.897  -4.537
  245    HG3  GLU  11           HG1      GLU  11   1.451  -9.579  -4.986
  246    H    SER  12           HN       SER  12   1.951  -6.137  -8.441
  247    HA   SER  12           HA       SER  12   4.035  -6.668 -10.235
  248    HB2  SER  12           HB2      SER  12   1.715  -6.330 -10.965
  249    HB3  SER  12           HB1      SER  12   1.796  -4.640 -10.476
  250    HG   SER  12           HG       SER  12   3.562  -5.845 -12.343
  251    H    LEU  13           HN       LEU  13   3.087  -3.622  -8.650
  252    HA   LEU  13           HA       LEU  13   5.003  -1.946  -9.818
  253    HB2  LEU  13           HB2      LEU  13   3.713  -1.882  -7.083
  254    HB3  LEU  13           HB1      LEU  13   4.698  -0.571  -7.732
  255    HG   LEU  13           HG       LEU  13   2.301  -1.685  -9.203
  256   HD11  LEU  13          HD11      LEU  13   2.494   0.526  -7.150
  257   HD12  LEU  13          HD12      LEU  13   1.374  -0.835  -7.183
  258   HD13  LEU  13          HD13      LEU  13   1.202   0.475  -8.349
  259   HD21  LEU  13          HD21      LEU  13   3.867  -0.442 -10.592
  260   HD22  LEU  13          HD22      LEU  13   3.932   0.867  -9.412
  261   HD23  LEU  13          HD23      LEU  13   2.447   0.565 -10.314
  262    H    LYS  14           HN       LYS  14   5.166  -3.857  -6.820
  263    HA   LYS  14           HA       LYS  14   7.723  -3.077  -5.995
  264    HB2  LYS  14           HB2      LYS  14   6.181  -4.354  -4.570
  265    HB3  LYS  14           HB1      LYS  14   6.356  -5.754  -5.628
  266    HG2  LYS  14           HG2      LYS  14   7.834  -6.035  -3.718
  267    HG3  LYS  14           HG1      LYS  14   8.817  -5.741  -5.151
  268    HD2  LYS  14           HD2      LYS  14   9.095  -3.401  -4.539
  269    HD3  LYS  14           HD1      LYS  14   7.994  -3.594  -3.174
  270    HE2  LYS  14           HE2      LYS  14   9.541  -5.227  -2.157
  271    HE3  LYS  14           HE1      LYS  14  10.644  -5.030  -3.519
  272    HZ1  LYS  14           HZ1      LYS  14   9.829  -2.940  -1.576
  273    HZ2  LYS  14           HZ2      LYS  14  10.764  -2.645  -2.963
  274    HZ3  LYS  14           HZ3      LYS  14  11.364  -3.644  -1.726
  275    H    SER  15           HN       SER  15   6.724  -5.797  -8.060
  276    HA   SER  15           HA       SER  15   9.261  -6.909  -8.479
  277    HB2  SER  15           HB2      SER  15   8.305  -7.958 -10.467
  278    HB3  SER  15           HB1      SER  15   7.152  -8.026  -9.138
  279    HG   SER  15           HG       SER  15   5.956  -6.485 -10.086
  280    H    PHE  16           HN       PHE  16   7.502  -4.430 -10.326
  281    HA   PHE  16           HA       PHE  16   9.398  -4.021 -12.345
  282    HB2  PHE  16           HB2      PHE  16   7.163  -3.065 -12.475
  283    HB3  PHE  16           HB1      PHE  16   7.486  -2.050 -11.070
  284    HD1  PHE  16           HD1      PHE  16   8.600  -2.756 -14.560
  285    HD2  PHE  16           HD2      PHE  16   8.589   0.035 -11.295
  286    HE1  PHE  16           HE1      PHE  16   9.591  -1.027 -16.035
  287    HE2  PHE  16           HE2      PHE  16   9.580   1.764 -12.770
  288    HZ   PHE  16           HZ       PHE  16  10.081   1.234 -15.140
  289    H    GLN  17           HN       GLN  17   9.044  -2.419  -9.188
  290    HA   GLN  17           HA       GLN  17  11.159  -0.601  -9.426
  291    HB2  GLN  17           HB2      GLN  17   9.494  -1.670  -7.287
  292    HB3  GLN  17           HB1      GLN  17  11.139  -1.335  -6.746
  293    HG2  GLN  17           HG2      GLN  17   9.977   0.712  -6.447
  294    HG3  GLN  17           HG1      GLN  17  10.896   0.927  -7.936
  295   HE21  GLN  17          HE21      GLN  17   7.665  -0.409  -6.997
  296   HE22  GLN  17          HE22      GLN  17   6.836   0.325  -8.283
  297    H1   ALA   1           HT1      ALA   1   1.558  13.162   6.074
  298    H2   ALA   1           HT2      ALA   1   0.368  13.712   4.993
  299    H3   ALA   1           HT3      ALA   1   2.014  13.861   4.598
  300    HA   ALA   1           HA       ALA   1   0.410  11.376   4.780
  301    HB1  ALA   1           HB1      ALA   1   0.149  12.314   2.635
  302    HB2  ALA   1           HB2      ALA   1   1.485  11.182   2.421
  303    HB3  ALA   1           HB3      ALA   1   1.810  12.907   2.594
  304    H    THR   2           HN       THR   2   3.642  12.816   4.563
  305    HA   THR   2           HA       THR   2   5.743  11.903   4.818
  306    HB   THR   2           HB       THR   2   5.826  10.270   6.813
  307    HG1  THR   2           HG1      THR   2   3.860  10.398   8.047
  308   HG21  THR   2          HG21      THR   2   5.550  12.093   8.382
  309   HG22  THR   2          HG22      THR   2   4.522  12.969   7.248
  310   HG23  THR   2          HG23      THR   2   6.235  12.745   6.894
  311    H    LEU   3           HN       LEU   3   5.979  10.861   2.822
  312    HA   LEU   3           HA       LEU   3   4.931   8.363   2.117
  313    HB2  LEU   3           HB2      LEU   3   7.480   9.757   1.278
  314    HB3  LEU   3           HB1      LEU   3   6.899   8.267   0.535
  315    HG   LEU   3           HG       LEU   3   5.231  10.787   0.733
  316   HD11  LEU   3          HD11      LEU   3   6.980   9.752  -1.516
  317   HD12  LEU   3          HD12      LEU   3   7.142  11.290  -0.668
  318   HD13  LEU   3          HD13      LEU   3   5.756  11.005  -1.721
  319   HD21  LEU   3          HD21      LEU   3   3.827   8.889   0.430
  320   HD22  LEU   3          HD22      LEU   3   4.963   8.129  -0.684
  321   HD23  LEU   3          HD23      LEU   3   4.046   9.547  -1.190
  322    H    GLU   4           HN       GLU   4   8.038   9.183   3.645
  323    HA   GLU   4           HA       GLU   4   9.094   6.596   3.806
  324    HB2  GLU   4           HB2      GLU   4  10.394   8.638   4.267
  325    HB3  GLU   4           HB1      GLU   4   9.459   8.896   5.741
  326    HG2  GLU   4           HG2      GLU   4  10.257   6.766   6.650
  327    HG3  GLU   4           HG1      GLU   4  11.146   6.445   5.162
  328    H    LYS   5           HN       LYS   5   7.095   8.391   6.140
  329    HA   LYS   5           HA       LYS   5   7.021   6.457   8.161
  330    HB2  LYS   5           HB2      LYS   5   6.205   8.750   8.478
  331    HB3  LYS   5           HB1      LYS   5   4.875   8.439   7.363
  332    HG2  LYS   5           HG2      LYS   5   4.078   8.191   9.657
  333    HG3  LYS   5           HG1      LYS   5   4.084   6.614   8.869
  334    HD2  LYS   5           HD2      LYS   5   6.116   5.973   9.974
  335    HD3  LYS   5           HD1      LYS   5   6.387   7.615  10.560
  336    HE2  LYS   5           HE2      LYS   5   5.499   6.293  12.390
  337    HE3  LYS   5           HE1      LYS   5   4.254   7.430  11.873
  338    HZ1  LYS   5           HZ1      LYS   5   3.628   5.431  10.313
  339    HZ2  LYS   5           HZ2      LYS   5   3.053   5.518  11.909
  340    HZ3  LYS   5           HZ3      LYS   5   4.381   4.527  11.534
  341    H    LEU   6           HN       LEU   6   4.830   6.951   5.402
  342    HA   LEU   6           HA       LEU   6   3.015   4.898   5.974
  343    HB2  LEU   6           HB2      LEU   6   2.588   6.580   4.251
  344    HB3  LEU   6           HB1      LEU   6   3.919   5.950   3.281
  345    HG   LEU   6           HG       LEU   6   2.758   3.765   3.126
  346   HD11  LEU   6          HD11      LEU   6   1.483   3.718   5.153
  347   HD12  LEU   6          HD12      LEU   6   0.309   3.772   3.838
  348   HD13  LEU   6          HD13      LEU   6   0.673   5.234   4.756
  349   HD21  LEU   6          HD21      LEU   6   0.995   4.489   1.599
  350   HD22  LEU   6          HD22      LEU   6   2.387   5.558   1.422
  351   HD23  LEU   6          HD23      LEU   6   0.976   6.091   2.336
  352    H    MET   7           HN       MET   7   5.991   4.835   4.023
  353    HA   MET   7           HA       MET   7   5.860   2.165   3.194
  354    HB2  MET   7           HB2      MET   7   7.469   3.798   2.288
  355    HB3  MET   7           HB1      MET   7   8.328   3.801   3.828
  356    HG2  MET   7           HG2      MET   7   9.463   2.283   2.297
  357    HG3  MET   7           HG1      MET   7   8.698   1.339   3.574
  358    HE1  MET   7           HE1      MET   7   9.670   0.006   0.985
  359    HE2  MET   7           HE2      MET   7   8.311  -1.049   0.603
  360    HE3  MET   7           HE3      MET   7   8.805  -0.833   2.281
  361    H    LYS   8           HN       LYS   8   7.383   3.583   6.081
  362    HA   LYS   8           HA       LYS   8   8.454   1.227   7.147
  363    HB2  LYS   8           HB2      LYS   8   7.511   3.786   8.424
  364    HB3  LYS   8           HB1      LYS   8   8.154   2.457   9.388
  365    HG2  LYS   8           HG2      LYS   8  10.218   2.488   7.984
  366    HG3  LYS   8           HG1      LYS   8   9.579   3.894   7.131
  367    HD2  LYS   8           HD2      LYS   8   9.608   5.227   9.126
  368    HD3  LYS   8           HD1      LYS   8   9.935   3.819  10.136
  369    HE2  LYS   8           HE2      LYS   8  12.006   5.063   9.816
  370    HE3  LYS   8           HE1      LYS   8  12.117   3.529   8.953
  371    HZ1  LYS   8           HZ1      LYS   8  12.839   5.037   7.394
  372    HZ2  LYS   8           HZ2      LYS   8  11.743   6.241   7.878
  373    HZ3  LYS   8           HZ3      LYS   8  11.197   4.900   6.992
  374    H    ALA   9           HN       ALA   9   5.275   2.732   7.684
  375    HA   ALA   9           HA       ALA   9   4.283   0.894   9.549
  376    HB1  ALA   9           HB1      ALA   9   2.220   1.886   9.206
  377    HB2  ALA   9           HB2      ALA   9   2.481   2.073   7.473
  378    HB3  ALA   9           HB3      ALA   9   3.299   3.146   8.608
  379    H    PHE  10           HN       PHE  10   4.057   0.888   5.996
  380    HA   PHE  10           HA       PHE  10   2.517  -1.432   5.703
  381    HB2  PHE  10           HB2      PHE  10   2.961   0.071   3.834
  382    HB3  PHE  10           HB1      PHE  10   4.679  -0.321   3.898
  383    HD1  PHE  10           HD1      PHE  10   1.299  -1.801   3.351
  384    HD2  PHE  10           HD2      PHE  10   5.538  -2.244   2.811
  385    HE1  PHE  10           HE1      PHE  10   0.908  -3.763   1.887
  386    HE2  PHE  10           HE2      PHE  10   5.146  -4.207   1.347
  387    HZ   PHE  10           HZ       PHE  10   2.831  -4.966   0.885
  388    H    GLU  11           HN       GLU  11   6.055  -1.042   5.813
  389    HA   GLU  11           HA       GLU  11   6.758  -3.723   5.418
  390    HB2  GLU  11           HB2      GLU  11   8.122  -1.518   6.973
  391    HB3  GLU  11           HB1      GLU  11   8.857  -3.094   6.682
  392    HG2  GLU  11           HG2      GLU  11   7.897  -1.176   4.537
  393    HG3  GLU  11           HG1      GLU  11   9.579  -1.451   4.986
  394    H    SER  12           HN       SER  12   6.137  -1.951   8.441
  395    HA   SER  12           HA       SER  12   6.668  -4.035  10.236
  396    HB2  SER  12           HB2      SER  12   6.328  -1.713  10.962
  397    HB3  SER  12           HB1      SER  12   4.637  -1.797  10.473
  398    HG   SER  12           HG       SER  12   5.807  -2.631  12.750
  399    H    LEU  13           HN       LEU  13   3.622  -3.087   8.650
  400    HA   LEU  13           HA       LEU  13   1.946  -5.003   9.818
  401    HB2  LEU  13           HB2      LEU  13   1.882  -3.713   7.083
  402    HB3  LEU  13           HB1      LEU  13   0.571  -4.698   7.732
  403    HG   LEU  13           HG       LEU  13   1.685  -2.301   9.203
  404   HD11  LEU  13          HD11      LEU  13  -0.526  -2.494   7.150
  405   HD12  LEU  13          HD12      LEU  13   0.835  -1.374   7.183
  406   HD13  LEU  13          HD13      LEU  13  -0.475  -1.201   8.349
  407   HD21  LEU  13          HD21      LEU  13   0.442  -3.867  10.592
  408   HD22  LEU  13          HD22      LEU  13  -0.867  -3.932   9.412
  409   HD23  LEU  13          HD23      LEU  13  -0.565  -2.447  10.314
  410    H    LYS  14           HN       LYS  14   3.857  -5.166   6.820
  411    HA   LYS  14           HA       LYS  14   3.077  -7.723   5.995
  412    HB2  LYS  14           HB2      LYS  14   4.354  -6.181   4.570
  413    HB3  LYS  14           HB1      LYS  14   5.754  -6.356   5.628
  414    HG2  LYS  14           HG2      LYS  14   6.035  -7.834   3.718
  415    HG3  LYS  14           HG1      LYS  14   5.741  -8.817   5.151
  416    HD2  LYS  14           HD2      LYS  14   3.401  -9.095   4.539
  417    HD3  LYS  14           HD1      LYS  14   3.594  -7.994   3.174
  418    HE2  LYS  14           HE2      LYS  14   5.227  -9.541   2.157
  419    HE3  LYS  14           HE1      LYS  14   5.030 -10.644   3.519
  420    HZ1  LYS  14           HZ1      LYS  14   2.940  -9.829   1.576
  421    HZ2  LYS  14           HZ2      LYS  14   2.645 -10.764   2.963
  422    HZ3  LYS  14           HZ3      LYS  14   3.644 -11.364   1.726
  423    H    SER  15           HN       SER  15   5.797  -6.724   8.060
  424    HA   SER  15           HA       SER  15   6.921  -9.256   8.484
  425    HB2  SER  15           HB2      SER  15   6.821  -6.839  10.303
  426    HB3  SER  15           HB1      SER  15   7.827  -8.255  10.593
  427    HG   SER  15           HG       SER  15   9.193  -7.273   9.337
  428    H    PHE  16           HN       PHE  16   4.430  -7.502  10.326
  429    HA   PHE  16           HA       PHE  16   4.021  -9.398  12.345
  430    HB2  PHE  16           HB2      PHE  16   3.055  -7.186  12.514
  431    HB3  PHE  16           HB1      PHE  16   2.078  -7.459  11.071
  432    HD1  PHE  16           HD1      PHE  16   2.677  -8.696  14.541
  433    HD2  PHE  16           HD2      PHE  16  -0.028  -8.531  11.208
  434    HE1  PHE  16           HE1      PHE  16   0.897  -9.716  15.935
  435    HE2  PHE  16           HE2      PHE  16  -1.808  -9.551  12.602
  436    HZ   PHE  16           HZ       PHE  16  -1.345 -10.143  14.966
  437    H    GLN  17           HN       GLN  17   2.419  -9.044   9.188
  438    HA   GLN  17           HA       GLN  17   0.601 -11.159   9.425
  439    HB2  GLN  17           HB2      GLN  17   1.456  -9.372   7.398
  440    HB3  GLN  17           HB1      GLN  17   1.567 -11.002   6.731
  441    HG2  GLN  17           HG2      GLN  17  -0.677 -10.066   6.363
  442    HG3  GLN  17           HG1      GLN  17  -0.752 -11.453   7.447
  443   HE21  GLN  17          HE21      GLN  17  -0.406  -7.861   7.636
  444   HE22  GLN  17          HE22      GLN  17  -1.351  -7.705   9.038
  445    H1   ALA   1           HT1      ALA   1  -1.558 -13.162   6.074
  446    H2   ALA   1           HT2      ALA   1  -0.368 -13.712   4.993
  447    H3   ALA   1           HT3      ALA   1  -2.014 -13.861   4.598
  448    HA   ALA   1           HA       ALA   1  -0.410 -11.376   4.780
  449    HB1  ALA   1           HB1      ALA   1  -0.149 -12.313   2.635
  450    HB2  ALA   1           HB2      ALA   1  -1.485 -11.182   2.421
  451    HB3  ALA   1           HB3      ALA   1  -1.810 -12.907   2.594
  452    H    THR   2           HN       THR   2  -3.642 -12.816   4.563
  453    HA   THR   2           HA       THR   2  -5.743 -11.903   4.818
  454    HB   THR   2           HB       THR   2  -5.826 -10.271   6.813
  455    HG1  THR   2           HG1      THR   2  -3.936 -10.170   7.995
  456   HG21  THR   2          HG21      THR   2  -5.550 -12.094   8.381
  457   HG22  THR   2          HG22      THR   2  -4.522 -12.969   7.246
  458   HG23  THR   2          HG23      THR   2  -6.235 -12.746   6.893
  459    H    LEU   3           HN       LEU   3  -5.979 -10.861   2.822
  460    HA   LEU   3           HA       LEU   3  -4.931  -8.363   2.117
  461    HB2  LEU   3           HB2      LEU   3  -7.480  -9.757   1.278
  462    HB3  LEU   3           HB1      LEU   3  -6.899  -8.267   0.535
  463    HG   LEU   3           HG       LEU   3  -5.231 -10.787   0.733
  464   HD11  LEU   3          HD11      LEU   3  -6.980  -9.752  -1.516
  465   HD12  LEU   3          HD12      LEU   3  -7.142 -11.290  -0.668
  466   HD13  LEU   3          HD13      LEU   3  -5.756 -11.005  -1.721
  467   HD21  LEU   3          HD21      LEU   3  -3.827  -8.889   0.430
  468   HD22  LEU   3          HD22      LEU   3  -4.963  -8.129  -0.684
  469   HD23  LEU   3          HD23      LEU   3  -4.046  -9.547  -1.190
  470    H    GLU   4           HN       GLU   4  -8.038  -9.183   3.645
  471    HA   GLU   4           HA       GLU   4  -9.094  -6.596   3.806
  472    HB2  GLU   4           HB2      GLU   4 -10.394  -8.638   4.267
  473    HB3  GLU   4           HB1      GLU   4  -9.459  -8.896   5.741
  474    HG2  GLU   4           HG2      GLU   4 -10.257  -6.766   6.650
  475    HG3  GLU   4           HG1      GLU   4 -11.146  -6.445   5.162
  476    H    LYS   5           HN       LYS   5  -7.095  -8.391   6.140
  477    HA   LYS   5           HA       LYS   5  -7.021  -6.457   8.161
  478    HB2  LYS   5           HB2      LYS   5  -6.205  -8.750   8.478
  479    HB3  LYS   5           HB1      LYS   5  -4.875  -8.439   7.363
  480    HG2  LYS   5           HG2      LYS   5  -4.078  -8.191   9.657
  481    HG3  LYS   5           HG1      LYS   5  -4.084  -6.614   8.869
  482    HD2  LYS   5           HD2      LYS   5  -6.116  -5.973   9.974
  483    HD3  LYS   5           HD1      LYS   5  -6.387  -7.615  10.560
  484    HE2  LYS   5           HE2      LYS   5  -5.499  -6.293  12.390
  485    HE3  LYS   5           HE1      LYS   5  -4.254  -7.430  11.873
  486    HZ1  LYS   5           HZ1      LYS   5  -3.628  -5.431  10.313
  487    HZ2  LYS   5           HZ2      LYS   5  -3.053  -5.518  11.909
  488    HZ3  LYS   5           HZ3      LYS   5  -4.381  -4.527  11.534
  489    H    LEU   6           HN       LEU   6  -4.830  -6.951   5.402
  490    HA   LEU   6           HA       LEU   6  -3.015  -4.898   5.974
  491    HB2  LEU   6           HB2      LEU   6  -2.588  -6.580   4.251
  492    HB3  LEU   6           HB1      LEU   6  -3.919  -5.950   3.281
  493    HG   LEU   6           HG       LEU   6  -2.758  -3.765   3.126
  494   HD11  LEU   6          HD11      LEU   6  -1.483  -3.718   5.153
  495   HD12  LEU   6          HD12      LEU   6  -0.309  -3.772   3.838
  496   HD13  LEU   6          HD13      LEU   6  -0.673  -5.234   4.756
  497   HD21  LEU   6          HD21      LEU   6  -0.995  -4.489   1.599
  498   HD22  LEU   6          HD22      LEU   6  -2.387  -5.558   1.422
  499   HD23  LEU   6          HD23      LEU   6  -0.976  -6.091   2.336
  500    H    MET   7           HN       MET   7  -5.991  -4.835   4.023
  501    HA   MET   7           HA       MET   7  -5.860  -2.165   3.194
  502    HB2  MET   7           HB2      MET   7  -7.469  -3.798   2.288
  503    HB3  MET   7           HB1      MET   7  -8.328  -3.801   3.828
  504    HG2  MET   7           HG2      MET   7  -9.463  -2.283   2.297
  505    HG3  MET   7           HG1      MET   7  -8.698  -1.339   3.574
  506    HE1  MET   7           HE1      MET   7  -9.670  -0.006   0.985
  507    HE2  MET   7           HE2      MET   7  -8.311   1.049   0.603
  508    HE3  MET   7           HE3      MET   7  -8.805   0.833   2.281
  509    H    LYS   8           HN       LYS   8  -7.383  -3.583   6.081
  510    HA   LYS   8           HA       LYS   8  -8.454  -1.227   7.147
  511    HB2  LYS   8           HB2      LYS   8  -7.511  -3.786   8.424
  512    HB3  LYS   8           HB1      LYS   8  -8.154  -2.457   9.388
  513    HG2  LYS   8           HG2      LYS   8 -10.218  -2.488   7.984
  514    HG3  LYS   8           HG1      LYS   8  -9.579  -3.894   7.131
  515    HD2  LYS   8           HD2      LYS   8  -9.608  -5.227   9.126
  516    HD3  LYS   8           HD1      LYS   8  -9.935  -3.819  10.136
  517    HE2  LYS   8           HE2      LYS   8 -12.006  -5.063   9.816
  518    HE3  LYS   8           HE1      LYS   8 -12.117  -3.529   8.953
  519    HZ1  LYS   8           HZ1      LYS   8 -12.839  -5.037   7.394
  520    HZ2  LYS   8           HZ2      LYS   8 -11.743  -6.241   7.878
  521    HZ3  LYS   8           HZ3      LYS   8 -11.197  -4.900   6.992
  522    H    ALA   9           HN       ALA   9  -5.275  -2.732   7.684
  523    HA   ALA   9           HA       ALA   9  -4.283  -0.894   9.549
  524    HB1  ALA   9           HB1      ALA   9  -2.220  -1.886   9.206
  525    HB2  ALA   9           HB2      ALA   9  -2.481  -2.074   7.472
  526    HB3  ALA   9           HB3      ALA   9  -3.299  -3.145   8.609
  527    H    PHE  10           HN       PHE  10  -4.057  -0.888   5.996
  528    HA   PHE  10           HA       PHE  10  -2.517   1.432   5.703
  529    HB2  PHE  10           HB2      PHE  10  -2.961  -0.071   3.834
  530    HB3  PHE  10           HB1      PHE  10  -4.679   0.321   3.898
  531    HD1  PHE  10           HD1      PHE  10  -1.299   1.801   3.351
  532    HD2  PHE  10           HD2      PHE  10  -5.538   2.244   2.811
  533    HE1  PHE  10           HE1      PHE  10  -0.908   3.763   1.887
  534    HE2  PHE  10           HE2      PHE  10  -5.146   4.207   1.347
  535    HZ   PHE  10           HZ       PHE  10  -2.831   4.966   0.885
  536    H    GLU  11           HN       GLU  11  -6.055   1.042   5.813
  537    HA   GLU  11           HA       GLU  11  -6.758   3.723   5.418
  538    HB2  GLU  11           HB2      GLU  11  -8.122   1.518   6.973
  539    HB3  GLU  11           HB1      GLU  11  -8.857   3.094   6.682
  540    HG2  GLU  11           HG2      GLU  11  -7.897   1.176   4.537
  541    HG3  GLU  11           HG1      GLU  11  -9.579   1.451   4.986
  542    H    SER  12           HN       SER  12  -6.137   1.951   8.441
  543    HA   SER  12           HA       SER  12  -6.668   4.035  10.236
  544    HB2  SER  12           HB2      SER  12  -6.327   1.713  10.962
  545    HB3  SER  12           HB1      SER  12  -4.637   1.797  10.473
  546    HG   SER  12           HG       SER  12  -5.036   2.214  12.740
  547    H    LEU  13           HN       LEU  13  -3.622   3.087   8.650
  548    HA   LEU  13           HA       LEU  13  -1.946   5.003   9.818
  549    HB2  LEU  13           HB2      LEU  13  -1.882   3.713   7.083
  550    HB3  LEU  13           HB1      LEU  13  -0.571   4.698   7.732
  551    HG   LEU  13           HG       LEU  13  -1.685   2.301   9.203
  552   HD11  LEU  13          HD11      LEU  13   0.525   2.494   7.150
  553   HD12  LEU  13          HD12      LEU  13  -0.835   1.373   7.183
  554   HD13  LEU  13          HD13      LEU  13   0.475   1.202   8.349
  555   HD21  LEU  13          HD21      LEU  13  -0.442   3.867  10.592
  556   HD22  LEU  13          HD22      LEU  13   0.867   3.932   9.412
  557   HD23  LEU  13          HD23      LEU  13   0.565   2.447  10.314
  558    H    LYS  14           HN       LYS  14  -3.857   5.166   6.820
  559    HA   LYS  14           HA       LYS  14  -3.077   7.723   5.995
  560    HB2  LYS  14           HB2      LYS  14  -4.354   6.181   4.570
  561    HB3  LYS  14           HB1      LYS  14  -5.754   6.356   5.628
  562    HG2  LYS  14           HG2      LYS  14  -6.035   7.834   3.718
  563    HG3  LYS  14           HG1      LYS  14  -5.741   8.817   5.151
  564    HD2  LYS  14           HD2      LYS  14  -3.401   9.095   4.539
  565    HD3  LYS  14           HD1      LYS  14  -3.594   7.994   3.174
  566    HE2  LYS  14           HE2      LYS  14  -5.227   9.541   2.157
  567    HE3  LYS  14           HE1      LYS  14  -5.030  10.644   3.519
  568    HZ1  LYS  14           HZ1      LYS  14  -2.940   9.829   1.576
  569    HZ2  LYS  14           HZ2      LYS  14  -2.645  10.764   2.963
  570    HZ3  LYS  14           HZ3      LYS  14  -3.644  11.364   1.726
  571    H    SER  15           HN       SER  15  -5.797   6.724   8.060
  572    HA   SER  15           HA       SER  15  -6.921   9.256   8.484
  573    HB2  SER  15           HB2      SER  15  -6.821   6.838  10.303
  574    HB3  SER  15           HB1      SER  15  -7.827   8.255  10.593
  575    HG   SER  15           HG       SER  15  -9.118   7.663   9.019
  576    H    PHE  16           HN       PHE  16  -4.430   7.502  10.326
  577    HA   PHE  16           HA       PHE  16  -4.021   9.398  12.345
  578    HB2  PHE  16           HB2      PHE  16  -3.055   7.187  12.516
  579    HB3  PHE  16           HB1      PHE  16  -2.081   7.457  11.070
  580    HD1  PHE  16           HD1      PHE  16  -2.671   8.701  14.540
  581    HD2  PHE  16           HD2      PHE  16   0.027   8.523  11.202
  582    HE1  PHE  16           HE1      PHE  16  -0.885   9.719  15.928
  583    HE2  PHE  16           HE2      PHE  16   1.812   9.541  12.590
  584    HZ   PHE  16           HZ       PHE  16   1.356  10.139  14.953
  585    H    GLN  17           HN       GLN  17  -2.419   9.044   9.188
  586    HA   GLN  17           HA       GLN  17  -0.601  11.159   9.425
  587    HB2  GLN  17           HB2      GLN  17  -1.456   9.372   7.398
  588    HB3  GLN  17           HB1      GLN  17  -1.568  11.002   6.731
  589    HG2  GLN  17           HG2      GLN  17   0.677  10.066   6.363
  590    HG3  GLN  17           HG1      GLN  17   0.751  11.454   7.447
  591   HE21  GLN  17          HE21      GLN  17   0.412   7.860   7.633
  592   HE22  GLN  17          HE22      GLN  17   1.355   7.705   9.035
  Start of MODEL    5
    1    H1   ALA   1           HT1      ALA   1  13.152  -1.403  -3.383
    2    H2   ALA   1           HT2      ALA   1  13.335  -0.016  -2.419
    3    H3   ALA   1           HT3      ALA   1  14.088  -0.103  -3.939
    4    HA   ALA   1           HA       ALA   1  12.115   0.150  -5.100
    5    HB1  ALA   1           HB1      ALA   1  10.842  -1.546  -3.874
    6    HB2  ALA   1           HB2      ALA   1   9.908  -0.053  -3.968
    7    HB3  ALA   1           HB3      ALA   1  10.737  -0.482  -2.472
    8    H    THR   2           HN       THR   2  11.862   2.243  -5.564
    9    HA   THR   2           HA       THR   2  12.567   4.304  -3.739
   10    HB   THR   2           HB       THR   2  11.066   4.509  -6.361
   11    HG1  THR   2           HG1      THR   2  12.972   3.668  -6.884
   12   HG21  THR   2          HG21      THR   2  11.836   6.816  -6.371
   13   HG22  THR   2          HG22      THR   2  12.713   6.563  -4.862
   14   HG23  THR   2          HG23      THR   2  10.950   6.518  -4.875
   15    H    LEU   3           HN       LEU   3  11.383   5.212  -2.191
   16    HA   LEU   3           HA       LEU   3   8.757   4.467  -1.571
   17    HB2  LEU   3           HB2      LEU   3  10.506   6.768  -0.750
   18    HB3  LEU   3           HB1      LEU   3   8.829   6.682  -0.209
   19    HG   LEU   3           HG       LEU   3   9.340   4.304   0.564
   20   HD11  LEU   3          HD11      LEU   3  11.350   3.803  -0.614
   21   HD12  LEU   3          HD12      LEU   3  11.837   4.000   1.069
   22   HD13  LEU   3          HD13      LEU   3  12.120   5.300  -0.088
   23   HD21  LEU   3          HD21      LEU   3  10.691   6.721   1.789
   24   HD22  LEU   3          HD22      LEU   3  10.617   5.159   2.604
   25   HD23  LEU   3          HD23      LEU   3   9.129   6.024   2.218
   26    H    GLU   4           HN       GLU   4   9.973   7.376  -3.222
   27    HA   GLU   4           HA       GLU   4   7.520   8.676  -3.585
   28    HB2  GLU   4           HB2      GLU   4  10.049   8.689  -5.239
   29    HB3  GLU   4           HB1      GLU   4   8.676   9.748  -5.568
   30    HG2  GLU   4           HG2      GLU   4   8.847  10.753  -3.371
   31    HG3  GLU   4           HG1      GLU   4  10.088   9.597  -2.891
   32    H    LYS   5           HN       LYS   5   9.210   6.364  -5.699
   33    HA   LYS   5           HA       LYS   5   7.380   6.362  -7.818
   34    HB2  LYS   5           HB2      LYS   5   9.654   5.286  -7.801
   35    HB3  LYS   5           HB1      LYS   5   8.962   3.976  -6.844
   36    HG2  LYS   5           HG2      LYS   5   7.485   4.721  -9.313
   37    HG3  LYS   5           HG1      LYS   5   9.042   3.925  -9.543
   38    HD2  LYS   5           HD2      LYS   5   8.123   2.276  -7.695
   39    HD3  LYS   5           HD1      LYS   5   6.556   2.880  -8.234
   40    HE2  LYS   5           HE2      LYS   5   8.659   1.804 -10.127
   41    HE3  LYS   5           HE1      LYS   5   7.365   0.813  -9.455
   42    HZ1  LYS   5           HZ1      LYS   5   7.192   3.061 -11.343
   43    HZ2  LYS   5           HZ2      LYS   5   5.870   2.713 -10.335
   44    HZ3  LYS   5           HZ3      LYS   5   6.450   1.537 -11.417
   45    H    LEU   6           HN       LEU   6   7.505   4.308  -4.913
   46    HA   LEU   6           HA       LEU   6   5.304   2.679  -5.493
   47    HB2  LEU   6           HB2      LEU   6   6.841   2.187  -3.660
   48    HB3  LEU   6           HB1      LEU   6   6.313   3.635  -2.804
   49    HG   LEU   6           HG       LEU   6   4.128   1.829  -3.635
   50   HD11  LEU   6          HD11      LEU   6   4.553   0.127  -2.000
   51   HD12  LEU   6          HD12      LEU   6   5.935   1.006  -1.349
   52   HD13  LEU   6          HD13      LEU   6   6.030   0.277  -2.951
   53   HD21  LEU   6          HD21      LEU   6   3.521   2.294  -1.194
   54   HD22  LEU   6          HD22      LEU   6   3.614   3.710  -2.241
   55   HD23  LEU   6          HD23      LEU   6   4.939   3.340  -1.139
   56    H    MET   7           HN       MET   7   5.457   5.761  -3.722
   57    HA   MET   7           HA       MET   7   2.751   5.956  -3.035
   58    HB2  MET   7           HB2      MET   7   4.500   7.443  -2.134
   59    HB3  MET   7           HB1      MET   7   4.667   8.198  -3.720
   60    HG2  MET   7           HG2      MET   7   3.208   9.576  -2.338
   61    HG3  MET   7           HG1      MET   7   2.250   8.837  -3.621
   62    HE1  MET   7           HE1      MET   7   0.023   9.234  -2.448
   63    HE2  MET   7           HE2      MET   7   0.914  10.110  -1.205
   64    HE3  MET   7           HE3      MET   7  -0.285   8.907  -0.736
   65    H    LYS   8           HN       LYS   8   4.461   7.143  -5.922
   66    HA   LYS   8           HA       LYS   8   2.290   8.383  -7.180
   67    HB2  LYS   8           HB2      LYS   8   4.738   7.024  -8.319
   68    HB3  LYS   8           HB1      LYS   8   3.587   7.930  -9.302
   69    HG2  LYS   8           HG2      LYS   8   3.971   9.935  -7.921
   70    HG3  LYS   8           HG1      LYS   8   5.118   9.034  -6.929
   71    HD2  LYS   8           HD2      LYS   8   6.527   8.641  -8.925
   72    HD3  LYS   8           HD1      LYS   8   5.391   9.573  -9.901
   73    HE2  LYS   8           HE2      LYS   8   6.891  10.645  -7.493
   74    HE3  LYS   8           HE1      LYS   8   7.334  10.944  -9.174
   75    HZ1  LYS   8           HZ1      LYS   8   4.797  11.728  -7.846
   76    HZ2  LYS   8           HZ2      LYS   8   5.116  11.920  -9.503
   77    HZ3  LYS   8           HZ3      LYS   8   6.036  12.768  -8.354
   78    H    ALA   9           HN       ALA   9   3.473   5.037  -7.447
   79    HA   ALA   9           HA       ALA   9   1.634   4.123  -9.351
   80    HB1  ALA   9           HB1      ALA   9   3.548   2.778  -8.741
   81    HB2  ALA   9           HB2      ALA   9   2.085   1.864  -8.374
   82    HB3  ALA   9           HB3      ALA   9   2.981   2.652  -7.076
   83    H    PHE  10           HN       PHE  10   1.431   4.120  -5.797
   84    HA   PHE  10           HA       PHE  10  -1.050   2.846  -5.547
   85    HB2  PHE  10           HB2      PHE  10   0.390   3.245  -3.622
   86    HB3  PHE  10           HB1      PHE  10   0.191   4.988  -3.803
   87    HD1  PHE  10           HD1      PHE  10  -1.673   1.821  -3.160
   88    HD2  PHE  10           HD2      PHE  10  -1.685   6.108  -2.884
   89    HE1  PHE  10           HE1      PHE  10  -3.745   1.728  -1.801
   90    HE2  PHE  10           HE2      PHE  10  -3.757   6.014  -1.525
   91    HZ   PHE  10           HZ       PHE  10  -4.787   3.824  -0.983
   92    H    GLU  11           HN       GLU  11  -0.285   6.311  -5.834
   93    HA   GLU  11           HA       GLU  11  -2.896   7.305  -5.630
   94    HB2  GLU  11           HB2      GLU  11  -0.484   8.340  -7.132
   95    HB3  GLU  11           HB1      GLU  11  -1.988   9.248  -6.973
   96    HG2  GLU  11           HG2      GLU  11  -0.293   8.232  -4.671
   97    HG3  GLU  11           HG1      GLU  11  -0.365   9.903  -5.229
   98    H    SER  12           HN       SER  12  -1.049   6.321  -8.510
   99    HA   SER  12           HA       SER  12  -2.977   6.947 -10.444
  100    HB2  SER  12           HB2      SER  12  -0.657   6.323 -10.996
  101    HB3  SER  12           HB1      SER  12  -0.968   4.678 -10.450
  102    HG   SER  12           HG       SER  12  -1.792   6.004 -12.750
  103    H    LEU  13           HN       LEU  13  -2.433   3.926  -8.638
  104    HA   LEU  13           HA       LEU  13  -4.456   2.390  -9.816
  105    HB2  LEU  13           HB2      LEU  13  -2.740   1.446  -8.335
  106    HB3  LEU  13           HB1      LEU  13  -3.433   2.316  -6.967
  107    HG   LEU  13           HG       LEU  13  -5.572   1.095  -7.303
  108   HD11  LEU  13          HD11      LEU  13  -5.562   0.571  -9.620
  109   HD12  LEU  13          HD12      LEU  13  -5.365  -0.984  -8.811
  110   HD13  LEU  13          HD13      LEU  13  -3.969  -0.179  -9.526
  111   HD21  LEU  13          HD21      LEU  13  -4.166   0.111  -5.672
  112   HD22  LEU  13          HD22      LEU  13  -3.007  -0.445  -6.880
  113   HD23  LEU  13          HD23      LEU  13  -4.579  -1.231  -6.738
  114    H    LYS  14           HN       LYS  14  -4.562   4.485  -6.941
  115    HA   LYS  14           HA       LYS  14  -7.225   4.023  -6.216
  116    HB2  LYS  14           HB2      LYS  14  -5.635   5.224  -4.780
  117    HB3  LYS  14           HB1      LYS  14  -5.605   6.565  -5.924
  118    HG2  LYS  14           HG2      LYS  14  -7.142   7.116  -4.122
  119    HG3  LYS  14           HG1      LYS  14  -8.076   6.835  -5.591
  120    HD2  LYS  14           HD2      LYS  14  -8.635   4.581  -4.863
  121    HD3  LYS  14           HD1      LYS  14  -7.589   4.743  -3.451
  122    HE2  LYS  14           HE2      LYS  14  -8.998   6.588  -2.616
  123    HE3  LYS  14           HE1      LYS  14 -10.047   6.427  -4.025
  124    HZ1  LYS  14           HZ1      LYS  14 -10.924   5.255  -2.091
  125    HZ2  LYS  14           HZ2      LYS  14  -9.523   4.296  -2.024
  126    HZ3  LYS  14           HZ3      LYS  14 -10.572   4.182  -3.356
  127    H    SER  15           HN       SER  15  -5.846   6.493  -8.373
  128    HA   SER  15           HA       SER  15  -8.222   7.838  -9.000
  129    HB2  SER  15           HB2      SER  15  -6.007   8.701  -9.620
  130    HB3  SER  15           HB1      SER  15  -5.792   7.365 -10.748
  131    HG   SER  15           HG       SER  15  -6.776   9.609 -11.370
  132    H    PHE  16           HN       PHE  16  -6.651   5.073 -10.599
  133    HA   PHE  16           HA       PHE  16  -8.487   4.735 -12.687
  134    HB2  PHE  16           HB2      PHE  16  -6.845   2.662 -11.212
  135    HB3  PHE  16           HB1      PHE  16  -7.675   2.384 -12.741
  136    HD1  PHE  16           HD1      PHE  16  -4.681   2.109 -12.319
  137    HD2  PHE  16           HD2      PHE  16  -7.085   5.438 -13.588
  138    HE1  PHE  16           HE1      PHE  16  -2.740   3.051 -13.538
  139    HE2  PHE  16           HE2      PHE  16  -5.143   6.376 -14.804
  140    HZ   PHE  16           HZ       PHE  16  -2.970   5.184 -14.781
  141    H    GLN  17           HN       GLN  17  -8.449   3.304  -9.435
  142    HA   GLN  17           HA       GLN  17 -10.728   1.701  -9.690
  143    HB2  GLN  17           HB2      GLN  17  -9.044   1.763  -7.768
  144    HB3  GLN  17           HB1      GLN  17  -9.957   3.140  -7.152
  145    HG2  GLN  17           HG2      GLN  17 -10.770   1.080  -6.111
  146    HG3  GLN  17           HG1      GLN  17 -12.017   1.752  -7.161
  147   HE21  GLN  17          HE21      GLN  17  -9.212  -0.513  -7.483
  148   HE22  GLN  17          HE22      GLN  17 -10.044  -1.620  -8.463
  149    H1   ALA   1           HT1      ALA   1 -13.152   1.403  -3.383
  150    H2   ALA   1           HT2      ALA   1 -13.335   0.016  -2.419
  151    H3   ALA   1           HT3      ALA   1 -14.088   0.103  -3.939
  152    HA   ALA   1           HA       ALA   1 -12.115  -0.150  -5.100
  153    HB1  ALA   1           HB1      ALA   1 -10.842   1.546  -3.874
  154    HB2  ALA   1           HB2      ALA   1  -9.908   0.053  -3.968
  155    HB3  ALA   1           HB3      ALA   1 -10.737   0.482  -2.472
  156    H    THR   2           HN       THR   2 -11.862  -2.243  -5.564
  157    HA   THR   2           HA       THR   2 -12.567  -4.304  -3.739
  158    HB   THR   2           HB       THR   2 -11.066  -4.509  -6.361
  159    HG1  THR   2           HG1      THR   2 -12.972  -3.668  -6.884
  160   HG21  THR   2          HG21      THR   2 -11.836  -6.816  -6.371
  161   HG22  THR   2          HG22      THR   2 -12.713  -6.563  -4.862
  162   HG23  THR   2          HG23      THR   2 -10.950  -6.518  -4.875
  163    H    LEU   3           HN       LEU   3 -11.383  -5.212  -2.191
  164    HA   LEU   3           HA       LEU   3  -8.757  -4.467  -1.571
  165    HB2  LEU   3           HB2      LEU   3 -10.506  -6.768  -0.750
  166    HB3  LEU   3           HB1      LEU   3  -8.829  -6.682  -0.209
  167    HG   LEU   3           HG       LEU   3  -9.340  -4.304   0.564
  168   HD11  LEU   3          HD11      LEU   3 -11.350  -3.803  -0.614
  169   HD12  LEU   3          HD12      LEU   3 -11.837  -4.000   1.069
  170   HD13  LEU   3          HD13      LEU   3 -12.120  -5.300  -0.088
  171   HD21  LEU   3          HD21      LEU   3 -10.691  -6.721   1.789
  172   HD22  LEU   3          HD22      LEU   3 -10.617  -5.159   2.604
  173   HD23  LEU   3          HD23      LEU   3  -9.129  -6.024   2.218
  174    H    GLU   4           HN       GLU   4  -9.973  -7.376  -3.222
  175    HA   GLU   4           HA       GLU   4  -7.520  -8.676  -3.585
  176    HB2  GLU   4           HB2      GLU   4 -10.049  -8.689  -5.239
  177    HB3  GLU   4           HB1      GLU   4  -8.676  -9.748  -5.568
  178    HG2  GLU   4           HG2      GLU   4  -8.847 -10.753  -3.371
  179    HG3  GLU   4           HG1      GLU   4 -10.088  -9.597  -2.891
  180    H    LYS   5           HN       LYS   5  -9.210  -6.364  -5.699
  181    HA   LYS   5           HA       LYS   5  -7.380  -6.362  -7.818
  182    HB2  LYS   5           HB2      LYS   5  -9.654  -5.286  -7.801
  183    HB3  LYS   5           HB1      LYS   5  -8.962  -3.976  -6.844
  184    HG2  LYS   5           HG2      LYS   5  -7.485  -4.721  -9.313
  185    HG3  LYS   5           HG1      LYS   5  -9.042  -3.925  -9.543
  186    HD2  LYS   5           HD2      LYS   5  -8.123  -2.276  -7.695
  187    HD3  LYS   5           HD1      LYS   5  -6.556  -2.880  -8.234
  188    HE2  LYS   5           HE2      LYS   5  -8.659  -1.804 -10.127
  189    HE3  LYS   5           HE1      LYS   5  -7.365  -0.813  -9.455
  190    HZ1  LYS   5           HZ1      LYS   5  -7.192  -3.061 -11.343
  191    HZ2  LYS   5           HZ2      LYS   5  -5.870  -2.713 -10.335
  192    HZ3  LYS   5           HZ3      LYS   5  -6.450  -1.537 -11.417
  193    H    LEU   6           HN       LEU   6  -7.505  -4.308  -4.913
  194    HA   LEU   6           HA       LEU   6  -5.304  -2.679  -5.493
  195    HB2  LEU   6           HB2      LEU   6  -6.841  -2.187  -3.660
  196    HB3  LEU   6           HB1      LEU   6  -6.313  -3.635  -2.804
  197    HG   LEU   6           HG       LEU   6  -4.128  -1.829  -3.635
  198   HD11  LEU   6          HD11      LEU   6  -4.553  -0.127  -2.000
  199   HD12  LEU   6          HD12      LEU   6  -5.935  -1.006  -1.349
  200   HD13  LEU   6          HD13      LEU   6  -6.030  -0.277  -2.951
  201   HD21  LEU   6          HD21      LEU   6  -3.521  -2.294  -1.194
  202   HD22  LEU   6          HD22      LEU   6  -3.614  -3.710  -2.241
  203   HD23  LEU   6          HD23      LEU   6  -4.939  -3.340  -1.139
  204    H    MET   7           HN       MET   7  -5.457  -5.761  -3.722
  205    HA   MET   7           HA       MET   7  -2.751  -5.956  -3.035
  206    HB2  MET   7           HB2      MET   7  -4.500  -7.443  -2.134
  207    HB3  MET   7           HB1      MET   7  -4.667  -8.198  -3.720
  208    HG2  MET   7           HG2      MET   7  -3.208  -9.576  -2.338
  209    HG3  MET   7           HG1      MET   7  -2.250  -8.837  -3.621
  210    HE1  MET   7           HE1      MET   7  -0.023  -9.234  -2.448
  211    HE2  MET   7           HE2      MET   7  -0.914 -10.110  -1.205
  212    HE3  MET   7           HE3      MET   7   0.285  -8.907  -0.736
  213    H    LYS   8           HN       LYS   8  -4.461  -7.143  -5.922
  214    HA   LYS   8           HA       LYS   8  -2.290  -8.383  -7.180
  215    HB2  LYS   8           HB2      LYS   8  -4.738  -7.024  -8.319
  216    HB3  LYS   8           HB1      LYS   8  -3.587  -7.930  -9.302
  217    HG2  LYS   8           HG2      LYS   8  -3.971  -9.935  -7.921
  218    HG3  LYS   8           HG1      LYS   8  -5.118  -9.034  -6.929
  219    HD2  LYS   8           HD2      LYS   8  -6.527  -8.641  -8.925
  220    HD3  LYS   8           HD1      LYS   8  -5.391  -9.573  -9.901
  221    HE2  LYS   8           HE2      LYS   8  -6.891 -10.645  -7.493
  222    HE3  LYS   8           HE1      LYS   8  -7.334 -10.944  -9.174
  223    HZ1  LYS   8           HZ1      LYS   8  -4.797 -11.728  -7.846
  224    HZ2  LYS   8           HZ2      LYS   8  -5.116 -11.920  -9.503
  225    HZ3  LYS   8           HZ3      LYS   8  -6.036 -12.768  -8.354
  226    H    ALA   9           HN       ALA   9  -3.473  -5.037  -7.447
  227    HA   ALA   9           HA       ALA   9  -1.634  -4.123  -9.351
  228    HB1  ALA   9           HB1      ALA   9  -3.548  -2.778  -8.741
  229    HB2  ALA   9           HB2      ALA   9  -2.085  -1.864  -8.374
  230    HB3  ALA   9           HB3      ALA   9  -2.981  -2.652  -7.076
  231    H    PHE  10           HN       PHE  10  -1.431  -4.120  -5.797
  232    HA   PHE  10           HA       PHE  10   1.050  -2.846  -5.547
  233    HB2  PHE  10           HB2      PHE  10  -0.390  -3.245  -3.622
  234    HB3  PHE  10           HB1      PHE  10  -0.191  -4.988  -3.803
  235    HD1  PHE  10           HD1      PHE  10   1.673  -1.821  -3.160
  236    HD2  PHE  10           HD2      PHE  10   1.685  -6.108  -2.884
  237    HE1  PHE  10           HE1      PHE  10   3.745  -1.728  -1.801
  238    HE2  PHE  10           HE2      PHE  10   3.757  -6.014  -1.525
  239    HZ   PHE  10           HZ       PHE  10   4.787  -3.824  -0.983
  240    H    GLU  11           HN       GLU  11   0.285  -6.311  -5.834
  241    HA   GLU  11           HA       GLU  11   2.896  -7.305  -5.630
  242    HB2  GLU  11           HB2      GLU  11   0.484  -8.340  -7.132
  243    HB3  GLU  11           HB1      GLU  11   1.988  -9.248  -6.973
  244    HG2  GLU  11           HG2      GLU  11   0.293  -8.232  -4.671
  245    HG3  GLU  11           HG1      GLU  11   0.365  -9.903  -5.229
  246    H    SER  12           HN       SER  12   1.049  -6.321  -8.510
  247    HA   SER  12           HA       SER  12   2.977  -6.947 -10.444
  248    HB2  SER  12           HB2      SER  12   0.897  -4.749 -10.407
  249    HB3  SER  12           HB1      SER  12   1.832  -5.204 -11.829
  250    HG   SER  12           HG       SER  12   0.276  -7.021 -10.304
  251    H    LEU  13           HN       LEU  13   2.433  -3.926  -8.638
  252    HA   LEU  13           HA       LEU  13   4.455  -2.390  -9.816
  253    HB2  LEU  13           HB2      LEU  13   2.740  -1.446  -8.335
  254    HB3  LEU  13           HB1      LEU  13   3.433  -2.316  -6.967
  255    HG   LEU  13           HG       LEU  13   5.572  -1.095  -7.303
  256   HD11  LEU  13          HD11      LEU  13   5.562  -0.571  -9.620
  257   HD12  LEU  13          HD12      LEU  13   5.365   0.984  -8.811
  258   HD13  LEU  13          HD13      LEU  13   3.969   0.179  -9.526
  259   HD21  LEU  13          HD21      LEU  13   4.166  -0.111  -5.672
  260   HD22  LEU  13          HD22      LEU  13   3.007   0.445  -6.880
  261   HD23  LEU  13          HD23      LEU  13   4.579   1.231  -6.738
  262    H    LYS  14           HN       LYS  14   4.562  -4.485  -6.941
  263    HA   LYS  14           HA       LYS  14   7.225  -4.023  -6.216
  264    HB2  LYS  14           HB2      LYS  14   5.635  -5.224  -4.780
  265    HB3  LYS  14           HB1      LYS  14   5.605  -6.565  -5.924
  266    HG2  LYS  14           HG2      LYS  14   7.142  -7.116  -4.122
  267    HG3  LYS  14           HG1      LYS  14   8.076  -6.835  -5.591
  268    HD2  LYS  14           HD2      LYS  14   8.635  -4.581  -4.863
  269    HD3  LYS  14           HD1      LYS  14   7.589  -4.743  -3.451
  270    HE2  LYS  14           HE2      LYS  14   8.998  -6.588  -2.616
  271    HE3  LYS  14           HE1      LYS  14  10.047  -6.427  -4.025
  272    HZ1  LYS  14           HZ1      LYS  14  10.924  -5.255  -2.091
  273    HZ2  LYS  14           HZ2      LYS  14   9.523  -4.296  -2.024
  274    HZ3  LYS  14           HZ3      LYS  14  10.572  -4.182  -3.356
  275    H    SER  15           HN       SER  15   5.846  -6.493  -8.373
  276    HA   SER  15           HA       SER  15   8.229  -7.828  -8.995
  277    HB2  SER  15           HB2      SER  15   7.071  -8.651 -10.981
  278    HB3  SER  15           HB1      SER  15   5.983  -8.680  -9.597
  279    HG   SER  15           HG       SER  15   4.913  -6.968 -10.392
  280    H    PHE  16           HN       PHE  16   6.651  -5.073 -10.599
  281    HA   PHE  16           HA       PHE  16   8.474  -4.730 -12.695
  282    HB2  PHE  16           HB2      PHE  16   6.335  -3.564 -12.617
  283    HB3  PHE  16           HB1      PHE  16   6.843  -2.676 -11.182
  284    HD1  PHE  16           HD1      PHE  16   7.655  -3.248 -14.778
  285    HD2  PHE  16           HD2      PHE  16   8.103  -0.682 -11.363
  286    HE1  PHE  16           HE1      PHE  16   8.678  -1.508 -16.219
  287    HE2  PHE  16           HE2      PHE  16   9.128   1.056 -12.803
  288    HZ   PHE  16           HZ       PHE  16   9.415   0.644 -15.232
  289    H    GLN  17           HN       GLN  17   8.449  -3.304  -9.435
  290    HA   GLN  17           HA       GLN  17  10.728  -1.701  -9.690
  291    HB2  GLN  17           HB2      GLN  17   9.044  -1.763  -7.768
  292    HB3  GLN  17           HB1      GLN  17   9.957  -3.140  -7.152
  293    HG2  GLN  17           HG2      GLN  17  10.770  -1.080  -6.111
  294    HG3  GLN  17           HG1      GLN  17  12.017  -1.752  -7.161
  295   HE21  GLN  17          HE21      GLN  17   9.212   0.513  -7.483
  296   HE22  GLN  17          HE22      GLN  17  10.044   1.620  -8.463
  297    H1   ALA   1           HT1      ALA   1  -1.403  13.152   3.383
  298    H2   ALA   1           HT2      ALA   1  -0.016  13.335   2.419
  299    H3   ALA   1           HT3      ALA   1  -0.103  14.088   3.939
  300    HA   ALA   1           HA       ALA   1   0.150  12.115   5.100
  301    HB1  ALA   1           HB1      ALA   1  -1.546  10.842   3.874
  302    HB2  ALA   1           HB2      ALA   1  -0.053   9.908   3.968
  303    HB3  ALA   1           HB3      ALA   1  -0.482  10.737   2.472
  304    H    THR   2           HN       THR   2   2.243  11.862   5.564
  305    HA   THR   2           HA       THR   2   4.304  12.567   3.739
  306    HB   THR   2           HB       THR   2   4.509  11.066   6.361
  307    HG1  THR   2           HG1      THR   2   3.668  12.972   6.884
  308   HG21  THR   2          HG21      THR   2   6.816  11.836   6.371
  309   HG22  THR   2          HG22      THR   2   6.563  12.713   4.862
  310   HG23  THR   2          HG23      THR   2   6.518  10.950   4.875
  311    H    LEU   3           HN       LEU   3   5.212  11.383   2.191
  312    HA   LEU   3           HA       LEU   3   4.467   8.757   1.571
  313    HB2  LEU   3           HB2      LEU   3   6.768  10.506   0.750
  314    HB3  LEU   3           HB1      LEU   3   6.682   8.829   0.209
  315    HG   LEU   3           HG       LEU   3   4.304   9.340  -0.564
  316   HD11  LEU   3          HD11      LEU   3   3.803  11.350   0.614
  317   HD12  LEU   3          HD12      LEU   3   4.000  11.837  -1.069
  318   HD13  LEU   3          HD13      LEU   3   5.300  12.120   0.088
  319   HD21  LEU   3          HD21      LEU   3   6.721  10.691  -1.789
  320   HD22  LEU   3          HD22      LEU   3   5.159  10.617  -2.604
  321   HD23  LEU   3          HD23      LEU   3   6.024   9.129  -2.218
  322    H    GLU   4           HN       GLU   4   7.376   9.973   3.222
  323    HA   GLU   4           HA       GLU   4   8.676   7.520   3.585
  324    HB2  GLU   4           HB2      GLU   4   8.689  10.049   5.239
  325    HB3  GLU   4           HB1      GLU   4   9.748   8.676   5.568
  326    HG2  GLU   4           HG2      GLU   4  10.753   8.847   3.371
  327    HG3  GLU   4           HG1      GLU   4   9.597  10.088   2.891
  328    H    LYS   5           HN       LYS   5   6.364   9.210   5.699
  329    HA   LYS   5           HA       LYS   5   6.362   7.380   7.818
  330    HB2  LYS   5           HB2      LYS   5   5.286   9.654   7.801
  331    HB3  LYS   5           HB1      LYS   5   3.976   8.962   6.844
  332    HG2  LYS   5           HG2      LYS   5   4.721   7.485   9.313
  333    HG3  LYS   5           HG1      LYS   5   3.925   9.042   9.543
  334    HD2  LYS   5           HD2      LYS   5   2.276   8.123   7.695
  335    HD3  LYS   5           HD1      LYS   5   2.880   6.556   8.234
  336    HE2  LYS   5           HE2      LYS   5   1.804   8.659  10.128
  337    HE3  LYS   5           HE1      LYS   5   0.813   7.365   9.455
  338    HZ1  LYS   5           HZ1      LYS   5   3.061   7.192  11.343
  339    HZ2  LYS   5           HZ2      LYS   5   2.712   5.870  10.335
  340    HZ3  LYS   5           HZ3      LYS   5   1.537   6.450  11.417
  341    H    LEU   6           HN       LEU   6   4.308   7.505   4.913
  342    HA   LEU   6           HA       LEU   6   2.679   5.304   5.493
  343    HB2  LEU   6           HB2      LEU   6   2.187   6.841   3.660
  344    HB3  LEU   6           HB1      LEU   6   3.635   6.313   2.804
  345    HG   LEU   6           HG       LEU   6   1.829   4.128   3.635
  346   HD11  LEU   6          HD11      LEU   6   0.127   4.553   2.000
  347   HD12  LEU   6          HD12      LEU   6   1.006   5.935   1.349
  348   HD13  LEU   6          HD13      LEU   6   0.277   6.030   2.951
  349   HD21  LEU   6          HD21      LEU   6   2.294   3.521   1.194
  350   HD22  LEU   6          HD22      LEU   6   3.710   3.614   2.241
  351   HD23  LEU   6          HD23      LEU   6   3.340   4.939   1.139
  352    H    MET   7           HN       MET   7   5.761   5.457   3.722
  353    HA   MET   7           HA       MET   7   5.956   2.751   3.035
  354    HB2  MET   7           HB2      MET   7   7.443   4.500   2.134
  355    HB3  MET   7           HB1      MET   7   8.198   4.667   3.720
  356    HG2  MET   7           HG2      MET   7   9.576   3.208   2.338
  357    HG3  MET   7           HG1      MET   7   8.837   2.250   3.621
  358    HE1  MET   7           HE1      MET   7   9.234   0.023   2.448
  359    HE2  MET   7           HE2      MET   7  10.110   0.914   1.205
  360    HE3  MET   7           HE3      MET   7   8.907  -0.285   0.736
  361    H    LYS   8           HN       LYS   8   7.143   4.461   5.922
  362    HA   LYS   8           HA       LYS   8   8.383   2.290   7.180
  363    HB2  LYS   8           HB2      LYS   8   7.024   4.738   8.319
  364    HB3  LYS   8           HB1      LYS   8   7.930   3.587   9.302
  365    HG2  LYS   8           HG2      LYS   8   9.935   3.971   7.921
  366    HG3  LYS   8           HG1      LYS   8   9.034   5.118   6.929
  367    HD2  LYS   8           HD2      LYS   8   8.641   6.527   8.925
  368    HD3  LYS   8           HD1      LYS   8   9.573   5.391   9.901
  369    HE2  LYS   8           HE2      LYS   8  10.645   6.891   7.493
  370    HE3  LYS   8           HE1      LYS   8  10.944   7.334   9.174
  371    HZ1  LYS   8           HZ1      LYS   8  11.728   4.797   7.846
  372    HZ2  LYS   8           HZ2      LYS   8  11.920   5.116   9.503
  373    HZ3  LYS   8           HZ3      LYS   8  12.768   6.036   8.354
  374    H    ALA   9           HN       ALA   9   5.037   3.473   7.447
  375    HA   ALA   9           HA       ALA   9   4.123   1.634   9.350
  376    HB1  ALA   9           HB1      ALA   9   2.779   3.550   8.738
  377    HB2  ALA   9           HB2      ALA   9   1.864   2.086   8.376
  378    HB3  ALA   9           HB3      ALA   9   2.651   2.979   7.074
  379    H    PHE  10           HN       PHE  10   4.120   1.431   5.797
  380    HA   PHE  10           HA       PHE  10   2.846  -1.050   5.547
  381    HB2  PHE  10           HB2      PHE  10   3.245   0.390   3.622
  382    HB3  PHE  10           HB1      PHE  10   4.988   0.191   3.803
  383    HD1  PHE  10           HD1      PHE  10   1.821  -1.673   3.160
  384    HD2  PHE  10           HD2      PHE  10   6.108  -1.685   2.884
  385    HE1  PHE  10           HE1      PHE  10   1.728  -3.745   1.801
  386    HE2  PHE  10           HE2      PHE  10   6.014  -3.757   1.525
  387    HZ   PHE  10           HZ       PHE  10   3.824  -4.787   0.983
  388    H    GLU  11           HN       GLU  11   6.311  -0.285   5.834
  389    HA   GLU  11           HA       GLU  11   7.305  -2.896   5.630
  390    HB2  GLU  11           HB2      GLU  11   8.340  -0.484   7.132
  391    HB3  GLU  11           HB1      GLU  11   9.248  -1.988   6.973
  392    HG2  GLU  11           HG2      GLU  11   8.232  -0.293   4.671
  393    HG3  GLU  11           HG1      GLU  11   9.903  -0.365   5.229
  394    H    SER  12           HN       SER  12   6.321  -1.049   8.510
  395    HA   SER  12           HA       SER  12   6.948  -2.985  10.435
  396    HB2  SER  12           HB2      SER  12   5.404  -1.812  11.904
  397    HB3  SER  12           HB1      SER  12   6.317  -0.637  10.962
  398    HG   SER  12           HG       SER  12   4.562  -0.189   9.797
  399    H    LEU  13           HN       LEU  13   3.926  -2.433   8.638
  400    HA   LEU  13           HA       LEU  13   2.393  -4.456   9.818
  401    HB2  LEU  13           HB2      LEU  13   1.430  -2.751   8.348
  402    HB3  LEU  13           HB1      LEU  13   2.312  -3.419   6.974
  403    HG   LEU  13           HG       LEU  13   1.115  -5.571   7.270
  404   HD11  LEU  13          HD11      LEU  13   0.630  -5.576   9.613
  405   HD12  LEU  13          HD12      LEU  13  -0.930  -5.478   8.798
  406   HD13  LEU  13          HD13      LEU  13  -0.216  -4.032   9.511
  407   HD21  LEU  13          HD21      LEU  13   0.096  -4.153   5.677
  408   HD22  LEU  13          HD22      LEU  13  -0.456  -3.018   6.909
  409   HD23  LEU  13          HD23      LEU  13  -1.232  -4.593   6.751
  410    H    LYS  14           HN       LYS  14   4.485  -4.562   6.941
  411    HA   LYS  14           HA       LYS  14   4.023  -7.225   6.216
  412    HB2  LYS  14           HB2      LYS  14   5.224  -5.635   4.780
  413    HB3  LYS  14           HB1      LYS  14   6.565  -5.605   5.924
  414    HG2  LYS  14           HG2      LYS  14   7.116  -7.142   4.122
  415    HG3  LYS  14           HG1      LYS  14   6.835  -8.076   5.591
  416    HD2  LYS  14           HD2      LYS  14   4.581  -8.635   4.863
  417    HD3  LYS  14           HD1      LYS  14   4.743  -7.589   3.451
  418    HE2  LYS  14           HE2      LYS  14   6.588  -8.998   2.616
  419    HE3  LYS  14           HE1      LYS  14   6.427 -10.047   4.025
  420    HZ1  LYS  14           HZ1      LYS  14   5.255 -10.924   2.091
  421    HZ2  LYS  14           HZ2      LYS  14   4.296  -9.523   2.024
  422    HZ3  LYS  14           HZ3      LYS  14   4.182 -10.572   3.356
  423    H    SER  15           HN       SER  15   6.493  -5.846   8.373
  424    HA   SER  15           HA       SER  15   7.838  -8.222   9.000
  425    HB2  SER  15           HB2      SER  15   8.701  -6.007   9.621
  426    HB3  SER  15           HB1      SER  15   7.365  -5.791  10.747
  427    HG   SER  15           HG       SER  15   9.497  -6.656  11.538
  428    H    PHE  16           HN       PHE  16   5.073  -6.651  10.599
  429    HA   PHE  16           HA       PHE  16   4.735  -8.479  12.692
  430    HB2  PHE  16           HB2      PHE  16   3.543  -6.372  12.681
  431    HB3  PHE  16           HB1      PHE  16   2.689  -6.818  11.203
  432    HD1  PHE  16           HD1      PHE  16   3.195  -7.809  14.765
  433    HD2  PHE  16           HD2      PHE  16   0.693  -8.089  11.284
  434    HE1  PHE  16           HE1      PHE  16   1.443  -8.933  16.114
  435    HE2  PHE  16           HE2      PHE  16  -1.058  -9.212  12.633
  436    HZ   PHE  16           HZ       PHE  16  -0.683  -9.634  15.048
  437    H    GLN  17           HN       GLN  17   3.304  -8.449   9.435
  438    HA   GLN  17           HA       GLN  17   1.701 -10.728   9.689
  439    HB2  GLN  17           HB2      GLN  17   1.857  -9.001   7.759
  440    HB3  GLN  17           HB1      GLN  17   3.127 -10.050   7.129
  441    HG2  GLN  17           HG2      GLN  17   0.995 -10.707   6.149
  442    HG3  GLN  17           HG1      GLN  17   1.543 -11.975   7.244
  443   HE21  GLN  17          HE21      GLN  17  -0.404  -8.932   7.481
  444   HE22  GLN  17          HE22      GLN  17  -1.587  -9.607   8.494
  445    H1   ALA   1           HT1      ALA   1   1.403 -13.152   3.383
  446    H2   ALA   1           HT2      ALA   1   0.016 -13.335   2.419
  447    H3   ALA   1           HT3      ALA   1   0.103 -14.088   3.939
  448    HA   ALA   1           HA       ALA   1  -0.150 -12.115   5.100
  449    HB1  ALA   1           HB1      ALA   1   1.546 -10.842   3.874
  450    HB2  ALA   1           HB2      ALA   1   0.053  -9.908   3.968
  451    HB3  ALA   1           HB3      ALA   1   0.482 -10.737   2.472
  452    H    THR   2           HN       THR   2  -2.243 -11.862   5.564
  453    HA   THR   2           HA       THR   2  -4.298 -12.564   3.732
  454    HB   THR   2           HB       THR   2  -4.493 -11.111   6.378
  455    HG1  THR   2           HG1      THR   2  -3.707 -13.029   6.883
  456   HG21  THR   2          HG21      THR   2  -6.808 -11.827   6.383
  457   HG22  THR   2          HG22      THR   2  -6.581 -12.693   4.865
  458   HG23  THR   2          HG23      THR   2  -6.506 -10.931   4.894
  459    H    LEU   3           HN       LEU   3  -5.212 -11.383   2.191
  460    HA   LEU   3           HA       LEU   3  -4.467  -8.757   1.571
  461    HB2  LEU   3           HB2      LEU   3  -6.768 -10.506   0.750
  462    HB3  LEU   3           HB1      LEU   3  -6.682  -8.829   0.209
  463    HG   LEU   3           HG       LEU   3  -4.304  -9.340  -0.564
  464   HD11  LEU   3          HD11      LEU   3  -3.803 -11.350   0.614
  465   HD12  LEU   3          HD12      LEU   3  -4.000 -11.837  -1.069
  466   HD13  LEU   3          HD13      LEU   3  -5.300 -12.120   0.088
  467   HD21  LEU   3          HD21      LEU   3  -6.721 -10.691  -1.789
  468   HD22  LEU   3          HD22      LEU   3  -5.159 -10.617  -2.604
  469   HD23  LEU   3          HD23      LEU   3  -6.024  -9.129  -2.218
  470    H    GLU   4           HN       GLU   4  -7.376  -9.973   3.222
  471    HA   GLU   4           HA       GLU   4  -8.676  -7.520   3.585
  472    HB2  GLU   4           HB2      GLU   4  -8.689 -10.049   5.239
  473    HB3  GLU   4           HB1      GLU   4  -9.748  -8.676   5.568
  474    HG2  GLU   4           HG2      GLU   4 -10.753  -8.847   3.371
  475    HG3  GLU   4           HG1      GLU   4  -9.597 -10.088   2.891
  476    H    LYS   5           HN       LYS   5  -6.364  -9.210   5.699
  477    HA   LYS   5           HA       LYS   5  -6.365  -7.376   7.813
  478    HB2  LYS   5           HB2      LYS   5  -4.257  -9.260   6.782
  479    HB3  LYS   5           HB1      LYS   5  -3.982  -8.232   8.187
  480    HG2  LYS   5           HG2      LYS   5  -6.343  -9.216   8.930
  481    HG3  LYS   5           HG1      LYS   5  -5.858 -10.539   7.869
  482    HD2  LYS   5           HD2      LYS   5  -4.451 -11.325   9.435
  483    HD3  LYS   5           HD1      LYS   5  -3.617  -9.773   9.503
  484    HE2  LYS   5           HE2      LYS   5  -6.269 -10.079  10.878
  485    HE3  LYS   5           HE1      LYS   5  -4.813 -10.701  11.656
  486    HZ1  LYS   5           HZ1      LYS   5  -5.570  -8.251  12.030
  487    HZ2  LYS   5           HZ2      LYS   5  -4.781  -7.983  10.549
  488    HZ3  LYS   5           HZ3      LYS   5  -3.922  -8.621  11.867
  489    H    LEU   6           HN       LEU   6  -4.308  -7.505   4.913
  490    HA   LEU   6           HA       LEU   6  -2.679  -5.304   5.493
  491    HB2  LEU   6           HB2      LEU   6  -2.187  -6.841   3.660
  492    HB3  LEU   6           HB1      LEU   6  -3.635  -6.313   2.804
  493    HG   LEU   6           HG       LEU   6  -1.829  -4.128   3.635
  494   HD11  LEU   6          HD11      LEU   6  -0.127  -4.553   2.000
  495   HD12  LEU   6          HD12      LEU   6  -1.006  -5.935   1.349
  496   HD13  LEU   6          HD13      LEU   6  -0.277  -6.030   2.951
  497   HD21  LEU   6          HD21      LEU   6  -2.294  -3.521   1.194
  498   HD22  LEU   6          HD22      LEU   6  -3.709  -3.614   2.241
  499   HD23  LEU   6          HD23      LEU   6  -3.340  -4.939   1.139
  500    H    MET   7           HN       MET   7  -5.761  -5.457   3.722
  501    HA   MET   7           HA       MET   7  -5.956  -2.751   3.035
  502    HB2  MET   7           HB2      MET   7  -7.443  -4.500   2.134
  503    HB3  MET   7           HB1      MET   7  -8.198  -4.667   3.720
  504    HG2  MET   7           HG2      MET   7  -9.576  -3.208   2.338
  505    HG3  MET   7           HG1      MET   7  -8.837  -2.250   3.621
  506    HE1  MET   7           HE1      MET   7  -9.234  -0.023   2.448
  507    HE2  MET   7           HE2      MET   7 -10.110  -0.914   1.205
  508    HE3  MET   7           HE3      MET   7  -8.907   0.285   0.736
  509    H    LYS   8           HN       LYS   8  -7.143  -4.461   5.922
  510    HA   LYS   8           HA       LYS   8  -8.383  -2.290   7.180
  511    HB2  LYS   8           HB2      LYS   8  -7.024  -4.738   8.319
  512    HB3  LYS   8           HB1      LYS   8  -7.930  -3.587   9.302
  513    HG2  LYS   8           HG2      LYS   8  -9.935  -3.971   7.921
  514    HG3  LYS   8           HG1      LYS   8  -9.034  -5.118   6.929
  515    HD2  LYS   8           HD2      LYS   8  -8.641  -6.527   8.925
  516    HD3  LYS   8           HD1      LYS   8  -9.573  -5.391   9.901
  517    HE2  LYS   8           HE2      LYS   8 -10.645  -6.891   7.493
  518    HE3  LYS   8           HE1      LYS   8 -10.944  -7.334   9.174
  519    HZ1  LYS   8           HZ1      LYS   8 -11.728  -4.797   7.846
  520    HZ2  LYS   8           HZ2      LYS   8 -11.920  -5.116   9.503
  521    HZ3  LYS   8           HZ3      LYS   8 -12.768  -6.036   8.354
  522    H    ALA   9           HN       ALA   9  -5.037  -3.473   7.447
  523    HA   ALA   9           HA       ALA   9  -4.124  -1.633   9.350
  524    HB1  ALA   9           HB1      ALA   9  -2.723  -3.481   8.828
  525    HB2  ALA   9           HB2      ALA   9  -1.860  -2.053   8.258
  526    HB3  ALA   9           HB3      ALA   9  -2.714  -3.084   7.110
  527    H    PHE  10           HN       PHE  10  -4.120  -1.431   5.797
  528    HA   PHE  10           HA       PHE  10  -2.846   1.050   5.547
  529    HB2  PHE  10           HB2      PHE  10  -3.245  -0.390   3.622
  530    HB3  PHE  10           HB1      PHE  10  -4.988  -0.191   3.803
  531    HD1  PHE  10           HD1      PHE  10  -1.821   1.673   3.160
  532    HD2  PHE  10           HD2      PHE  10  -6.108   1.685   2.884
  533    HE1  PHE  10           HE1      PHE  10  -1.728   3.745   1.801
  534    HE2  PHE  10           HE2      PHE  10  -6.014   3.757   1.525
  535    HZ   PHE  10           HZ       PHE  10  -3.824   4.787   0.983
  536    H    GLU  11           HN       GLU  11  -6.311   0.285   5.834
  537    HA   GLU  11           HA       GLU  11  -7.305   2.896   5.630
  538    HB2  GLU  11           HB2      GLU  11  -8.340   0.484   7.132
  539    HB3  GLU  11           HB1      GLU  11  -9.248   1.988   6.973
  540    HG2  GLU  11           HG2      GLU  11  -8.232   0.293   4.671
  541    HG3  GLU  11           HG1      GLU  11  -9.903   0.365   5.229
  542    H    SER  12           HN       SER  12  -6.321   1.049   8.510
  543    HA   SER  12           HA       SER  12  -6.949   2.986  10.434
  544    HB2  SER  12           HB2      SER  12  -5.381   1.819  11.897
  545    HB3  SER  12           HB1      SER  12  -6.335   0.653  10.985
  546    HG   SER  12           HG       SER  12  -3.637   1.273  10.854
  547    H    LEU  13           HN       LEU  13  -3.926   2.433   8.638
  548    HA   LEU  13           HA       LEU  13  -2.390   4.455   9.816
  549    HB2  LEU  13           HB2      LEU  13  -1.446   2.740   8.335
  550    HB3  LEU  13           HB1      LEU  13  -2.316   3.433   6.967
  551    HG   LEU  13           HG       LEU  13  -1.095   5.572   7.303
  552   HD11  LEU  13          HD11      LEU  13  -0.571   5.562   9.620
  553   HD12  LEU  13          HD12      LEU  13   0.984   5.365   8.811
  554   HD13  LEU  13          HD13      LEU  13   0.179   3.969   9.526
  555   HD21  LEU  13          HD21      LEU  13  -0.111   4.166   5.672
  556   HD22  LEU  13          HD22      LEU  13   0.445   3.007   6.880
  557   HD23  LEU  13          HD23      LEU  13   1.231   4.579   6.738
  558    H    LYS  14           HN       LYS  14  -4.485   4.562   6.941
  559    HA   LYS  14           HA       LYS  14  -4.023   7.225   6.216
  560    HB2  LYS  14           HB2      LYS  14  -5.224   5.635   4.780
  561    HB3  LYS  14           HB1      LYS  14  -6.565   5.605   5.924
  562    HG2  LYS  14           HG2      LYS  14  -7.116   7.142   4.122
  563    HG3  LYS  14           HG1      LYS  14  -6.835   8.076   5.591
  564    HD2  LYS  14           HD2      LYS  14  -4.581   8.635   4.863
  565    HD3  LYS  14           HD1      LYS  14  -4.743   7.589   3.451
  566    HE2  LYS  14           HE2      LYS  14  -6.588   8.998   2.616
  567    HE3  LYS  14           HE1      LYS  14  -6.427  10.047   4.025
  568    HZ1  LYS  14           HZ1      LYS  14  -5.255  10.924   2.091
  569    HZ2  LYS  14           HZ2      LYS  14  -4.296   9.523   2.024
  570    HZ3  LYS  14           HZ3      LYS  14  -4.182  10.572   3.356
  571    H    SER  15           HN       SER  15  -6.493   5.846   8.373
  572    HA   SER  15           HA       SER  15  -7.838   8.222   9.000
  573    HB2  SER  15           HB2      SER  15  -8.701   6.008   9.623
  574    HB3  SER  15           HB1      SER  15  -7.365   5.794  10.750
  575    HG   SER  15           HG       SER  15  -8.229   7.249  12.073
  576    H    PHE  16           HN       PHE  16  -5.073   6.651  10.599
  577    HA   PHE  16           HA       PHE  16  -4.737   8.481  12.690
  578    HB2  PHE  16           HB2      PHE  16  -2.859   6.634  11.242
  579    HB3  PHE  16           HB1      PHE  16  -2.256   7.733  12.483
  580    HD1  PHE  16           HD1      PHE  16  -3.562   4.521  11.923
  581    HD2  PHE  16           HD2      PHE  16  -3.758   7.788  14.704
  582    HE1  PHE  16           HE1      PHE  16  -4.358   2.971  13.687
  583    HE2  PHE  16           HE2      PHE  16  -4.552   6.238  16.469
  584    HZ   PHE  16           HZ       PHE  16  -4.852   3.829  15.960
  585    H    GLN  17           HN       GLN  17  -3.304   8.449   9.435
  586    HA   GLN  17           HA       GLN  17  -1.701  10.728   9.690
  587    HB2  GLN  17           HB2      GLN  17  -1.763   9.044   7.768
  588    HB3  GLN  17           HB1      GLN  17  -3.140   9.957   7.152
  589    HG2  GLN  17           HG2      GLN  17  -1.080  10.770   6.111
  590    HG3  GLN  17           HG1      GLN  17  -1.752  12.017   7.161
  591   HE21  GLN  17          HE21      GLN  17   0.513   9.212   7.483
  592   HE22  GLN  17          HE22      GLN  17   1.620  10.044   8.463
  Start of MODEL    6
    1    H1   ALA   1           HT1      ALA   1  12.114   9.245  -4.840
    2    H2   ALA   1           HT2      ALA   1  13.325   9.404  -6.021
    3    H3   ALA   1           HT3      ALA   1  13.612   9.927  -4.431
    4    HA   ALA   1           HA       ALA   1  14.565   7.672  -5.222
    5    HB1  ALA   1           HB1      ALA   1  14.821   7.169  -2.997
    6    HB2  ALA   1           HB2      ALA   1  13.109   7.395  -2.641
    7    HB3  ALA   1           HB3      ALA   1  14.168   8.796  -2.801
    8    H    THR   2           HN       THR   2  13.827   5.342  -4.399
    9    HA   THR   2           HA       THR   2  11.798   4.479  -6.151
   10    HB   THR   2           HB       THR   2  12.010   2.306  -4.996
   11    HG1  THR   2           HG1      THR   2  13.461   2.222  -3.226
   12   HG21  THR   2          HG21      THR   2  14.675   3.699  -5.371
   13   HG22  THR   2          HG22      THR   2  13.694   3.038  -6.680
   14   HG23  THR   2          HG23      THR   2  14.380   1.963  -5.461
   15    H    LEU   3           HN       LEU   3  11.766   5.272  -2.714
   16    HA   LEU   3           HA       LEU   3   9.247   4.260  -2.030
   17    HB2  LEU   3           HB2      LEU   3  10.711   6.705  -1.007
   18    HB3  LEU   3           HB1      LEU   3   9.286   6.003  -0.240
   19    HG   LEU   3           HG       LEU   3  11.837   4.457  -0.776
   20   HD11  LEU   3          HD11      LEU   3  12.320   6.223   0.826
   21   HD12  LEU   3          HD12      LEU   3  12.195   4.692   1.693
   22   HD13  LEU   3          HD13      LEU   3  10.859   5.843   1.738
   23   HD21  LEU   3          HD21      LEU   3   9.904   3.013  -0.569
   24   HD22  LEU   3          HD22      LEU   3   9.335   3.904   0.842
   25   HD23  LEU   3          HD23      LEU   3  10.799   2.930   0.948
   26    H    GLU   4           HN       GLU   4  10.154   7.465  -3.285
   27    HA   GLU   4           HA       GLU   4   7.605   8.622  -3.262
   28    HB2  GLU   4           HB2      GLU   4  10.014   9.101  -5.013
   29    HB3  GLU   4           HB1      GLU   4   8.537  10.052  -5.163
   30    HG2  GLU   4           HG2      GLU   4   9.822  11.317  -3.657
   31    HG3  GLU   4           HG1      GLU   4   8.761  10.394  -2.595
   32    H    LYS   5           HN       LYS   5   9.255   6.796  -5.832
   33    HA   LYS   5           HA       LYS   5   7.266   6.994  -7.790
   34    HB2  LYS   5           HB2      LYS   5   9.510   6.123  -8.257
   35    HB3  LYS   5           HB1      LYS   5   9.181   4.709  -7.257
   36    HG2  LYS   5           HG2      LYS   5   8.833   4.123  -9.596
   37    HG3  LYS   5           HG1      LYS   5   7.275   4.136  -8.773
   38    HD2  LYS   5           HD2      LYS   5   6.779   6.355  -9.648
   39    HD3  LYS   5           HD1      LYS   5   8.383   6.461 -10.373
   40    HE2  LYS   5           HE2      LYS   5   7.861   4.526 -11.813
   41    HE3  LYS   5           HE1      LYS   5   6.257   4.420 -11.089
   42    HZ1  LYS   5           HZ1      LYS   5   5.648   6.484 -11.988
   43    HZ2  LYS   5           HZ2      LYS   5   6.427   5.663 -13.256
   44    HZ3  LYS   5           HZ3      LYS   5   7.245   6.882 -12.400
   45    H    LEU   6           HN       LEU   6   7.742   4.529  -5.266
   46    HA   LEU   6           HA       LEU   6   5.597   2.859  -5.941
   47    HB2  LEU   6           HB2      LEU   6   7.503   2.595  -4.158
   48    HB3  LEU   6           HB1      LEU   6   6.327   3.339  -3.073
   49    HG   LEU   6           HG       LEU   6   5.599   0.988  -4.822
   50   HD11  LEU   6          HD11      LEU   6   7.493   0.263  -3.473
   51   HD12  LEU   6          HD12      LEU   6   6.016  -0.427  -2.800
   52   HD13  LEU   6          HD13      LEU   6   6.772   0.966  -2.025
   53   HD21  LEU   6          HD21      LEU   6   4.417   2.440  -2.468
   54   HD22  LEU   6          HD22      LEU   6   4.036   0.735  -2.707
   55   HD23  LEU   6          HD23      LEU   6   3.636   1.910  -3.957
   56    H    MET   7           HN       MET   7   5.715   5.634  -3.718
   57    HA   MET   7           HA       MET   7   3.065   5.529  -2.823
   58    HB2  MET   7           HB2      MET   7   5.072   7.746  -3.102
   59    HB3  MET   7           HB1      MET   7   3.423   8.096  -2.581
   60    HG2  MET   7           HG2      MET   7   4.912   5.855  -1.259
   61    HG3  MET   7           HG1      MET   7   5.279   7.517  -0.793
   62    HE1  MET   7           HE1      MET   7   3.521   4.753   0.723
   63    HE2  MET   7           HE2      MET   7   3.012   4.637  -0.959
   64    HE3  MET   7           HE3      MET   7   1.812   4.912   0.300
   65    H    LYS   8           HN       LYS   8   4.465   7.266  -5.594
   66    HA   LYS   8           HA       LYS   8   2.133   8.531  -6.483
   67    HB2  LYS   8           HB2      LYS   8   4.557   7.539  -7.992
   68    HB3  LYS   8           HB1      LYS   8   3.278   8.497  -8.739
   69    HG2  LYS   8           HG2      LYS   8   3.651  10.291  -7.085
   70    HG3  LYS   8           HG1      LYS   8   4.936   9.337  -6.343
   71    HD2  LYS   8           HD2      LYS   8   6.217   9.389  -8.432
   72    HD3  LYS   8           HD1      LYS   8   4.920  10.283  -9.224
   73    HE2  LYS   8           HE2      LYS   8   6.679  11.832  -8.508
   74    HE3  LYS   8           HE1      LYS   8   5.210  12.121  -7.577
   75    HZ1  LYS   8           HZ1      LYS   8   7.529  11.858  -6.414
   76    HZ2  LYS   8           HZ2      LYS   8   7.156  10.205  -6.525
   77    HZ3  LYS   8           HZ3      LYS   8   6.115  11.260  -5.694
   78    H    ALA   9           HN       ALA   9   3.483   5.357  -7.361
   79    HA   ALA   9           HA       ALA   9   1.553   4.623  -9.252
   80    HB1  ALA   9           HB1      ALA   9   3.511   3.290  -9.096
   81    HB2  ALA   9           HB2      ALA   9   2.189   2.253  -8.563
   82    HB3  ALA   9           HB3      ALA   9   3.261   2.995  -7.376
   83    H    PHE  10           HN       PHE  10   1.638   4.056  -5.739
   84    HA   PHE  10           HA       PHE  10  -0.738   2.589  -5.529
   85    HB2  PHE  10           HB2      PHE  10   0.912   2.874  -3.688
   86    HB3  PHE  10           HB1      PHE  10   0.361   4.540  -3.494
   87    HD1  PHE  10           HD1      PHE  10  -0.627   0.983  -3.237
   88    HD2  PHE  10           HD2      PHE  10  -1.772   5.055  -2.491
   89    HE1  PHE  10           HE1      PHE  10  -2.532   0.195  -1.860
   90    HE2  PHE  10           HE2      PHE  10  -3.676   4.266  -1.112
   91    HZ   PHE  10           HZ       PHE  10  -4.056   1.836  -0.797
   92    H    GLU  11           HN       GLU  11  -0.201   6.101  -5.306
   93    HA   GLU  11           HA       GLU  11  -2.838   6.867  -4.762
   94    HB2  GLU  11           HB2      GLU  11  -0.622   8.286  -6.250
   95    HB3  GLU  11           HB1      GLU  11  -2.157   9.051  -5.840
   96    HG2  GLU  11           HG2      GLU  11  -0.222   7.815  -3.858
   97    HG3  GLU  11           HG1      GLU  11  -0.438   9.542  -4.137
   98    H    SER  12           HN       SER  12  -1.178   6.470  -7.886
   99    HA   SER  12           HA       SER  12  -3.289   7.251  -9.553
  100    HB2  SER  12           HB2      SER  12  -1.087   5.226 -10.017
  101    HB3  SER  12           HB1      SER  12  -2.161   5.828 -11.277
  102    HG   SER  12           HG       SER  12  -0.318   7.283  -9.684
  103    H    LEU  13           HN       LEU  13  -2.424   4.033  -8.296
  104    HA   LEU  13           HA       LEU  13  -4.442   2.556  -9.558
  105    HB2  LEU  13           HB2      LEU  13  -2.596   1.479  -8.386
  106    HB3  LEU  13           HB1      LEU  13  -3.155   2.140  -6.849
  107    HG   LEU  13           HG       LEU  13  -5.299   0.899  -7.133
  108   HD11  LEU  13          HD11      LEU  13  -5.423   0.694  -9.524
  109   HD12  LEU  13          HD12      LEU  13  -5.263  -0.941  -8.882
  110   HD13  LEU  13          HD13      LEU  13  -3.866  -0.132  -9.593
  111   HD21  LEU  13          HD21      LEU  13  -2.752  -0.743  -7.267
  112   HD22  LEU  13          HD22      LEU  13  -4.318  -1.367  -6.747
  113   HD23  LEU  13          HD23      LEU  13  -3.516  -0.107  -5.810
  114    H    LYS  14           HN       LYS  14  -4.441   4.172  -6.386
  115    HA   LYS  14           HA       LYS  14  -7.006   3.419  -5.559
  116    HB2  LYS  14           HB2      LYS  14  -5.366   5.890  -4.979
  117    HB3  LYS  14           HB1      LYS  14  -6.905   5.555  -4.190
  118    HG2  LYS  14           HG2      LYS  14  -4.598   3.594  -4.192
  119    HG3  LYS  14           HG1      LYS  14  -4.840   4.789  -2.919
  120    HD2  LYS  14           HD2      LYS  14  -6.966   2.791  -3.735
  121    HD3  LYS  14           HD1      LYS  14  -5.819   2.503  -2.430
  122    HE2  LYS  14           HE2      LYS  14  -6.600   4.634  -1.355
  123    HE3  LYS  14           HE1      LYS  14  -7.844   4.751  -2.599
  124    HZ1  LYS  14           HZ1      LYS  14  -7.516   2.378  -0.855
  125    HZ2  LYS  14           HZ2      LYS  14  -8.822   2.743  -1.879
  126    HZ3  LYS  14           HZ3      LYS  14  -8.553   3.667  -0.479
  127    H    SER  15           HN       SER  15  -5.949   6.282  -7.387
  128    HA   SER  15           HA       SER  15  -8.442   7.539  -7.622
  129    HB2  SER  15           HB2      SER  15  -6.082   7.522  -9.518
  130    HB3  SER  15           HB1      SER  15  -7.463   8.605  -9.666
  131    HG   SER  15           HG       SER  15  -5.736   8.366  -7.420
  132    H    PHE  16           HN       PHE  16  -6.846   5.170  -9.747
  133    HA   PHE  16           HA       PHE  16  -8.814   5.032 -11.732
  134    HB2  PHE  16           HB2      PHE  16  -6.953   2.870 -10.714
  135    HB3  PHE  16           HB1      PHE  16  -7.891   2.766 -12.202
  136    HD1  PHE  16           HD1      PHE  16  -4.721   2.978 -11.481
  137    HD2  PHE  16           HD2      PHE  16  -7.683   5.587 -13.179
  138    HE1  PHE  16           HE1      PHE  16  -2.942   4.216 -12.684
  139    HE2  PHE  16           HE2      PHE  16  -5.902   6.823 -14.382
  140    HZ   PHE  16           HZ       PHE  16  -3.532   6.139 -14.134
  141    H    GLN  17           HN       GLN  17  -8.440   3.121  -8.757
  142    HA   GLN  17           HA       GLN  17 -10.634   1.418  -9.099
  143    HB2  GLN  17           HB2      GLN  17  -8.848   1.221  -7.333
  144    HB3  GLN  17           HB1      GLN  17  -9.653   2.525  -6.460
  145    HG2  GLN  17           HG2      GLN  17 -10.405   0.355  -5.603
  146    HG3  GLN  17           HG1      GLN  17 -11.737   1.183  -6.406
  147   HE21  GLN  17          HE21      GLN  17 -12.928  -0.297  -7.607
  148   HE22  GLN  17          HE22      GLN  17 -12.268  -1.574  -8.510
  149    H1   ALA   1           HT1      ALA   1 -12.114  -9.245  -4.840
  150    H2   ALA   1           HT2      ALA   1 -13.325  -9.404  -6.021
  151    H3   ALA   1           HT3      ALA   1 -13.612  -9.927  -4.431
  152    HA   ALA   1           HA       ALA   1 -14.565  -7.672  -5.222
  153    HB1  ALA   1           HB1      ALA   1 -14.821  -7.169  -2.997
  154    HB2  ALA   1           HB2      ALA   1 -13.109  -7.395  -2.641
  155    HB3  ALA   1           HB3      ALA   1 -14.168  -8.796  -2.801
  156    H    THR   2           HN       THR   2 -13.827  -5.342  -4.399
  157    HA   THR   2           HA       THR   2 -11.798  -4.479  -6.151
  158    HB   THR   2           HB       THR   2 -12.010  -2.306  -4.996
  159    HG1  THR   2           HG1      THR   2 -13.461  -2.222  -3.226
  160   HG21  THR   2          HG21      THR   2 -14.675  -3.699  -5.371
  161   HG22  THR   2          HG22      THR   2 -13.694  -3.038  -6.680
  162   HG23  THR   2          HG23      THR   2 -14.380  -1.963  -5.461
  163    H    LEU   3           HN       LEU   3 -11.766  -5.272  -2.714
  164    HA   LEU   3           HA       LEU   3  -9.247  -4.260  -2.030
  165    HB2  LEU   3           HB2      LEU   3 -10.711  -6.705  -1.007
  166    HB3  LEU   3           HB1      LEU   3  -9.286  -6.003  -0.240
  167    HG   LEU   3           HG       LEU   3 -11.837  -4.457  -0.776
  168   HD11  LEU   3          HD11      LEU   3 -12.320  -6.223   0.826
  169   HD12  LEU   3          HD12      LEU   3 -12.195  -4.692   1.693
  170   HD13  LEU   3          HD13      LEU   3 -10.859  -5.843   1.738
  171   HD21  LEU   3          HD21      LEU   3  -9.904  -3.013  -0.569
  172   HD22  LEU   3          HD22      LEU   3  -9.335  -3.904   0.842
  173   HD23  LEU   3          HD23      LEU   3 -10.799  -2.930   0.948
  174    H    GLU   4           HN       GLU   4 -10.154  -7.465  -3.285
  175    HA   GLU   4           HA       GLU   4  -7.605  -8.622  -3.262
  176    HB2  GLU   4           HB2      GLU   4 -10.014  -9.101  -5.013
  177    HB3  GLU   4           HB1      GLU   4  -8.537 -10.052  -5.163
  178    HG2  GLU   4           HG2      GLU   4  -9.822 -11.317  -3.657
  179    HG3  GLU   4           HG1      GLU   4  -8.761 -10.394  -2.595
  180    H    LYS   5           HN       LYS   5  -9.255  -6.796  -5.832
  181    HA   LYS   5           HA       LYS   5  -7.266  -6.994  -7.790
  182    HB2  LYS   5           HB2      LYS   5  -9.510  -6.123  -8.257
  183    HB3  LYS   5           HB1      LYS   5  -9.181  -4.709  -7.257
  184    HG2  LYS   5           HG2      LYS   5  -8.833  -4.123  -9.596
  185    HG3  LYS   5           HG1      LYS   5  -7.275  -4.136  -8.773
  186    HD2  LYS   5           HD2      LYS   5  -6.779  -6.355  -9.648
  187    HD3  LYS   5           HD1      LYS   5  -8.383  -6.461 -10.373
  188    HE2  LYS   5           HE2      LYS   5  -7.861  -4.526 -11.813
  189    HE3  LYS   5           HE1      LYS   5  -6.257  -4.420 -11.089
  190    HZ1  LYS   5           HZ1      LYS   5  -5.648  -6.484 -11.988
  191    HZ2  LYS   5           HZ2      LYS   5  -6.427  -5.663 -13.256
  192    HZ3  LYS   5           HZ3      LYS   5  -7.245  -6.882 -12.400
  193    H    LEU   6           HN       LEU   6  -7.742  -4.529  -5.266
  194    HA   LEU   6           HA       LEU   6  -5.597  -2.859  -5.941
  195    HB2  LEU   6           HB2      LEU   6  -7.503  -2.595  -4.158
  196    HB3  LEU   6           HB1      LEU   6  -6.327  -3.339  -3.073
  197    HG   LEU   6           HG       LEU   6  -5.599  -0.988  -4.822
  198   HD11  LEU   6          HD11      LEU   6  -7.493  -0.263  -3.473
  199   HD12  LEU   6          HD12      LEU   6  -6.016   0.427  -2.800
  200   HD13  LEU   6          HD13      LEU   6  -6.772  -0.966  -2.025
  201   HD21  LEU   6          HD21      LEU   6  -4.417  -2.440  -2.468
  202   HD22  LEU   6          HD22      LEU   6  -4.036  -0.735  -2.707
  203   HD23  LEU   6          HD23      LEU   6  -3.636  -1.910  -3.957
  204    H    MET   7           HN       MET   7  -5.715  -5.634  -3.718
  205    HA   MET   7           HA       MET   7  -3.065  -5.529  -2.823
  206    HB2  MET   7           HB2      MET   7  -5.072  -7.746  -3.102
  207    HB3  MET   7           HB1      MET   7  -3.423  -8.096  -2.581
  208    HG2  MET   7           HG2      MET   7  -4.912  -5.855  -1.259
  209    HG3  MET   7           HG1      MET   7  -5.279  -7.517  -0.793
  210    HE1  MET   7           HE1      MET   7  -3.521  -4.753   0.723
  211    HE2  MET   7           HE2      MET   7  -3.012  -4.637  -0.959
  212    HE3  MET   7           HE3      MET   7  -1.812  -4.912   0.300
  213    H    LYS   8           HN       LYS   8  -4.465  -7.266  -5.594
  214    HA   LYS   8           HA       LYS   8  -2.133  -8.531  -6.483
  215    HB2  LYS   8           HB2      LYS   8  -4.557  -7.539  -7.992
  216    HB3  LYS   8           HB1      LYS   8  -3.278  -8.497  -8.739
  217    HG2  LYS   8           HG2      LYS   8  -3.651 -10.291  -7.085
  218    HG3  LYS   8           HG1      LYS   8  -4.936  -9.337  -6.343
  219    HD2  LYS   8           HD2      LYS   8  -6.217  -9.389  -8.432
  220    HD3  LYS   8           HD1      LYS   8  -4.920 -10.283  -9.224
  221    HE2  LYS   8           HE2      LYS   8  -6.679 -11.832  -8.508
  222    HE3  LYS   8           HE1      LYS   8  -5.210 -12.121  -7.577
  223    HZ1  LYS   8           HZ1      LYS   8  -7.529 -11.858  -6.414
  224    HZ2  LYS   8           HZ2      LYS   8  -7.156 -10.205  -6.525
  225    HZ3  LYS   8           HZ3      LYS   8  -6.115 -11.260  -5.694
  226    H    ALA   9           HN       ALA   9  -3.483  -5.357  -7.361
  227    HA   ALA   9           HA       ALA   9  -1.554  -4.623  -9.252
  228    HB1  ALA   9           HB1      ALA   9  -3.512  -3.290  -9.096
  229    HB2  ALA   9           HB2      ALA   9  -2.189  -2.253  -8.563
  230    HB3  ALA   9           HB3      ALA   9  -3.261  -2.995  -7.376
  231    H    PHE  10           HN       PHE  10  -1.638  -4.056  -5.739
  232    HA   PHE  10           HA       PHE  10   0.738  -2.589  -5.529
  233    HB2  PHE  10           HB2      PHE  10  -0.912  -2.874  -3.688
  234    HB3  PHE  10           HB1      PHE  10  -0.361  -4.540  -3.494
  235    HD1  PHE  10           HD1      PHE  10   0.627  -0.983  -3.237
  236    HD2  PHE  10           HD2      PHE  10   1.772  -5.055  -2.491
  237    HE1  PHE  10           HE1      PHE  10   2.532  -0.195  -1.860
  238    HE2  PHE  10           HE2      PHE  10   3.676  -4.266  -1.112
  239    HZ   PHE  10           HZ       PHE  10   4.056  -1.836  -0.797
  240    H    GLU  11           HN       GLU  11   0.201  -6.101  -5.306
  241    HA   GLU  11           HA       GLU  11   2.838  -6.867  -4.762
  242    HB2  GLU  11           HB2      GLU  11   0.622  -8.286  -6.250
  243    HB3  GLU  11           HB1      GLU  11   2.157  -9.051  -5.840
  244    HG2  GLU  11           HG2      GLU  11   0.222  -7.815  -3.858
  245    HG3  GLU  11           HG1      GLU  11   0.438  -9.542  -4.137
  246    H    SER  12           HN       SER  12   1.178  -6.470  -7.886
  247    HA   SER  12           HA       SER  12   3.296  -7.250  -9.542
  248    HB2  SER  12           HB2      SER  12   2.163  -6.014 -11.318
  249    HB3  SER  12           HB1      SER  12   0.985  -6.895 -10.350
  250    HG   SER  12           HG       SER  12   0.332  -5.040  -9.439
  251    H    LEU  13           HN       LEU  13   2.424  -4.033  -8.296
  252    HA   LEU  13           HA       LEU  13   4.442  -2.556  -9.558
  253    HB2  LEU  13           HB2      LEU  13   2.596  -1.479  -8.386
  254    HB3  LEU  13           HB1      LEU  13   3.155  -2.140  -6.849
  255    HG   LEU  13           HG       LEU  13   5.299  -0.899  -7.133
  256   HD11  LEU  13          HD11      LEU  13   5.423  -0.693  -9.524
  257   HD12  LEU  13          HD12      LEU  13   5.262   0.941  -8.882
  258   HD13  LEU  13          HD13      LEU  13   3.866   0.132  -9.593
  259   HD21  LEU  13          HD21      LEU  13   2.753   0.743  -7.267
  260   HD22  LEU  13          HD22      LEU  13   4.318   1.366  -6.747
  261   HD23  LEU  13          HD23      LEU  13   3.516   0.107  -5.810
  262    H    LYS  14           HN       LYS  14   4.441  -4.172  -6.386
  263    HA   LYS  14           HA       LYS  14   7.006  -3.419  -5.559
  264    HB2  LYS  14           HB2      LYS  14   5.366  -5.890  -4.979
  265    HB3  LYS  14           HB1      LYS  14   6.905  -5.555  -4.190
  266    HG2  LYS  14           HG2      LYS  14   4.598  -3.594  -4.192
  267    HG3  LYS  14           HG1      LYS  14   4.840  -4.789  -2.919
  268    HD2  LYS  14           HD2      LYS  14   6.966  -2.791  -3.735
  269    HD3  LYS  14           HD1      LYS  14   5.819  -2.503  -2.430
  270    HE2  LYS  14           HE2      LYS  14   6.600  -4.634  -1.355
  271    HE3  LYS  14           HE1      LYS  14   7.844  -4.751  -2.599
  272    HZ1  LYS  14           HZ1      LYS  14   7.516  -2.378  -0.855
  273    HZ2  LYS  14           HZ2      LYS  14   8.822  -2.743  -1.879
  274    HZ3  LYS  14           HZ3      LYS  14   8.553  -3.667  -0.479
  275    H    SER  15           HN       SER  15   5.949  -6.282  -7.387
  276    HA   SER  15           HA       SER  15   8.448  -7.526  -7.617
  277    HB2  SER  15           HB2      SER  15   7.505  -8.726  -9.524
  278    HB3  SER  15           HB1      SER  15   6.315  -8.619  -8.231
  279    HG   SER  15           HG       SER  15   5.214  -7.125  -9.356
  280    H    PHE  16           HN       PHE  16   6.846  -5.170  -9.747
  281    HA   PHE  16           HA       PHE  16   8.815  -5.032 -11.732
  282    HB2  PHE  16           HB2      PHE  16   6.944  -2.879 -10.713
  283    HB3  PHE  16           HB1      PHE  16   7.885  -2.765 -12.199
  284    HD1  PHE  16           HD1      PHE  16   4.707  -3.045 -11.443
  285    HD2  PHE  16           HD2      PHE  16   7.712  -5.546 -13.223
  286    HE1  PHE  16           HE1      PHE  16   2.944  -4.307 -12.648
  287    HE2  PHE  16           HE2      PHE  16   5.949  -6.808 -14.426
  288    HZ   PHE  16           HZ       PHE  16   3.566  -6.189 -14.138
  289    H    GLN  17           HN       GLN  17   8.440  -3.121  -8.757
  290    HA   GLN  17           HA       GLN  17  10.634  -1.418  -9.099
  291    HB2  GLN  17           HB2      GLN  17   8.848  -1.221  -7.333
  292    HB3  GLN  17           HB1      GLN  17   9.653  -2.525  -6.460
  293    HG2  GLN  17           HG2      GLN  17  10.405  -0.355  -5.603
  294    HG3  GLN  17           HG1      GLN  17  11.737  -1.183  -6.406
  295   HE21  GLN  17          HE21      GLN  17  12.928   0.297  -7.607
  296   HE22  GLN  17          HE22      GLN  17  12.268   1.574  -8.510
  297    H1   ALA   1           HT1      ALA   1   9.245  12.114   4.840
  298    H2   ALA   1           HT2      ALA   1   9.404  13.325   6.021
  299    H3   ALA   1           HT3      ALA   1   9.927  13.612   4.431
  300    HA   ALA   1           HA       ALA   1   7.672  14.565   5.222
  301    HB1  ALA   1           HB1      ALA   1   7.169  14.821   2.997
  302    HB2  ALA   1           HB2      ALA   1   7.395  13.109   2.641
  303    HB3  ALA   1           HB3      ALA   1   8.796  14.168   2.801
  304    H    THR   2           HN       THR   2   5.342  13.827   4.399
  305    HA   THR   2           HA       THR   2   4.479  11.798   6.151
  306    HB   THR   2           HB       THR   2   2.306  12.010   4.996
  307    HG1  THR   2           HG1      THR   2   2.222  13.461   3.226
  308   HG21  THR   2          HG21      THR   2   3.699  14.675   5.371
  309   HG22  THR   2          HG22      THR   2   3.038  13.694   6.680
  310   HG23  THR   2          HG23      THR   2   1.963  14.380   5.461
  311    H    LEU   3           HN       LEU   3   5.272  11.766   2.714
  312    HA   LEU   3           HA       LEU   3   4.260   9.247   2.030
  313    HB2  LEU   3           HB2      LEU   3   6.705  10.711   1.007
  314    HB3  LEU   3           HB1      LEU   3   6.003   9.286   0.240
  315    HG   LEU   3           HG       LEU   3   4.457  11.837   0.776
  316   HD11  LEU   3          HD11      LEU   3   6.223  12.320  -0.826
  317   HD12  LEU   3          HD12      LEU   3   4.692  12.195  -1.693
  318   HD13  LEU   3          HD13      LEU   3   5.843  10.859  -1.738
  319   HD21  LEU   3          HD21      LEU   3   3.013   9.904   0.569
  320   HD22  LEU   3          HD22      LEU   3   3.904   9.335  -0.842
  321   HD23  LEU   3          HD23      LEU   3   2.930  10.799  -0.948
  322    H    GLU   4           HN       GLU   4   7.465  10.154   3.285
  323    HA   GLU   4           HA       GLU   4   8.622   7.605   3.262
  324    HB2  GLU   4           HB2      GLU   4   9.101  10.014   5.013
  325    HB3  GLU   4           HB1      GLU   4  10.052   8.537   5.163
  326    HG2  GLU   4           HG2      GLU   4  11.317   9.822   3.657
  327    HG3  GLU   4           HG1      GLU   4  10.394   8.761   2.595
  328    H    LYS   5           HN       LYS   5   6.796   9.255   5.832
  329    HA   LYS   5           HA       LYS   5   6.994   7.266   7.790
  330    HB2  LYS   5           HB2      LYS   5   6.123   9.510   8.257
  331    HB3  LYS   5           HB1      LYS   5   4.709   9.181   7.257
  332    HG2  LYS   5           HG2      LYS   5   4.123   8.833   9.596
  333    HG3  LYS   5           HG1      LYS   5   4.136   7.275   8.773
  334    HD2  LYS   5           HD2      LYS   5   6.355   6.779   9.648
  335    HD3  LYS   5           HD1      LYS   5   6.461   8.383  10.373
  336    HE2  LYS   5           HE2      LYS   5   4.526   7.861  11.813
  337    HE3  LYS   5           HE1      LYS   5   4.420   6.257  11.089
  338    HZ1  LYS   5           HZ1      LYS   5   6.484   5.648  11.988
  339    HZ2  LYS   5           HZ2      LYS   5   5.663   6.427  13.256
  340    HZ3  LYS   5           HZ3      LYS   5   6.882   7.245  12.400
  341    H    LEU   6           HN       LEU   6   4.529   7.742   5.266
  342    HA   LEU   6           HA       LEU   6   2.859   5.597   5.941
  343    HB2  LEU   6           HB2      LEU   6   2.595   7.503   4.158
  344    HB3  LEU   6           HB1      LEU   6   3.339   6.327   3.073
  345    HG   LEU   6           HG       LEU   6   0.988   5.599   4.822
  346   HD11  LEU   6          HD11      LEU   6   0.263   7.493   3.473
  347   HD12  LEU   6          HD12      LEU   6  -0.427   6.016   2.800
  348   HD13  LEU   6          HD13      LEU   6   0.966   6.772   2.025
  349   HD21  LEU   6          HD21      LEU   6   2.440   4.417   2.468
  350   HD22  LEU   6          HD22      LEU   6   0.735   4.036   2.707
  351   HD23  LEU   6          HD23      LEU   6   1.910   3.636   3.957
  352    H    MET   7           HN       MET   7   5.634   5.715   3.718
  353    HA   MET   7           HA       MET   7   5.529   3.065   2.823
  354    HB2  MET   7           HB2      MET   7   7.746   5.072   3.102
  355    HB3  MET   7           HB1      MET   7   8.096   3.423   2.581
  356    HG2  MET   7           HG2      MET   7   5.855   4.912   1.259
  357    HG3  MET   7           HG1      MET   7   7.517   5.279   0.793
  358    HE1  MET   7           HE1      MET   7   4.753   3.521  -0.723
  359    HE2  MET   7           HE2      MET   7   4.637   3.012   0.959
  360    HE3  MET   7           HE3      MET   7   4.912   1.812  -0.300
  361    H    LYS   8           HN       LYS   8   7.266   4.465   5.594
  362    HA   LYS   8           HA       LYS   8   8.531   2.133   6.483
  363    HB2  LYS   8           HB2      LYS   8   7.539   4.557   7.992
  364    HB3  LYS   8           HB1      LYS   8   8.497   3.278   8.739
  365    HG2  LYS   8           HG2      LYS   8  10.291   3.651   7.085
  366    HG3  LYS   8           HG1      LYS   8   9.337   4.936   6.343
  367    HD2  LYS   8           HD2      LYS   8   9.389   6.217   8.432
  368    HD3  LYS   8           HD1      LYS   8  10.283   4.920   9.224
  369    HE2  LYS   8           HE2      LYS   8  11.832   6.679   8.508
  370    HE3  LYS   8           HE1      LYS   8  12.121   5.210   7.577
  371    HZ1  LYS   8           HZ1      LYS   8  11.858   7.529   6.414
  372    HZ2  LYS   8           HZ2      LYS   8  10.205   7.156   6.525
  373    HZ3  LYS   8           HZ3      LYS   8  11.260   6.115   5.694
  374    H    ALA   9           HN       ALA   9   5.357   3.483   7.361
  375    HA   ALA   9           HA       ALA   9   4.623   1.553   9.252
  376    HB1  ALA   9           HB1      ALA   9   3.290   3.511   9.096
  377    HB2  ALA   9           HB2      ALA   9   2.253   2.189   8.563
  378    HB3  ALA   9           HB3      ALA   9   2.995   3.261   7.376
  379    H    PHE  10           HN       PHE  10   4.056   1.638   5.739
  380    HA   PHE  10           HA       PHE  10   2.589  -0.738   5.529
  381    HB2  PHE  10           HB2      PHE  10   2.874   0.912   3.688
  382    HB3  PHE  10           HB1      PHE  10   4.540   0.361   3.494
  383    HD1  PHE  10           HD1      PHE  10   0.983  -0.627   3.237
  384    HD2  PHE  10           HD2      PHE  10   5.055  -1.772   2.491
  385    HE1  PHE  10           HE1      PHE  10   0.195  -2.532   1.860
  386    HE2  PHE  10           HE2      PHE  10   4.266  -3.676   1.112
  387    HZ   PHE  10           HZ       PHE  10   1.836  -4.056   0.797
  388    H    GLU  11           HN       GLU  11   6.101  -0.201   5.306
  389    HA   GLU  11           HA       GLU  11   6.867  -2.838   4.762
  390    HB2  GLU  11           HB2      GLU  11   8.286  -0.622   6.250
  391    HB3  GLU  11           HB1      GLU  11   9.051  -2.157   5.840
  392    HG2  GLU  11           HG2      GLU  11   7.815  -0.222   3.858
  393    HG3  GLU  11           HG1      GLU  11   9.542  -0.438   4.137
  394    H    SER  12           HN       SER  12   6.470  -1.178   7.886
  395    HA   SER  12           HA       SER  12   7.251  -3.289   9.553
  396    HB2  SER  12           HB2      SER  12   5.226  -1.087  10.017
  397    HB3  SER  12           HB1      SER  12   5.828  -2.160  11.277
  398    HG   SER  12           HG       SER  12   7.596  -1.033  11.334
  399    H    LEU  13           HN       LEU  13   4.033  -2.424   8.296
  400    HA   LEU  13           HA       LEU  13   2.556  -4.442   9.558
  401    HB2  LEU  13           HB2      LEU  13   1.479  -2.596   8.386
  402    HB3  LEU  13           HB1      LEU  13   2.139  -3.155   6.849
  403    HG   LEU  13           HG       LEU  13   0.898  -5.299   7.133
  404   HD11  LEU  13          HD11      LEU  13   0.694  -5.423   9.524
  405   HD12  LEU  13          HD12      LEU  13  -0.941  -5.263   8.882
  406   HD13  LEU  13          HD13      LEU  13  -0.132  -3.867   9.594
  407   HD21  LEU  13          HD21      LEU  13  -0.743  -2.752   7.267
  408   HD22  LEU  13          HD22      LEU  13  -1.367  -4.318   6.747
  409   HD23  LEU  13          HD23      LEU  13  -0.107  -3.515   5.810
  410    H    LYS  14           HN       LYS  14   4.172  -4.441   6.386
  411    HA   LYS  14           HA       LYS  14   3.419  -7.006   5.559
  412    HB2  LYS  14           HB2      LYS  14   5.890  -5.366   4.979
  413    HB3  LYS  14           HB1      LYS  14   5.555  -6.905   4.190
  414    HG2  LYS  14           HG2      LYS  14   3.594  -4.598   4.192
  415    HG3  LYS  14           HG1      LYS  14   4.789  -4.840   2.919
  416    HD2  LYS  14           HD2      LYS  14   2.791  -6.966   3.735
  417    HD3  LYS  14           HD1      LYS  14   2.503  -5.819   2.430
  418    HE2  LYS  14           HE2      LYS  14   4.634  -6.600   1.355
  419    HE3  LYS  14           HE1      LYS  14   4.751  -7.844   2.599
  420    HZ1  LYS  14           HZ1      LYS  14   2.378  -7.516   0.855
  421    HZ2  LYS  14           HZ2      LYS  14   2.743  -8.822   1.879
  422    HZ3  LYS  14           HZ3      LYS  14   3.667  -8.553   0.479
  423    H    SER  15           HN       SER  15   6.282  -5.949   7.387
  424    HA   SER  15           HA       SER  15   7.539  -8.442   7.622
  425    HB2  SER  15           HB2      SER  15   8.639  -6.338   8.250
  426    HB3  SER  15           HB1      SER  15   7.512  -6.137   9.589
  427    HG   SER  15           HG       SER  15   9.747  -7.680   9.392
  428    H    PHE  16           HN       PHE  16   5.170  -6.846   9.747
  429    HA   PHE  16           HA       PHE  16   5.031  -8.813  11.733
  430    HB2  PHE  16           HB2      PHE  16   2.879  -6.946  10.707
  431    HB3  PHE  16           HB1      PHE  16   2.754  -7.895  12.187
  432    HD1  PHE  16           HD1      PHE  16   2.988  -4.721  11.485
  433    HD2  PHE  16           HD2      PHE  16   5.556  -7.703  13.207
  434    HE1  PHE  16           HE1      PHE  16   4.213  -2.953  12.719
  435    HE2  PHE  16           HE2      PHE  16   6.780  -5.935  14.441
  436    HZ   PHE  16           HZ       PHE  16   6.110  -3.560  14.197
  437    H    GLN  17           HN       GLN  17   3.121  -8.440   8.757
  438    HA   GLN  17           HA       GLN  17   1.418 -10.634   9.099
  439    HB2  GLN  17           HB2      GLN  17   1.221  -8.848   7.333
  440    HB3  GLN  17           HB1      GLN  17   2.525  -9.653   6.460
  441    HG2  GLN  17           HG2      GLN  17   0.355 -10.405   5.603
  442    HG3  GLN  17           HG1      GLN  17   1.183 -11.737   6.406
  443   HE21  GLN  17          HE21      GLN  17  -0.297 -12.928   7.607
  444   HE22  GLN  17          HE22      GLN  17  -1.574 -12.268   8.510
  445    H1   ALA   1           HT1      ALA   1  -9.245 -12.114   4.840
  446    H2   ALA   1           HT2      ALA   1  -9.404 -13.325   6.021
  447    H3   ALA   1           HT3      ALA   1  -9.927 -13.612   4.431
  448    HA   ALA   1           HA       ALA   1  -7.672 -14.565   5.222
  449    HB1  ALA   1           HB1      ALA   1  -7.169 -14.821   2.997
  450    HB2  ALA   1           HB2      ALA   1  -7.395 -13.109   2.641
  451    HB3  ALA   1           HB3      ALA   1  -8.796 -14.168   2.801
  452    H    THR   2           HN       THR   2  -5.342 -13.827   4.399
  453    HA   THR   2           HA       THR   2  -4.479 -11.798   6.151
  454    HB   THR   2           HB       THR   2  -2.306 -12.010   4.996
  455    HG1  THR   2           HG1      THR   2  -2.222 -13.461   3.226
  456   HG21  THR   2          HG21      THR   2  -3.699 -14.675   5.371
  457   HG22  THR   2          HG22      THR   2  -3.038 -13.694   6.680
  458   HG23  THR   2          HG23      THR   2  -1.963 -14.380   5.461
  459    H    LEU   3           HN       LEU   3  -5.272 -11.766   2.714
  460    HA   LEU   3           HA       LEU   3  -4.260  -9.247   2.030
  461    HB2  LEU   3           HB2      LEU   3  -6.705 -10.711   1.007
  462    HB3  LEU   3           HB1      LEU   3  -6.003  -9.286   0.240
  463    HG   LEU   3           HG       LEU   3  -4.457 -11.837   0.776
  464   HD11  LEU   3          HD11      LEU   3  -6.223 -12.320  -0.826
  465   HD12  LEU   3          HD12      LEU   3  -4.692 -12.195  -1.693
  466   HD13  LEU   3          HD13      LEU   3  -5.843 -10.859  -1.738
  467   HD21  LEU   3          HD21      LEU   3  -3.013  -9.904   0.569
  468   HD22  LEU   3          HD22      LEU   3  -3.904  -9.335  -0.842
  469   HD23  LEU   3          HD23      LEU   3  -2.930 -10.799  -0.948
  470    H    GLU   4           HN       GLU   4  -7.465 -10.154   3.285
  471    HA   GLU   4           HA       GLU   4  -8.622  -7.605   3.262
  472    HB2  GLU   4           HB2      GLU   4  -9.101 -10.014   5.013
  473    HB3  GLU   4           HB1      GLU   4 -10.052  -8.537   5.163
  474    HG2  GLU   4           HG2      GLU   4 -11.317  -9.822   3.657
  475    HG3  GLU   4           HG1      GLU   4 -10.394  -8.761   2.595
  476    H    LYS   5           HN       LYS   5  -6.796  -9.255   5.832
  477    HA   LYS   5           HA       LYS   5  -6.994  -7.266   7.790
  478    HB2  LYS   5           HB2      LYS   5  -6.123  -9.510   8.257
  479    HB3  LYS   5           HB1      LYS   5  -4.709  -9.181   7.257
  480    HG2  LYS   5           HG2      LYS   5  -4.123  -8.833   9.596
  481    HG3  LYS   5           HG1      LYS   5  -4.136  -7.275   8.773
  482    HD2  LYS   5           HD2      LYS   5  -6.355  -6.779   9.648
  483    HD3  LYS   5           HD1      LYS   5  -6.461  -8.383  10.373
  484    HE2  LYS   5           HE2      LYS   5  -4.526  -7.861  11.813
  485    HE3  LYS   5           HE1      LYS   5  -4.420  -6.257  11.089
  486    HZ1  LYS   5           HZ1      LYS   5  -6.484  -5.648  11.988
  487    HZ2  LYS   5           HZ2      LYS   5  -5.663  -6.427  13.256
  488    HZ3  LYS   5           HZ3      LYS   5  -6.882  -7.245  12.400
  489    H    LEU   6           HN       LEU   6  -4.529  -7.742   5.266
  490    HA   LEU   6           HA       LEU   6  -2.859  -5.597   5.941
  491    HB2  LEU   6           HB2      LEU   6  -2.595  -7.503   4.158
  492    HB3  LEU   6           HB1      LEU   6  -3.339  -6.327   3.073
  493    HG   LEU   6           HG       LEU   6  -0.988  -5.599   4.822
  494   HD11  LEU   6          HD11      LEU   6  -0.263  -7.493   3.473
  495   HD12  LEU   6          HD12      LEU   6   0.427  -6.016   2.800
  496   HD13  LEU   6          HD13      LEU   6  -0.966  -6.772   2.025
  497   HD21  LEU   6          HD21      LEU   6  -2.440  -4.417   2.468
  498   HD22  LEU   6          HD22      LEU   6  -0.735  -4.036   2.707
  499   HD23  LEU   6          HD23      LEU   6  -1.910  -3.636   3.957
  500    H    MET   7           HN       MET   7  -5.634  -5.715   3.718
  501    HA   MET   7           HA       MET   7  -5.529  -3.065   2.823
  502    HB2  MET   7           HB2      MET   7  -7.746  -5.072   3.102
  503    HB3  MET   7           HB1      MET   7  -8.096  -3.423   2.581
  504    HG2  MET   7           HG2      MET   7  -5.855  -4.912   1.259
  505    HG3  MET   7           HG1      MET   7  -7.517  -5.279   0.793
  506    HE1  MET   7           HE1      MET   7  -4.753  -3.521  -0.723
  507    HE2  MET   7           HE2      MET   7  -4.637  -3.012   0.959
  508    HE3  MET   7           HE3      MET   7  -4.912  -1.812  -0.300
  509    H    LYS   8           HN       LYS   8  -7.266  -4.465   5.594
  510    HA   LYS   8           HA       LYS   8  -8.531  -2.133   6.483
  511    HB2  LYS   8           HB2      LYS   8  -7.539  -4.557   7.992
  512    HB3  LYS   8           HB1      LYS   8  -8.497  -3.278   8.739
  513    HG2  LYS   8           HG2      LYS   8 -10.291  -3.651   7.085
  514    HG3  LYS   8           HG1      LYS   8  -9.337  -4.936   6.343
  515    HD2  LYS   8           HD2      LYS   8  -9.389  -6.217   8.432
  516    HD3  LYS   8           HD1      LYS   8 -10.283  -4.920   9.224
  517    HE2  LYS   8           HE2      LYS   8 -11.832  -6.679   8.508
  518    HE3  LYS   8           HE1      LYS   8 -12.121  -5.210   7.577
  519    HZ1  LYS   8           HZ1      LYS   8 -11.858  -7.529   6.414
  520    HZ2  LYS   8           HZ2      LYS   8 -10.205  -7.156   6.525
  521    HZ3  LYS   8           HZ3      LYS   8 -11.260  -6.115   5.694
  522    H    ALA   9           HN       ALA   9  -5.357  -3.483   7.361
  523    HA   ALA   9           HA       ALA   9  -4.623  -1.553   9.252
  524    HB1  ALA   9           HB1      ALA   9  -3.290  -3.511   9.096
  525    HB2  ALA   9           HB2      ALA   9  -2.253  -2.189   8.563
  526    HB3  ALA   9           HB3      ALA   9  -2.995  -3.261   7.376
  527    H    PHE  10           HN       PHE  10  -4.056  -1.638   5.739
  528    HA   PHE  10           HA       PHE  10  -2.589   0.738   5.529
  529    HB2  PHE  10           HB2      PHE  10  -2.874  -0.912   3.688
  530    HB3  PHE  10           HB1      PHE  10  -4.540  -0.361   3.494
  531    HD1  PHE  10           HD1      PHE  10  -0.983   0.627   3.237
  532    HD2  PHE  10           HD2      PHE  10  -5.055   1.772   2.491
  533    HE1  PHE  10           HE1      PHE  10  -0.195   2.532   1.860
  534    HE2  PHE  10           HE2      PHE  10  -4.266   3.676   1.112
  535    HZ   PHE  10           HZ       PHE  10  -1.836   4.056   0.797
  536    H    GLU  11           HN       GLU  11  -6.101   0.201   5.306
  537    HA   GLU  11           HA       GLU  11  -6.867   2.838   4.762
  538    HB2  GLU  11           HB2      GLU  11  -8.286   0.622   6.250
  539    HB3  GLU  11           HB1      GLU  11  -9.051   2.157   5.840
  540    HG2  GLU  11           HG2      GLU  11  -7.815   0.222   3.858
  541    HG3  GLU  11           HG1      GLU  11  -9.542   0.438   4.137
  542    H    SER  12           HN       SER  12  -6.470   1.178   7.886
  543    HA   SER  12           HA       SER  12  -7.251   3.289   9.553
  544    HB2  SER  12           HB2      SER  12  -6.894   1.005  10.383
  545    HB3  SER  12           HB1      SER  12  -5.169   1.145  10.056
  546    HG   SER  12           HG       SER  12  -5.226   2.994  11.506
  547    H    LEU  13           HN       LEU  13  -4.033   2.424   8.296
  548    HA   LEU  13           HA       LEU  13  -2.556   4.442   9.558
  549    HB2  LEU  13           HB2      LEU  13  -1.479   2.596   8.386
  550    HB3  LEU  13           HB1      LEU  13  -2.140   3.155   6.849
  551    HG   LEU  13           HG       LEU  13  -0.899   5.299   7.133
  552   HD11  LEU  13          HD11      LEU  13  -0.693   5.423   9.524
  553   HD12  LEU  13          HD12      LEU  13   0.941   5.262   8.882
  554   HD13  LEU  13          HD13      LEU  13   0.132   3.866   9.593
  555   HD21  LEU  13          HD21      LEU  13   0.743   2.753   7.267
  556   HD22  LEU  13          HD22      LEU  13   1.366   4.318   6.747
  557   HD23  LEU  13          HD23      LEU  13   0.107   3.516   5.810
  558    H    LYS  14           HN       LYS  14  -4.172   4.441   6.386
  559    HA   LYS  14           HA       LYS  14  -3.419   7.006   5.559
  560    HB2  LYS  14           HB2      LYS  14  -5.890   5.366   4.979
  561    HB3  LYS  14           HB1      LYS  14  -5.555   6.905   4.190
  562    HG2  LYS  14           HG2      LYS  14  -3.594   4.598   4.192
  563    HG3  LYS  14           HG1      LYS  14  -4.789   4.840   2.919
  564    HD2  LYS  14           HD2      LYS  14  -2.791   6.966   3.735
  565    HD3  LYS  14           HD1      LYS  14  -2.503   5.819   2.430
  566    HE2  LYS  14           HE2      LYS  14  -4.634   6.600   1.355
  567    HE3  LYS  14           HE1      LYS  14  -4.751   7.844   2.599
  568    HZ1  LYS  14           HZ1      LYS  14  -2.378   7.516   0.855
  569    HZ2  LYS  14           HZ2      LYS  14  -2.743   8.822   1.879
  570    HZ3  LYS  14           HZ3      LYS  14  -3.667   8.553   0.479
  571    H    SER  15           HN       SER  15  -6.282   5.949   7.387
  572    HA   SER  15           HA       SER  15  -7.527   8.448   7.617
  573    HB2  SER  15           HB2      SER  15  -8.727   7.502   9.524
  574    HB3  SER  15           HB1      SER  15  -8.619   6.312   8.232
  575    HG   SER  15           HG       SER  15  -7.253   6.448  10.685
  576    H    PHE  16           HN       PHE  16  -5.170   6.846   9.747
  577    HA   PHE  16           HA       PHE  16  -5.033   8.812  11.734
  578    HB2  PHE  16           HB2      PHE  16  -4.007   6.620  12.019
  579    HB3  PHE  16           HB1      PHE  16  -2.868   6.956  10.715
  580    HD1  PHE  16           HD1      PHE  16  -3.973   8.108  14.085
  581    HD2  PHE  16           HD2      PHE  16  -0.868   8.165  11.118
  582    HE1  PHE  16           HE1      PHE  16  -2.449   9.211  15.701
  583    HE2  PHE  16           HE2      PHE  16   0.657   9.267  12.734
  584    HZ   PHE  16           HZ       PHE  16  -0.134   9.790  15.026
  585    H    GLN  17           HN       GLN  17  -3.121   8.440   8.757
  586    HA   GLN  17           HA       GLN  17  -1.418  10.634   9.099
  587    HB2  GLN  17           HB2      GLN  17  -1.221   8.848   7.333
  588    HB3  GLN  17           HB1      GLN  17  -2.525   9.653   6.460
  589    HG2  GLN  17           HG2      GLN  17  -0.355  10.405   5.603
  590    HG3  GLN  17           HG1      GLN  17  -1.183  11.737   6.406
  591   HE21  GLN  17          HE21      GLN  17   0.297  12.928   7.607
  592   HE22  GLN  17          HE22      GLN  17   1.574  12.268   8.510
  Start of MODEL    7
    1    H1   ALA   1           HT1      ALA   1  14.788   6.889  -5.608
    2    H2   ALA   1           HT2      ALA   1  14.933   7.083  -3.927
    3    H3   ALA   1           HT3      ALA   1  15.374   8.348  -4.972
    4    HA   ALA   1           HA       ALA   1  13.127   8.492  -3.776
    5    HB1  ALA   1           HB1      ALA   1  12.136   9.561  -5.797
    6    HB2  ALA   1           HB2      ALA   1  13.412   8.837  -6.776
    7    HB3  ALA   1           HB3      ALA   1  13.817  10.033  -5.545
    8    H    THR   2           HN       THR   2  13.488   5.658  -4.084
    9    HA   THR   2           HA       THR   2  11.578   4.533  -5.860
   10    HB   THR   2           HB       THR   2  11.836   2.496  -4.485
   11    HG1  THR   2           HG1      THR   2  12.719   2.590  -2.557
   12   HG21  THR   2          HG21      THR   2  14.255   2.224  -4.825
   13   HG22  THR   2          HG22      THR   2  14.437   3.971  -4.984
   14   HG23  THR   2          HG23      THR   2  13.529   3.066  -6.194
   15    H    LEU   3           HN       LEU   3  11.437   5.555  -2.473
   16    HA   LEU   3           HA       LEU   3   8.902   4.556  -1.826
   17    HB2  LEU   3           HB2      LEU   3  10.518   6.893  -0.840
   18    HB3  LEU   3           HB1      LEU   3   8.886   6.607  -0.233
   19    HG   LEU   3           HG       LEU   3   9.645   4.200   0.220
   20   HD11  LEU   3          HD11      LEU   3  12.179   4.106   0.625
   21   HD12  LEU   3          HD12      LEU   3  12.282   5.551  -0.381
   22   HD13  LEU   3          HD13      LEU   3  11.649   4.049  -1.055
   23   HD21  LEU   3          HD21      LEU   3   9.323   5.678   2.078
   24   HD22  LEU   3          HD22      LEU   3  10.786   6.586   1.695
   25   HD23  LEU   3          HD23      LEU   3  10.907   4.939   2.316
   26    H    GLU   4           HN       GLU   4   9.830   7.705  -3.203
   27    HA   GLU   4           HA       GLU   4   7.281   8.851  -3.319
   28    HB2  GLU   4           HB2      GLU   4   9.362  10.109  -3.723
   29    HB3  GLU   4           HB1      GLU   4   9.590   9.237  -5.239
   30    HG2  GLU   4           HG2      GLU   4   7.466  10.130  -6.092
   31    HG3  GLU   4           HG1      GLU   4   7.197  10.974  -4.569
   32    H    LYS   5           HN       LYS   5   9.018   6.905  -5.741
   33    HA   LYS   5           HA       LYS   5   7.090   6.991  -7.768
   34    HB2  LYS   5           HB2      LYS   5   9.352   6.117  -8.126
   35    HB3  LYS   5           HB1      LYS   5   9.004   4.751  -7.066
   36    HG2  LYS   5           HG2      LYS   5   8.733   4.054  -9.388
   37    HG3  LYS   5           HG1      LYS   5   7.155   4.078  -8.604
   38    HD2  LYS   5           HD2      LYS   5   6.626   6.225  -9.603
   39    HD3  LYS   5           HD1      LYS   5   8.258   6.365 -10.260
   40    HE2  LYS   5           HE2      LYS   5   6.266   4.197 -10.989
   41    HE3  LYS   5           HE1      LYS   5   6.641   5.606 -11.981
   42    HZ1  LYS   5           HZ1      LYS   5   8.370   3.317 -11.297
   43    HZ2  LYS   5           HZ2      LYS   5   9.046   4.802 -11.768
   44    HZ3  LYS   5           HZ3      LYS   5   8.014   3.962 -12.824
   45    H    LEU   6           HN       LEU   6   7.501   4.658  -5.113
   46    HA   LEU   6           HA       LEU   6   5.390   2.939  -5.771
   47    HB2  LEU   6           HB2      LEU   6   7.047   2.374  -4.067
   48    HB3  LEU   6           HB1      LEU   6   6.462   3.682  -3.039
   49    HG   LEU   6           HG       LEU   6   4.370   1.815  -3.967
   50   HD11  LEU   6          HD11      LEU   6   6.405   0.345  -3.537
   51   HD12  LEU   6          HD12      LEU   6   4.991  -0.012  -2.545
   52   HD13  LEU   6          HD13      LEU   6   6.341   0.895  -1.862
   53   HD21  LEU   6          HD21      LEU   6   3.853   1.976  -1.468
   54   HD22  LEU   6          HD22      LEU   6   3.796   3.496  -2.359
   55   HD23  LEU   6          HD23      LEU   6   5.197   3.113  -1.359
   56    H    MET   7           HN       MET   7   5.419   5.822  -3.686
   57    HA   MET   7           HA       MET   7   2.742   5.743  -2.869
   58    HB2  MET   7           HB2      MET   7   4.418   7.256  -1.882
   59    HB3  MET   7           HB1      MET   7   4.464   8.180  -3.384
   60    HG2  MET   7           HG2      MET   7   2.971   9.304  -1.826
   61    HG3  MET   7           HG1      MET   7   2.009   8.615  -3.132
   62    HE1  MET   7           HE1      MET   7  -0.193   8.709  -1.831
   63    HE2  MET   7           HE2      MET   7   0.700   9.550  -0.566
   64    HE3  MET   7           HE3      MET   7  -0.373   8.219  -0.141
   65    H    LYS   8           HN       LYS   8   4.221   7.349  -5.680
   66    HA   LYS   8           HA       LYS   8   1.910   8.552  -6.703
   67    HB2  LYS   8           HB2      LYS   8   4.387   7.509  -8.084
   68    HB3  LYS   8           HB1      LYS   8   3.123   8.412  -8.920
   69    HG2  LYS   8           HG2      LYS   8   3.418  10.250  -7.223
   70    HG3  LYS   8           HG1      LYS   8   4.813   9.371  -6.595
   71    HD2  LYS   8           HD2      LYS   8   4.527  10.221  -9.490
   72    HD3  LYS   8           HD1      LYS   8   5.402  11.156  -8.276
   73    HE2  LYS   8           HE2      LYS   8   6.860   9.188  -7.846
   74    HE3  LYS   8           HE1      LYS   8   6.019   8.310  -9.123
   75    HZ1  LYS   8           HZ1      LYS   8   8.083   9.352  -9.895
   76    HZ2  LYS   8           HZ2      LYS   8   7.457  10.880  -9.496
   77    HZ3  LYS   8           HZ3      LYS   8   6.722   9.949 -10.713
   78    H    ALA   9           HN       ALA   9   3.308   5.348  -7.381
   79    HA   ALA   9           HA       ALA   9   1.444   4.505  -9.294
   80    HB1  ALA   9           HB1      ALA   9   3.386   3.181  -9.024
   81    HB2  ALA   9           HB2      ALA   9   2.064   2.173  -8.433
   82    HB3  ALA   9           HB3      ALA   9   3.120   3.004  -7.290
   83    H    PHE  10           HN       PHE  10   1.418   4.115  -5.757
   84    HA   PHE  10           HA       PHE  10  -0.954   2.643  -5.548
   85    HB2  PHE  10           HB2      PHE  10   0.560   2.958  -3.648
   86    HB3  PHE  10           HB1      PHE  10   0.171   4.679  -3.609
   87    HD1  PHE  10           HD1      PHE  10  -1.292   1.270  -3.270
   88    HD2  PHE  10           HD2      PHE  10  -1.807   5.474  -2.551
   89    HE1  PHE  10           HE1      PHE  10  -3.298   0.789  -1.895
   90    HE2  PHE  10           HE2      PHE  10  -3.812   4.992  -1.174
   91    HZ   PHE  10           HZ       PHE  10  -4.558   2.649  -0.847
   92    H    GLU  11           HN       GLU  11  -0.445   6.164  -5.484
   93    HA   GLU  11           HA       GLU  11  -3.103   6.938  -5.063
   94    HB2  GLU  11           HB2      GLU  11  -0.840   8.295  -6.536
   95    HB3  GLU  11           HB1      GLU  11  -2.397   9.068  -6.237
   96    HG2  GLU  11           HG2      GLU  11  -2.116   8.849  -3.842
   97    HG3  GLU  11           HG1      GLU  11  -0.652   7.891  -4.059
   98    H    SER  12           HN       SER  12  -1.340   6.399  -8.109
   99    HA   SER  12           HA       SER  12  -3.400   7.082  -9.880
  100    HB2  SER  12           HB2      SER  12  -1.174   5.052 -10.172
  101    HB3  SER  12           HB1      SER  12  -2.209   5.584 -11.495
  102    HG   SER  12           HG       SER  12  -1.508   7.764 -10.898
  103    H    LEU  13           HN       LEU  13  -2.559   3.935  -8.438
  104    HA   LEU  13           HA       LEU  13  -4.526   2.384  -9.689
  105    HB2  LEU  13           HB2      LEU  13  -2.707   1.383  -8.407
  106    HB3  LEU  13           HB1      LEU  13  -3.328   2.103  -6.921
  107    HG   LEU  13           HG       LEU  13  -5.442   0.825  -7.214
  108   HD11  LEU  13          HD11      LEU  13  -3.944  -0.260  -9.610
  109   HD12  LEU  13          HD12      LEU  13  -5.521   0.528  -9.591
  110   HD13  LEU  13          HD13      LEU  13  -5.332  -1.082  -8.897
  111   HD21  LEU  13          HD21      LEU  13  -2.830  -0.704  -7.163
  112   HD22  LEU  13          HD22      LEU  13  -4.388  -1.463  -6.836
  113   HD23  LEU  13          HD23      LEU  13  -3.798  -0.175  -5.787
  114    H    LYS  14           HN       LYS  14  -4.636   4.154  -6.603
  115    HA   LYS  14           HA       LYS  14  -7.221   3.423  -5.820
  116    HB2  LYS  14           HB2      LYS  14  -5.636   4.586  -4.341
  117    HB3  LYS  14           HB1      LYS  14  -5.777   6.039  -5.329
  118    HG2  LYS  14           HG2      LYS  14  -7.246   6.278  -3.413
  119    HG3  LYS  14           HG1      LYS  14  -8.244   6.051  -4.849
  120    HD2  LYS  14           HD2      LYS  14  -8.563   3.698  -4.318
  121    HD3  LYS  14           HD1      LYS  14  -7.444   3.818  -2.960
  122    HE2  LYS  14           HE2      LYS  14  -8.948   5.443  -1.864
  123    HE3  LYS  14           HE1      LYS  14 -10.070   5.315  -3.220
  124    HZ1  LYS  14           HZ1      LYS  14 -10.521   3.082  -2.713
  125    HZ2  LYS  14           HZ2      LYS  14 -10.567   3.892  -1.220
  126    HZ3  LYS  14           HZ3      LYS  14  -9.210   2.961  -1.643
  127    H    SER  15           HN       SER  15  -6.124   6.201  -7.754
  128    HA   SER  15           HA       SER  15  -8.616   7.425  -8.131
  129    HB2  SER  15           HB2      SER  15  -6.197   7.331  -9.948
  130    HB3  SER  15           HB1      SER  15  -7.579   8.395 -10.194
  131    HG   SER  15           HG       SER  15  -6.896   9.620  -8.622
  132    H    PHE  16           HN       PHE  16  -6.938   4.968 -10.084
  133    HA   PHE  16           HA       PHE  16  -8.841   4.720 -12.120
  134    HB2  PHE  16           HB2      PHE  16  -6.738   2.916 -10.991
  135    HB3  PHE  16           HB1      PHE  16  -7.910   2.251 -12.129
  136    HD1  PHE  16           HD1      PHE  16  -4.839   4.011 -11.817
  137    HD2  PHE  16           HD2      PHE  16  -8.322   3.666 -14.307
  138    HE1  PHE  16           HE1      PHE  16  -3.591   5.026 -13.704
  139    HE2  PHE  16           HE2      PHE  16  -7.074   4.681 -16.194
  140    HZ   PHE  16           HZ       PHE  16  -4.708   5.361 -15.893
  141    H    GLN  17           HN       GLN  17  -8.550   2.958  -9.044
  142    HA   GLN  17           HA       GLN  17 -10.723   1.221  -9.370
  143    HB2  GLN  17           HB2      GLN  17  -9.089   0.980  -7.557
  144    HB3  GLN  17           HB1      GLN  17  -9.665   2.479  -6.826
  145    HG2  GLN  17           HG2      GLN  17 -11.894   1.496  -6.521
  146    HG3  GLN  17           HG1      GLN  17 -11.356   0.006  -7.293
  147   HE21  GLN  17          HE21      GLN  17 -12.329  -0.127  -4.659
  148   HE22  GLN  17          HE22      GLN  17 -11.042  -0.443  -3.598
  149    H1   ALA   1           HT1      ALA   1 -14.788  -6.889  -5.608
  150    H2   ALA   1           HT2      ALA   1 -14.933  -7.083  -3.927
  151    H3   ALA   1           HT3      ALA   1 -15.374  -8.348  -4.972
  152    HA   ALA   1           HA       ALA   1 -13.127  -8.492  -3.776
  153    HB1  ALA   1           HB1      ALA   1 -12.136  -9.561  -5.797
  154    HB2  ALA   1           HB2      ALA   1 -13.412  -8.837  -6.776
  155    HB3  ALA   1           HB3      ALA   1 -13.817 -10.033  -5.545
  156    H    THR   2           HN       THR   2 -13.488  -5.658  -4.084
  157    HA   THR   2           HA       THR   2 -11.578  -4.533  -5.860
  158    HB   THR   2           HB       THR   2 -11.836  -2.496  -4.485
  159    HG1  THR   2           HG1      THR   2 -12.719  -2.590  -2.557
  160   HG21  THR   2          HG21      THR   2 -14.255  -2.224  -4.826
  161   HG22  THR   2          HG22      THR   2 -14.437  -3.971  -4.984
  162   HG23  THR   2          HG23      THR   2 -13.528  -3.065  -6.194
  163    H    LEU   3           HN       LEU   3 -11.437  -5.555  -2.473
  164    HA   LEU   3           HA       LEU   3  -8.902  -4.556  -1.826
  165    HB2  LEU   3           HB2      LEU   3 -10.518  -6.893  -0.840
  166    HB3  LEU   3           HB1      LEU   3  -8.886  -6.607  -0.233
  167    HG   LEU   3           HG       LEU   3  -9.645  -4.200   0.220
  168   HD11  LEU   3          HD11      LEU   3 -12.179  -4.106   0.625
  169   HD12  LEU   3          HD12      LEU   3 -12.282  -5.550  -0.381
  170   HD13  LEU   3          HD13      LEU   3 -11.649  -4.049  -1.055
  171   HD21  LEU   3          HD21      LEU   3  -9.323  -5.678   2.078
  172   HD22  LEU   3          HD22      LEU   3 -10.786  -6.586   1.695
  173   HD23  LEU   3          HD23      LEU   3 -10.907  -4.939   2.316
  174    H    GLU   4           HN       GLU   4  -9.830  -7.705  -3.203
  175    HA   GLU   4           HA       GLU   4  -7.281  -8.851  -3.319
  176    HB2  GLU   4           HB2      GLU   4  -9.362 -10.109  -3.723
  177    HB3  GLU   4           HB1      GLU   4  -9.590  -9.237  -5.239
  178    HG2  GLU   4           HG2      GLU   4  -7.466 -10.130  -6.092
  179    HG3  GLU   4           HG1      GLU   4  -7.197 -10.974  -4.569
  180    H    LYS   5           HN       LYS   5  -9.018  -6.905  -5.741
  181    HA   LYS   5           HA       LYS   5  -7.090  -6.991  -7.768
  182    HB2  LYS   5           HB2      LYS   5  -9.352  -6.117  -8.126
  183    HB3  LYS   5           HB1      LYS   5  -9.004  -4.751  -7.066
  184    HG2  LYS   5           HG2      LYS   5  -8.733  -4.054  -9.388
  185    HG3  LYS   5           HG1      LYS   5  -7.155  -4.078  -8.604
  186    HD2  LYS   5           HD2      LYS   5  -6.626  -6.225  -9.603
  187    HD3  LYS   5           HD1      LYS   5  -8.258  -6.365 -10.260
  188    HE2  LYS   5           HE2      LYS   5  -6.266  -4.197 -10.989
  189    HE3  LYS   5           HE1      LYS   5  -6.641  -5.606 -11.981
  190    HZ1  LYS   5           HZ1      LYS   5  -8.370  -3.317 -11.297
  191    HZ2  LYS   5           HZ2      LYS   5  -9.046  -4.802 -11.768
  192    HZ3  LYS   5           HZ3      LYS   5  -8.014  -3.962 -12.824
  193    H    LEU   6           HN       LEU   6  -7.501  -4.658  -5.113
  194    HA   LEU   6           HA       LEU   6  -5.390  -2.939  -5.771
  195    HB2  LEU   6           HB2      LEU   6  -7.047  -2.374  -4.068
  196    HB3  LEU   6           HB1      LEU   6  -6.462  -3.682  -3.039
  197    HG   LEU   6           HG       LEU   6  -4.370  -1.815  -3.967
  198   HD11  LEU   6          HD11      LEU   6  -6.405  -0.346  -3.537
  199   HD12  LEU   6          HD12      LEU   6  -4.991   0.012  -2.545
  200   HD13  LEU   6          HD13      LEU   6  -6.341  -0.895  -1.862
  201   HD21  LEU   6          HD21      LEU   6  -3.853  -1.976  -1.468
  202   HD22  LEU   6          HD22      LEU   6  -3.796  -3.496  -2.359
  203   HD23  LEU   6          HD23      LEU   6  -5.197  -3.113  -1.359
  204    H    MET   7           HN       MET   7  -5.419  -5.822  -3.686
  205    HA   MET   7           HA       MET   7  -2.742  -5.743  -2.869
  206    HB2  MET   7           HB2      MET   7  -4.418  -7.256  -1.882
  207    HB3  MET   7           HB1      MET   7  -4.464  -8.180  -3.384
  208    HG2  MET   7           HG2      MET   7  -2.971  -9.304  -1.826
  209    HG3  MET   7           HG1      MET   7  -2.009  -8.615  -3.132
  210    HE1  MET   7           HE1      MET   7   0.193  -8.709  -1.831
  211    HE2  MET   7           HE2      MET   7  -0.700  -9.550  -0.566
  212    HE3  MET   7           HE3      MET   7   0.373  -8.219  -0.141
  213    H    LYS   8           HN       LYS   8  -4.221  -7.349  -5.680
  214    HA   LYS   8           HA       LYS   8  -1.910  -8.552  -6.703
  215    HB2  LYS   8           HB2      LYS   8  -4.387  -7.509  -8.084
  216    HB3  LYS   8           HB1      LYS   8  -3.123  -8.412  -8.920
  217    HG2  LYS   8           HG2      LYS   8  -3.418 -10.250  -7.223
  218    HG3  LYS   8           HG1      LYS   8  -4.813  -9.371  -6.595
  219    HD2  LYS   8           HD2      LYS   8  -4.527 -10.221  -9.490
  220    HD3  LYS   8           HD1      LYS   8  -5.402 -11.156  -8.276
  221    HE2  LYS   8           HE2      LYS   8  -6.860  -9.188  -7.846
  222    HE3  LYS   8           HE1      LYS   8  -6.019  -8.310  -9.123
  223    HZ1  LYS   8           HZ1      LYS   8  -8.083  -9.352  -9.895
  224    HZ2  LYS   8           HZ2      LYS   8  -7.457 -10.880  -9.496
  225    HZ3  LYS   8           HZ3      LYS   8  -6.722  -9.949 -10.713
  226    H    ALA   9           HN       ALA   9  -3.308  -5.348  -7.381
  227    HA   ALA   9           HA       ALA   9  -1.444  -4.505  -9.294
  228    HB1  ALA   9           HB1      ALA   9  -3.387  -3.181  -9.023
  229    HB2  ALA   9           HB2      ALA   9  -2.065  -2.173  -8.434
  230    HB3  ALA   9           HB3      ALA   9  -3.119  -3.003  -7.289
  231    H    PHE  10           HN       PHE  10  -1.418  -4.115  -5.757
  232    HA   PHE  10           HA       PHE  10   0.954  -2.643  -5.548
  233    HB2  PHE  10           HB2      PHE  10  -0.560  -2.958  -3.648
  234    HB3  PHE  10           HB1      PHE  10  -0.171  -4.679  -3.609
  235    HD1  PHE  10           HD1      PHE  10   1.292  -1.270  -3.270
  236    HD2  PHE  10           HD2      PHE  10   1.807  -5.474  -2.551
  237    HE1  PHE  10           HE1      PHE  10   3.298  -0.789  -1.895
  238    HE2  PHE  10           HE2      PHE  10   3.812  -4.992  -1.174
  239    HZ   PHE  10           HZ       PHE  10   4.558  -2.649  -0.847
  240    H    GLU  11           HN       GLU  11   0.445  -6.164  -5.484
  241    HA   GLU  11           HA       GLU  11   3.103  -6.938  -5.063
  242    HB2  GLU  11           HB2      GLU  11   0.840  -8.295  -6.536
  243    HB3  GLU  11           HB1      GLU  11   2.397  -9.068  -6.237
  244    HG2  GLU  11           HG2      GLU  11   2.116  -8.849  -3.842
  245    HG3  GLU  11           HG1      GLU  11   0.652  -7.891  -4.059
  246    H    SER  12           HN       SER  12   1.340  -6.399  -8.109
  247    HA   SER  12           HA       SER  12   3.408  -7.081  -9.870
  248    HB2  SER  12           HB2      SER  12   2.211  -5.765 -11.543
  249    HB3  SER  12           HB1      SER  12   1.070  -6.703 -10.585
  250    HG   SER  12           HG       SER  12   1.680  -3.947 -10.453
  251    H    LEU  13           HN       LEU  13   2.559  -3.935  -8.438
  252    HA   LEU  13           HA       LEU  13   4.526  -2.384  -9.689
  253    HB2  LEU  13           HB2      LEU  13   2.708  -1.383  -8.406
  254    HB3  LEU  13           HB1      LEU  13   3.329  -2.103  -6.921
  255    HG   LEU  13           HG       LEU  13   5.442  -0.825  -7.214
  256   HD11  LEU  13          HD11      LEU  13   3.945   0.255  -9.612
  257   HD12  LEU  13          HD12      LEU  13   5.525  -0.528  -9.590
  258   HD13  LEU  13          HD13      LEU  13   5.330   1.083  -8.899
  259   HD21  LEU  13          HD21      LEU  13   2.831   0.704  -7.163
  260   HD22  LEU  13          HD22      LEU  13   4.388   1.464  -6.837
  261   HD23  LEU  13          HD23      LEU  13   3.800   0.176  -5.787
  262    H    LYS  14           HN       LYS  14   4.636  -4.154  -6.603
  263    HA   LYS  14           HA       LYS  14   7.221  -3.423  -5.820
  264    HB2  LYS  14           HB2      LYS  14   5.636  -4.586  -4.341
  265    HB3  LYS  14           HB1      LYS  14   5.777  -6.039  -5.329
  266    HG2  LYS  14           HG2      LYS  14   7.246  -6.278  -3.413
  267    HG3  LYS  14           HG1      LYS  14   8.244  -6.051  -4.849
  268    HD2  LYS  14           HD2      LYS  14   8.563  -3.698  -4.318
  269    HD3  LYS  14           HD1      LYS  14   7.444  -3.818  -2.960
  270    HE2  LYS  14           HE2      LYS  14   8.948  -5.443  -1.864
  271    HE3  LYS  14           HE1      LYS  14  10.070  -5.315  -3.220
  272    HZ1  LYS  14           HZ1      LYS  14  10.521  -3.082  -2.713
  273    HZ2  LYS  14           HZ2      LYS  14  10.567  -3.892  -1.220
  274    HZ3  LYS  14           HZ3      LYS  14   9.210  -2.961  -1.643
  275    H    SER  15           HN       SER  15   6.124  -6.201  -7.754
  276    HA   SER  15           HA       SER  15   8.616  -7.425  -8.131
  277    HB2  SER  15           HB2      SER  15   6.197  -7.331  -9.948
  278    HB3  SER  15           HB1      SER  15   7.579  -8.395 -10.194
  279    HG   SER  15           HG       SER  15   7.155  -9.173  -8.025
  280    H    PHE  16           HN       PHE  16   6.938  -4.968 -10.084
  281    HA   PHE  16           HA       PHE  16   8.835  -4.714 -12.126
  282    HB2  PHE  16           HB2      PHE  16   6.650  -3.689 -12.318
  283    HB3  PHE  16           HB1      PHE  16   6.966  -2.658 -10.923
  284    HD1  PHE  16           HD1      PHE  16   8.151  -3.445 -14.374
  285    HD2  PHE  16           HD2      PHE  16   8.081  -0.587 -11.168
  286    HE1  PHE  16           HE1      PHE  16   9.190  -1.753 -15.860
  287    HE2  PHE  16           HE2      PHE  16   9.121   1.105 -12.653
  288    HZ   PHE  16           HZ       PHE  16   9.675   0.522 -14.999
  289    H    GLN  17           HN       GLN  17   8.550  -2.958  -9.044
  290    HA   GLN  17           HA       GLN  17  10.723  -1.221  -9.370
  291    HB2  GLN  17           HB2      GLN  17   9.086  -0.986  -7.557
  292    HB3  GLN  17           HB1      GLN  17   9.672  -2.479  -6.823
  293    HG2  GLN  17           HG2      GLN  17  11.898  -1.482  -6.531
  294    HG3  GLN  17           HG1      GLN  17  11.344   0.005  -7.300
  295   HE21  GLN  17          HE21      GLN  17  12.331   0.129  -4.662
  296   HE22  GLN  17          HE22      GLN  17  11.046   0.441  -3.598
  297    H1   ALA   1           HT1      ALA   1   6.889  14.788   5.608
  298    H2   ALA   1           HT2      ALA   1   7.083  14.933   3.927
  299    H3   ALA   1           HT3      ALA   1   8.348  15.374   4.972
  300    HA   ALA   1           HA       ALA   1   8.492  13.127   3.776
  301    HB1  ALA   1           HB1      ALA   1   9.561  12.136   5.797
  302    HB2  ALA   1           HB2      ALA   1   8.837  13.412   6.776
  303    HB3  ALA   1           HB3      ALA   1  10.033  13.817   5.545
  304    H    THR   2           HN       THR   2   5.658  13.488   4.084
  305    HA   THR   2           HA       THR   2   4.533  11.578   5.860
  306    HB   THR   2           HB       THR   2   2.496  11.836   4.485
  307    HG1  THR   2           HG1      THR   2   2.590  12.719   2.557
  308   HG21  THR   2          HG21      THR   2   2.224  14.255   4.826
  309   HG22  THR   2          HG22      THR   2   3.971  14.437   4.984
  310   HG23  THR   2          HG23      THR   2   3.065  13.528   6.194
  311    H    LEU   3           HN       LEU   3   5.555  11.437   2.473
  312    HA   LEU   3           HA       LEU   3   4.556   8.902   1.826
  313    HB2  LEU   3           HB2      LEU   3   6.893  10.518   0.840
  314    HB3  LEU   3           HB1      LEU   3   6.607   8.886   0.233
  315    HG   LEU   3           HG       LEU   3   4.200   9.645  -0.220
  316   HD11  LEU   3          HD11      LEU   3   4.106  12.179  -0.625
  317   HD12  LEU   3          HD12      LEU   3   5.550  12.282   0.381
  318   HD13  LEU   3          HD13      LEU   3   4.049  11.649   1.055
  319   HD21  LEU   3          HD21      LEU   3   5.678   9.323  -2.078
  320   HD22  LEU   3          HD22      LEU   3   6.586  10.786  -1.695
  321   HD23  LEU   3          HD23      LEU   3   4.939  10.907  -2.316
  322    H    GLU   4           HN       GLU   4   7.705   9.830   3.203
  323    HA   GLU   4           HA       GLU   4   8.851   7.281   3.319
  324    HB2  GLU   4           HB2      GLU   4  10.109   9.362   3.723
  325    HB3  GLU   4           HB1      GLU   4   9.237   9.590   5.239
  326    HG2  GLU   4           HG2      GLU   4  10.130   7.466   6.092
  327    HG3  GLU   4           HG1      GLU   4  10.974   7.197   4.569
  328    H    LYS   5           HN       LYS   5   6.905   9.018   5.741
  329    HA   LYS   5           HA       LYS   5   6.991   7.090   7.768
  330    HB2  LYS   5           HB2      LYS   5   6.117   9.352   8.126
  331    HB3  LYS   5           HB1      LYS   5   4.751   9.004   7.066
  332    HG2  LYS   5           HG2      LYS   5   4.054   8.733   9.388
  333    HG3  LYS   5           HG1      LYS   5   4.078   7.155   8.604
  334    HD2  LYS   5           HD2      LYS   5   6.225   6.626   9.603
  335    HD3  LYS   5           HD1      LYS   5   6.365   8.258  10.260
  336    HE2  LYS   5           HE2      LYS   5   4.197   6.266  10.989
  337    HE3  LYS   5           HE1      LYS   5   5.606   6.641  11.981
  338    HZ1  LYS   5           HZ1      LYS   5   3.317   8.370  11.297
  339    HZ2  LYS   5           HZ2      LYS   5   4.802   9.046  11.768
  340    HZ3  LYS   5           HZ3      LYS   5   3.962   8.014  12.824
  341    H    LEU   6           HN       LEU   6   4.658   7.501   5.113
  342    HA   LEU   6           HA       LEU   6   2.939   5.390   5.771
  343    HB2  LEU   6           HB2      LEU   6   2.374   7.047   4.068
  344    HB3  LEU   6           HB1      LEU   6   3.682   6.462   3.039
  345    HG   LEU   6           HG       LEU   6   1.815   4.370   3.967
  346   HD11  LEU   6          HD11      LEU   6   0.346   6.405   3.537
  347   HD12  LEU   6          HD12      LEU   6  -0.012   4.991   2.545
  348   HD13  LEU   6          HD13      LEU   6   0.895   6.341   1.862
  349   HD21  LEU   6          HD21      LEU   6   1.976   3.853   1.468
  350   HD22  LEU   6          HD22      LEU   6   3.496   3.796   2.359
  351   HD23  LEU   6          HD23      LEU   6   3.113   5.197   1.359
  352    H    MET   7           HN       MET   7   5.822   5.419   3.686
  353    HA   MET   7           HA       MET   7   5.743   2.742   2.869
  354    HB2  MET   7           HB2      MET   7   7.256   4.418   1.882
  355    HB3  MET   7           HB1      MET   7   8.180   4.464   3.384
  356    HG2  MET   7           HG2      MET   7   9.304   2.971   1.826
  357    HG3  MET   7           HG1      MET   7   8.615   2.009   3.132
  358    HE1  MET   7           HE1      MET   7   8.709  -0.193   1.831
  359    HE2  MET   7           HE2      MET   7   9.550   0.700   0.566
  360    HE3  MET   7           HE3      MET   7   8.219  -0.373   0.141
  361    H    LYS   8           HN       LYS   8   7.349   4.221   5.680
  362    HA   LYS   8           HA       LYS   8   8.552   1.910   6.703
  363    HB2  LYS   8           HB2      LYS   8   7.509   4.387   8.084
  364    HB3  LYS   8           HB1      LYS   8   8.412   3.123   8.920
  365    HG2  LYS   8           HG2      LYS   8  10.250   3.418   7.223
  366    HG3  LYS   8           HG1      LYS   8   9.371   4.813   6.595
  367    HD2  LYS   8           HD2      LYS   8  10.221   4.527   9.490
  368    HD3  LYS   8           HD1      LYS   8  11.156   5.402   8.276
  369    HE2  LYS   8           HE2      LYS   8   9.188   6.860   7.846
  370    HE3  LYS   8           HE1      LYS   8   8.310   6.019   9.123
  371    HZ1  LYS   8           HZ1      LYS   8   9.352   8.083   9.895
  372    HZ2  LYS   8           HZ2      LYS   8  10.880   7.457   9.496
  373    HZ3  LYS   8           HZ3      LYS   8   9.949   6.722  10.713
  374    H    ALA   9           HN       ALA   9   5.348   3.308   7.381
  375    HA   ALA   9           HA       ALA   9   4.505   1.444   9.294
  376    HB1  ALA   9           HB1      ALA   9   3.182   3.387   9.023
  377    HB2  ALA   9           HB2      ALA   9   2.174   2.065   8.435
  378    HB3  ALA   9           HB3      ALA   9   3.003   3.118   7.289
  379    H    PHE  10           HN       PHE  10   4.115   1.418   5.757
  380    HA   PHE  10           HA       PHE  10   2.643  -0.954   5.548
  381    HB2  PHE  10           HB2      PHE  10   2.958   0.560   3.648
  382    HB3  PHE  10           HB1      PHE  10   4.679   0.171   3.609
  383    HD1  PHE  10           HD1      PHE  10   1.270  -1.292   3.270
  384    HD2  PHE  10           HD2      PHE  10   5.474  -1.807   2.551
  385    HE1  PHE  10           HE1      PHE  10   0.789  -3.298   1.895
  386    HE2  PHE  10           HE2      PHE  10   4.992  -3.812   1.174
  387    HZ   PHE  10           HZ       PHE  10   2.649  -4.558   0.847
  388    H    GLU  11           HN       GLU  11   6.164  -0.445   5.484
  389    HA   GLU  11           HA       GLU  11   6.938  -3.103   5.063
  390    HB2  GLU  11           HB2      GLU  11   8.295  -0.840   6.536
  391    HB3  GLU  11           HB1      GLU  11   9.068  -2.397   6.237
  392    HG2  GLU  11           HG2      GLU  11   8.849  -2.116   3.842
  393    HG3  GLU  11           HG1      GLU  11   7.891  -0.652   4.059
  394    H    SER  12           HN       SER  12   6.399  -1.340   8.109
  395    HA   SER  12           HA       SER  12   7.082  -3.400   9.880
  396    HB2  SER  12           HB2      SER  12   5.054  -1.171  10.169
  397    HB3  SER  12           HB1      SER  12   5.583  -2.205  11.493
  398    HG   SER  12           HG       SER  12   7.315  -1.035  11.623
  399    H    LEU  13           HN       LEU  13   3.935  -2.559   8.438
  400    HA   LEU  13           HA       LEU  13   2.384  -4.526   9.689
  401    HB2  LEU  13           HB2      LEU  13   1.383  -2.707   8.407
  402    HB3  LEU  13           HB1      LEU  13   2.103  -3.328   6.921
  403    HG   LEU  13           HG       LEU  13   0.825  -5.442   7.214
  404   HD11  LEU  13          HD11      LEU  13  -0.260  -3.944   9.610
  405   HD12  LEU  13          HD12      LEU  13   0.528  -5.521   9.591
  406   HD13  LEU  13          HD13      LEU  13  -1.082  -5.332   8.897
  407   HD21  LEU  13          HD21      LEU  13  -0.704  -2.830   7.163
  408   HD22  LEU  13          HD22      LEU  13  -1.463  -4.388   6.836
  409   HD23  LEU  13          HD23      LEU  13  -0.175  -3.798   5.787
  410    H    LYS  14           HN       LYS  14   4.154  -4.636   6.603
  411    HA   LYS  14           HA       LYS  14   3.423  -7.221   5.820
  412    HB2  LYS  14           HB2      LYS  14   4.586  -5.636   4.341
  413    HB3  LYS  14           HB1      LYS  14   6.039  -5.777   5.329
  414    HG2  LYS  14           HG2      LYS  14   6.278  -7.246   3.413
  415    HG3  LYS  14           HG1      LYS  14   6.051  -8.244   4.849
  416    HD2  LYS  14           HD2      LYS  14   3.698  -8.563   4.318
  417    HD3  LYS  14           HD1      LYS  14   3.818  -7.444   2.960
  418    HE2  LYS  14           HE2      LYS  14   5.443  -8.948   1.864
  419    HE3  LYS  14           HE1      LYS  14   5.315 -10.070   3.220
  420    HZ1  LYS  14           HZ1      LYS  14   3.082 -10.521   2.713
  421    HZ2  LYS  14           HZ2      LYS  14   3.892 -10.567   1.220
  422    HZ3  LYS  14           HZ3      LYS  14   2.961  -9.210   1.643
  423    H    SER  15           HN       SER  15   6.201  -6.124   7.754
  424    HA   SER  15           HA       SER  15   7.426  -8.616   8.131
  425    HB2  SER  15           HB2      SER  15   8.510  -6.499   8.748
  426    HB3  SER  15           HB1      SER  15   7.319  -6.248  10.021
  427    HG   SER  15           HG       SER  15   8.509  -7.474  11.227
  428    H    PHE  16           HN       PHE  16   4.968  -6.938  10.084
  429    HA   PHE  16           HA       PHE  16   4.717  -8.838  12.122
  430    HB2  PHE  16           HB2      PHE  16   3.688  -6.638  12.295
  431    HB3  PHE  16           HB1      PHE  16   2.614  -7.007  10.944
  432    HD1  PHE  16           HD1      PHE  16   3.546  -8.077  14.394
  433    HD2  PHE  16           HD2      PHE  16   0.594  -8.203  11.276
  434    HE1  PHE  16           HE1      PHE  16   1.943  -9.146  15.955
  435    HE2  PHE  16           HE2      PHE  16  -1.009  -9.271  12.838
  436    HZ   PHE  16           HZ       PHE  16  -0.335  -9.743  15.177
  437    H    GLN  17           HN       GLN  17   2.958  -8.550   9.044
  438    HA   GLN  17           HA       GLN  17   1.221 -10.723   9.370
  439    HB2  GLN  17           HB2      GLN  17   0.980  -9.089   7.557
  440    HB3  GLN  17           HB1      GLN  17   2.479  -9.665   6.826
  441    HG2  GLN  17           HG2      GLN  17   1.496 -11.894   6.521
  442    HG3  GLN  17           HG1      GLN  17   0.006 -11.356   7.293
  443   HE21  GLN  17          HE21      GLN  17  -0.127 -12.329   4.658
  444   HE22  GLN  17          HE22      GLN  17  -0.443 -11.042   3.598
  445    H1   ALA   1           HT1      ALA   1  -6.889 -14.788   5.608
  446    H2   ALA   1           HT2      ALA   1  -7.083 -14.933   3.927
  447    H3   ALA   1           HT3      ALA   1  -8.348 -15.374   4.972
  448    HA   ALA   1           HA       ALA   1  -8.492 -13.127   3.776
  449    HB1  ALA   1           HB1      ALA   1  -9.561 -12.136   5.797
  450    HB2  ALA   1           HB2      ALA   1  -8.837 -13.412   6.776
  451    HB3  ALA   1           HB3      ALA   1 -10.033 -13.817   5.545
  452    H    THR   2           HN       THR   2  -5.658 -13.488   4.084
  453    HA   THR   2           HA       THR   2  -4.533 -11.578   5.860
  454    HB   THR   2           HB       THR   2  -2.496 -11.836   4.485
  455    HG1  THR   2           HG1      THR   2  -2.590 -12.719   2.557
  456   HG21  THR   2          HG21      THR   2  -2.224 -14.255   4.826
  457   HG22  THR   2          HG22      THR   2  -3.971 -14.437   4.984
  458   HG23  THR   2          HG23      THR   2  -3.065 -13.528   6.194
  459    H    LEU   3           HN       LEU   3  -5.555 -11.437   2.473
  460    HA   LEU   3           HA       LEU   3  -4.556  -8.902   1.826
  461    HB2  LEU   3           HB2      LEU   3  -6.893 -10.518   0.840
  462    HB3  LEU   3           HB1      LEU   3  -6.607  -8.886   0.233
  463    HG   LEU   3           HG       LEU   3  -4.200  -9.645  -0.220
  464   HD11  LEU   3          HD11      LEU   3  -4.106 -12.179  -0.625
  465   HD12  LEU   3          HD12      LEU   3  -5.550 -12.282   0.381
  466   HD13  LEU   3          HD13      LEU   3  -4.049 -11.649   1.055
  467   HD21  LEU   3          HD21      LEU   3  -5.678  -9.323  -2.078
  468   HD22  LEU   3          HD22      LEU   3  -6.586 -10.786  -1.695
  469   HD23  LEU   3          HD23      LEU   3  -4.939 -10.907  -2.316
  470    H    GLU   4           HN       GLU   4  -7.705  -9.830   3.203
  471    HA   GLU   4           HA       GLU   4  -8.851  -7.281   3.319
  472    HB2  GLU   4           HB2      GLU   4 -10.109  -9.362   3.723
  473    HB3  GLU   4           HB1      GLU   4  -9.237  -9.590   5.239
  474    HG2  GLU   4           HG2      GLU   4 -10.130  -7.466   6.092
  475    HG3  GLU   4           HG1      GLU   4 -10.974  -7.197   4.569
  476    H    LYS   5           HN       LYS   5  -6.905  -9.018   5.741
  477    HA   LYS   5           HA       LYS   5  -6.991  -7.090   7.768
  478    HB2  LYS   5           HB2      LYS   5  -6.117  -9.352   8.126
  479    HB3  LYS   5           HB1      LYS   5  -4.751  -9.004   7.066
  480    HG2  LYS   5           HG2      LYS   5  -4.054  -8.733   9.388
  481    HG3  LYS   5           HG1      LYS   5  -4.078  -7.155   8.604
  482    HD2  LYS   5           HD2      LYS   5  -6.225  -6.626   9.603
  483    HD3  LYS   5           HD1      LYS   5  -6.365  -8.258  10.260
  484    HE2  LYS   5           HE2      LYS   5  -4.197  -6.266  10.989
  485    HE3  LYS   5           HE1      LYS   5  -5.606  -6.641  11.981
  486    HZ1  LYS   5           HZ1      LYS   5  -3.317  -8.370  11.297
  487    HZ2  LYS   5           HZ2      LYS   5  -4.802  -9.046  11.768
  488    HZ3  LYS   5           HZ3      LYS   5  -3.962  -8.014  12.824
  489    H    LEU   6           HN       LEU   6  -4.658  -7.501   5.113
  490    HA   LEU   6           HA       LEU   6  -2.939  -5.390   5.771
  491    HB2  LEU   6           HB2      LEU   6  -2.374  -7.047   4.068
  492    HB3  LEU   6           HB1      LEU   6  -3.682  -6.462   3.039
  493    HG   LEU   6           HG       LEU   6  -1.815  -4.370   3.967
  494   HD11  LEU   6          HD11      LEU   6  -0.346  -6.405   3.537
  495   HD12  LEU   6          HD12      LEU   6   0.012  -4.991   2.545
  496   HD13  LEU   6          HD13      LEU   6  -0.895  -6.341   1.862
  497   HD21  LEU   6          HD21      LEU   6  -1.976  -3.853   1.468
  498   HD22  LEU   6          HD22      LEU   6  -3.496  -3.796   2.359
  499   HD23  LEU   6          HD23      LEU   6  -3.113  -5.197   1.359
  500    H    MET   7           HN       MET   7  -5.822  -5.419   3.686
  501    HA   MET   7           HA       MET   7  -5.743  -2.742   2.869
  502    HB2  MET   7           HB2      MET   7  -7.256  -4.418   1.882
  503    HB3  MET   7           HB1      MET   7  -8.180  -4.464   3.384
  504    HG2  MET   7           HG2      MET   7  -9.304  -2.971   1.826
  505    HG3  MET   7           HG1      MET   7  -8.615  -2.009   3.132
  506    HE1  MET   7           HE1      MET   7  -8.709   0.193   1.831
  507    HE2  MET   7           HE2      MET   7  -9.550  -0.700   0.566
  508    HE3  MET   7           HE3      MET   7  -8.219   0.373   0.141
  509    H    LYS   8           HN       LYS   8  -7.349  -4.221   5.680
  510    HA   LYS   8           HA       LYS   8  -8.552  -1.910   6.703
  511    HB2  LYS   8           HB2      LYS   8  -7.509  -4.387   8.084
  512    HB3  LYS   8           HB1      LYS   8  -8.412  -3.123   8.920
  513    HG2  LYS   8           HG2      LYS   8 -10.250  -3.418   7.223
  514    HG3  LYS   8           HG1      LYS   8  -9.371  -4.813   6.595
  515    HD2  LYS   8           HD2      LYS   8 -10.221  -4.527   9.490
  516    HD3  LYS   8           HD1      LYS   8 -11.156  -5.402   8.276
  517    HE2  LYS   8           HE2      LYS   8  -9.188  -6.860   7.846
  518    HE3  LYS   8           HE1      LYS   8  -8.310  -6.019   9.123
  519    HZ1  LYS   8           HZ1      LYS   8  -9.352  -8.083   9.895
  520    HZ2  LYS   8           HZ2      LYS   8 -10.880  -7.457   9.496
  521    HZ3  LYS   8           HZ3      LYS   8  -9.949  -6.722  10.713
  522    H    ALA   9           HN       ALA   9  -5.348  -3.308   7.381
  523    HA   ALA   9           HA       ALA   9  -4.505  -1.444   9.294
  524    HB1  ALA   9           HB1      ALA   9  -3.181  -3.387   9.023
  525    HB2  ALA   9           HB2      ALA   9  -2.173  -2.065   8.434
  526    HB3  ALA   9           HB3      ALA   9  -3.003  -3.119   7.289
  527    H    PHE  10           HN       PHE  10  -4.115  -1.418   5.757
  528    HA   PHE  10           HA       PHE  10  -2.643   0.954   5.548
  529    HB2  PHE  10           HB2      PHE  10  -2.958  -0.560   3.648
  530    HB3  PHE  10           HB1      PHE  10  -4.679  -0.171   3.609
  531    HD1  PHE  10           HD1      PHE  10  -1.270   1.292   3.270
  532    HD2  PHE  10           HD2      PHE  10  -5.474   1.807   2.551
  533    HE1  PHE  10           HE1      PHE  10  -0.789   3.298   1.895
  534    HE2  PHE  10           HE2      PHE  10  -4.992   3.812   1.174
  535    HZ   PHE  10           HZ       PHE  10  -2.649   4.558   0.847
  536    H    GLU  11           HN       GLU  11  -6.164   0.445   5.484
  537    HA   GLU  11           HA       GLU  11  -6.938   3.103   5.063
  538    HB2  GLU  11           HB2      GLU  11  -8.295   0.840   6.536
  539    HB3  GLU  11           HB1      GLU  11  -9.068   2.397   6.237
  540    HG2  GLU  11           HG2      GLU  11  -8.849   2.116   3.842
  541    HG3  GLU  11           HG1      GLU  11  -7.891   0.652   4.059
  542    H    SER  12           HN       SER  12  -6.399   1.340   8.109
  543    HA   SER  12           HA       SER  12  -7.081   3.408   9.870
  544    HB2  SER  12           HB2      SER  12  -5.765   2.211  11.544
  545    HB3  SER  12           HB1      SER  12  -6.703   1.070  10.585
  546    HG   SER  12           HG       SER  12  -3.952   1.577  10.619
  547    H    LEU  13           HN       LEU  13  -3.935   2.559   8.438
  548    HA   LEU  13           HA       LEU  13  -2.386   4.526   9.689
  549    HB2  LEU  13           HB2      LEU  13  -1.381   2.708   8.412
  550    HB3  LEU  13           HB1      LEU  13  -2.101   3.324   6.924
  551    HG   LEU  13           HG       LEU  13  -0.824   5.441   7.215
  552   HD11  LEU  13          HD11      LEU  13   0.266   3.943   9.609
  553   HD12  LEU  13          HD12      LEU  13  -0.524   5.520   9.593
  554   HD13  LEU  13          HD13      LEU  13   1.085   5.333   8.895
  555   HD21  LEU  13          HD21      LEU  13   0.705   2.829   7.163
  556   HD22  LEU  13          HD22      LEU  13   1.463   4.387   6.834
  557   HD23  LEU  13          HD23      LEU  13   0.174   3.796   5.787
  558    H    LYS  14           HN       LYS  14  -4.154   4.636   6.603
  559    HA   LYS  14           HA       LYS  14  -3.423   7.221   5.820
  560    HB2  LYS  14           HB2      LYS  14  -4.586   5.636   4.341
  561    HB3  LYS  14           HB1      LYS  14  -6.039   5.777   5.329
  562    HG2  LYS  14           HG2      LYS  14  -6.278   7.246   3.413
  563    HG3  LYS  14           HG1      LYS  14  -6.051   8.244   4.849
  564    HD2  LYS  14           HD2      LYS  14  -3.698   8.563   4.318
  565    HD3  LYS  14           HD1      LYS  14  -3.818   7.444   2.960
  566    HE2  LYS  14           HE2      LYS  14  -5.443   8.948   1.864
  567    HE3  LYS  14           HE1      LYS  14  -5.315  10.070   3.220
  568    HZ1  LYS  14           HZ1      LYS  14  -3.082  10.521   2.713
  569    HZ2  LYS  14           HZ2      LYS  14  -3.892  10.567   1.220
  570    HZ3  LYS  14           HZ3      LYS  14  -2.961   9.210   1.643
  571    H    SER  15           HN       SER  15  -6.201   6.124   7.754
  572    HA   SER  15           HA       SER  15  -7.414   8.621   8.127
  573    HB2  SER  15           HB2      SER  15  -8.521   7.624  10.062
  574    HB3  SER  15           HB1      SER  15  -8.490   6.476   8.727
  575    HG   SER  15           HG       SER  15  -6.966   6.533  11.095
  576    H    PHE  16           HN       PHE  16  -4.968   6.938  10.084
  577    HA   PHE  16           HA       PHE  16  -4.715   8.835  12.126
  578    HB2  PHE  16           HB2      PHE  16  -3.688   6.656  12.329
  579    HB3  PHE  16           HB1      PHE  16  -2.664   6.960  10.925
  580    HD1  PHE  16           HD1      PHE  16  -3.430   8.175  14.371
  581    HD2  PHE  16           HD2      PHE  16  -0.589   8.072  11.151
  582    HE1  PHE  16           HE1      PHE  16  -1.728   9.224  15.839
  583    HE2  PHE  16           HE2      PHE  16   1.113   9.121  12.619
  584    HZ   PHE  16           HZ       PHE  16   0.543   9.697  14.963
  585    H    GLN  17           HN       GLN  17  -2.958   8.550   9.044
  586    HA   GLN  17           HA       GLN  17  -1.221  10.723   9.370
  587    HB2  GLN  17           HB2      GLN  17  -0.981   9.089   7.558
  588    HB3  GLN  17           HB1      GLN  17  -2.479   9.665   6.826
  589    HG2  GLN  17           HG2      GLN  17  -1.496  11.894   6.521
  590    HG3  GLN  17           HG1      GLN  17  -0.006  11.356   7.293
  591   HE21  GLN  17          HE21      GLN  17   0.128  12.328   4.658
  592   HE22  GLN  17          HE22      GLN  17   0.443  11.041   3.598
  Start of MODEL    8
    1    H1   ALA   1           HT1      ALA   1  13.792   8.392  -3.436
    2    H2   ALA   1           HT2      ALA   1  14.104   6.726  -3.311
    3    H3   ALA   1           HT3      ALA   1  12.542   7.325  -3.017
    4    HA   ALA   1           HA       ALA   1  12.692   8.203  -5.427
    5    HB1  ALA   1           HB1      ALA   1  15.033   7.673  -5.790
    6    HB2  ALA   1           HB2      ALA   1  14.060   6.623  -6.821
    7    HB3  ALA   1           HB3      ALA   1  14.763   5.991  -5.333
    8    H    THR   2           HN       THR   2  13.057   4.933  -4.041
    9    HA   THR   2           HA       THR   2  11.061   3.725  -5.656
   10    HB   THR   2           HB       THR   2  11.157   1.887  -4.006
   11    HG1  THR   2           HG1      THR   2  12.552   2.173  -2.222
   12   HG21  THR   2          HG21      THR   2  12.928   2.245  -5.785
   13   HG22  THR   2          HG22      THR   2  13.450   1.297  -4.393
   14   HG23  THR   2          HG23      THR   2  13.924   2.990  -4.535
   15    H    LEU   3           HN       LEU   3  10.996   5.188  -2.428
   16    HA   LEU   3           HA       LEU   3   8.381   4.500  -1.705
   17    HB2  LEU   3           HB2      LEU   3  10.193   6.785  -0.981
   18    HB3  LEU   3           HB1      LEU   3   8.536   6.731  -0.379
   19    HG   LEU   3           HG       LEU   3   9.078   4.317   0.356
   20   HD11  LEU   3          HD11      LEU   3  11.571   4.086   0.883
   21   HD12  LEU   3          HD12      LEU   3  11.831   5.424  -0.237
   22   HD13  LEU   3          HD13      LEU   3  11.122   3.916  -0.814
   23   HD21  LEU   3          HD21      LEU   3  10.300   5.206   2.417
   24   HD22  LEU   3          HD22      LEU   3   8.784   6.015   2.019
   25   HD23  LEU   3          HD23      LEU   3  10.323   6.776   1.613
   26    H    GLU   4           HN       GLU   4   9.588   7.361  -3.442
   27    HA   GLU   4           HA       GLU   4   7.147   8.698  -3.742
   28    HB2  GLU   4           HB2      GLU   4   9.617   8.640  -5.482
   29    HB3  GLU   4           HB1      GLU   4   8.252   9.717  -5.780
   30    HG2  GLU   4           HG2      GLU   4   8.518  10.755  -3.608
   31    HG3  GLU   4           HG1      GLU   4   9.754   9.585  -3.153
   32    H    LYS   5           HN       LYS   5   8.720   6.324  -5.875
   33    HA   LYS   5           HA       LYS   5   6.818   6.322  -7.928
   34    HB2  LYS   5           HB2      LYS   5   9.000   5.214  -8.127
   35    HB3  LYS   5           HB1      LYS   5   8.509   4.020  -6.925
   36    HG2  LYS   5           HG2      LYS   5   6.731   3.216  -8.368
   37    HG3  LYS   5           HG1      LYS   5   7.048   4.498  -9.537
   38    HD2  LYS   5           HD2      LYS   5   8.105   2.488 -10.359
   39    HD3  LYS   5           HD1      LYS   5   9.380   3.570  -9.798
   40    HE2  LYS   5           HE2      LYS   5   9.519   2.358  -7.677
   41    HE3  LYS   5           HE1      LYS   5   8.184   1.313  -8.163
   42    HZ1  LYS   5           HZ1      LYS   5   9.669   0.819 -10.184
   43    HZ2  LYS   5           HZ2      LYS   5  10.038   0.076  -8.701
   44    HZ3  LYS   5           HZ3      LYS   5  10.931   1.423  -9.225
   45    H    LEU   6           HN       LEU   6   7.011   4.310  -4.998
   46    HA   LEU   6           HA       LEU   6   4.762   2.714  -5.476
   47    HB2  LEU   6           HB2      LEU   6   6.355   2.222  -3.688
   48    HB3  LEU   6           HB1      LEU   6   5.878   3.690  -2.836
   49    HG   LEU   6           HG       LEU   6   3.571   2.821  -2.635
   50   HD11  LEU   6          HD11      LEU   6   3.393   1.431  -4.584
   51   HD12  LEU   6          HD12      LEU   6   3.257   0.359  -3.192
   52   HD13  LEU   6          HD13      LEU   6   4.772   0.452  -4.089
   53   HD21  LEU   6          HD21      LEU   6   4.033   1.197  -0.927
   54   HD22  LEU   6          HD22      LEU   6   5.395   2.317  -0.931
   55   HD23  LEU   6          HD23      LEU   6   5.553   0.733  -1.691
   56    H    MET   7           HN       MET   7   5.031   5.819  -3.759
   57    HA   MET   7           HA       MET   7   2.354   6.071  -2.982
   58    HB2  MET   7           HB2      MET   7   4.161   7.540  -2.166
   59    HB3  MET   7           HB1      MET   7   4.279   8.272  -3.767
   60    HG2  MET   7           HG2      MET   7   2.895   9.692  -2.354
   61    HG3  MET   7           HG1      MET   7   1.877   8.947  -3.585
   62    HE1  MET   7           HE1      MET   7  -0.527   9.106  -0.583
   63    HE2  MET   7           HE2      MET   7  -0.303   9.403  -2.305
   64    HE3  MET   7           HE3      MET   7   0.676  10.282  -1.133
   65    H    LYS   8           HN       LYS   8   3.981   7.184  -5.946
   66    HA   LYS   8           HA       LYS   8   1.790   8.443  -7.146
   67    HB2  LYS   8           HB2      LYS   8   4.170   7.021  -8.350
   68    HB3  LYS   8           HB1      LYS   8   3.001   7.934  -9.306
   69    HG2  LYS   8           HG2      LYS   8   3.474   9.951  -7.967
   70    HG3  LYS   8           HG1      LYS   8   4.644   9.043  -7.010
   71    HD2  LYS   8           HD2      LYS   8   5.976   8.608  -9.040
   72    HD3  LYS   8           HD1      LYS   8   4.807   9.512 -10.002
   73    HE2  LYS   8           HE2      LYS   8   5.272  11.538  -8.676
   74    HE3  LYS   8           HE1      LYS   8   6.436  10.638  -7.704
   75    HZ1  LYS   8           HZ1      LYS   8   7.617  11.805  -9.390
   76    HZ2  LYS   8           HZ2      LYS   8   6.594  11.213 -10.611
   77    HZ3  LYS   8           HZ3      LYS   8   7.647  10.158  -9.797
   78    H    ALA   9           HN       ALA   9   2.904   5.073  -7.400
   79    HA   ALA   9           HA       ALA   9   0.986   4.162  -9.224
   80    HB1  ALA   9           HB1      ALA   9   2.299   2.651  -6.953
   81    HB2  ALA   9           HB2      ALA   9   2.949   2.837  -8.582
   82    HB3  ALA   9           HB3      ALA   9   1.466   1.919  -8.324
   83    H    PHE  10           HN       PHE  10   0.906   4.218  -5.666
   84    HA   PHE  10           HA       PHE  10  -1.585   2.992  -5.309
   85    HB2  PHE  10           HB2      PHE  10   0.333   4.064  -3.656
   86    HB3  PHE  10           HB1      PHE  10  -1.017   5.178  -3.436
   87    HD1  PHE  10           HD1      PHE  10   0.280   1.875  -2.733
   88    HD2  PHE  10           HD2      PHE  10  -3.298   4.244  -2.844
   89    HE1  PHE  10           HE1      PHE  10  -0.869   0.204  -1.306
   90    HE2  PHE  10           HE2      PHE  10  -4.448   2.575  -1.414
   91    HZ   PHE  10           HZ       PHE  10  -3.233   0.555  -0.645
   92    H    GLU  11           HN       GLU  11  -0.772   6.438  -5.679
   93    HA   GLU  11           HA       GLU  11  -3.356   7.481  -5.400
   94    HB2  GLU  11           HB2      GLU  11  -0.982   8.453  -7.001
   95    HB3  GLU  11           HB1      GLU  11  -2.464   9.388  -6.802
   96    HG2  GLU  11           HG2      GLU  11  -0.709   8.375  -4.545
   97    HG3  GLU  11           HG1      GLU  11  -0.768  10.038  -5.126
   98    H    SER  12           HN       SER  12  -1.630   6.420  -8.326
   99    HA   SER  12           HA       SER  12  -3.614   7.051 -10.200
  100    HB2  SER  12           HB2      SER  12  -1.571   4.818 -10.203
  101    HB3  SER  12           HB1      SER  12  -2.549   5.267 -11.597
  102    HG   SER  12           HG       SER  12  -1.667   7.441 -11.251
  103    H    LEU  13           HN       LEU  13  -3.057   4.049  -8.367
  104    HA   LEU  13           HA       LEU  13  -5.149   2.536  -9.453
  105    HB2  LEU  13           HB2      LEU  13  -3.424   1.541  -8.041
  106    HB3  LEU  13           HB1      LEU  13  -3.997   2.468  -6.654
  107    HG   LEU  13           HG       LEU  13  -6.083   0.896  -8.034
  108   HD11  LEU  13          HD11      LEU  13  -4.193  -0.672  -8.205
  109   HD12  LEU  13          HD12      LEU  13  -5.352  -1.234  -7.001
  110   HD13  LEU  13          HD13      LEU  13  -3.852  -0.462  -6.487
  111   HD21  LEU  13          HD21      LEU  13  -5.190   1.392  -5.183
  112   HD22  LEU  13          HD22      LEU  13  -6.515   0.299  -5.586
  113   HD23  LEU  13          HD23      LEU  13  -6.633   2.013  -5.986
  114    H    LYS  14           HN       LYS  14  -5.117   4.672  -6.606
  115    HA   LYS  14           HA       LYS  14  -7.757   4.278  -5.762
  116    HB2  LYS  14           HB2      LYS  14  -5.893   6.643  -5.589
  117    HB3  LYS  14           HB1      LYS  14  -7.512   6.683  -4.896
  118    HG2  LYS  14           HG2      LYS  14  -7.012   4.839  -3.429
  119    HG3  LYS  14           HG1      LYS  14  -5.469   4.548  -4.239
  120    HD2  LYS  14           HD2      LYS  14  -4.557   6.615  -3.450
  121    HD3  LYS  14           HD1      LYS  14  -6.133   7.177  -2.896
  122    HE2  LYS  14           HE2      LYS  14  -6.186   5.571  -1.130
  123    HE3  LYS  14           HE1      LYS  14  -4.797   4.705  -1.779
  124    HZ1  LYS  14           HZ1      LYS  14  -4.871   7.361  -0.488
  125    HZ2  LYS  14           HZ2      LYS  14  -3.568   6.893  -1.472
  126    HZ3  LYS  14           HZ3      LYS  14  -3.936   6.009  -0.069
  127    H    SER  15           HN       SER  15  -6.414   6.680  -8.025
  128    HA   SER  15           HA       SER  15  -8.787   8.058  -8.591
  129    HB2  SER  15           HB2      SER  15  -6.580   8.869  -9.302
  130    HB3  SER  15           HB1      SER  15  -6.429   7.511 -10.414
  131    HG   SER  15           HG       SER  15  -7.754   9.858 -10.703
  132    H    PHE  16           HN       PHE  16  -7.322   5.240 -10.198
  133    HA   PHE  16           HA       PHE  16  -9.230   4.903 -12.218
  134    HB2  PHE  16           HB2      PHE  16  -7.575   2.829 -10.759
  135    HB3  PHE  16           HB1      PHE  16  -8.480   2.524 -12.241
  136    HD1  PHE  16           HD1      PHE  16  -5.316   2.663 -11.428
  137    HD2  PHE  16           HD2      PHE  16  -8.038   5.075 -13.714
  138    HE1  PHE  16           HE1      PHE  16  -3.420   3.541 -12.760
  139    HE2  PHE  16           HE2      PHE  16  -6.140   5.954 -15.045
  140    HZ   PHE  16           HZ       PHE  16  -3.831   5.186 -14.569
  141    H    GLN  17           HN       GLN  17  -9.108   3.522  -8.944
  142    HA   GLN  17           HA       GLN  17 -11.422   1.954  -9.088
  143    HB2  GLN  17           HB2      GLN  17  -9.791   1.837  -7.236
  144    HB3  GLN  17           HB1      GLN  17 -10.325   3.423  -6.679
  145    HG2  GLN  17           HG2      GLN  17 -12.593   2.565  -6.329
  146    HG3  GLN  17           HG1      GLN  17 -12.109   0.986  -6.946
  147   HE21  GLN  17          HE21      GLN  17 -13.094   0.832  -4.438
  148   HE22  GLN  17          HE22      GLN  17 -11.863   0.694  -3.278
  149    H1   ALA   1           HT1      ALA   1 -13.792  -8.392  -3.436
  150    H2   ALA   1           HT2      ALA   1 -14.104  -6.726  -3.311
  151    H3   ALA   1           HT3      ALA   1 -12.542  -7.325  -3.017
  152    HA   ALA   1           HA       ALA   1 -12.692  -8.203  -5.427
  153    HB1  ALA   1           HB1      ALA   1 -15.033  -7.673  -5.790
  154    HB2  ALA   1           HB2      ALA   1 -14.060  -6.623  -6.821
  155    HB3  ALA   1           HB3      ALA   1 -14.763  -5.991  -5.333
  156    H    THR   2           HN       THR   2 -13.057  -4.933  -4.041
  157    HA   THR   2           HA       THR   2 -11.061  -3.725  -5.656
  158    HB   THR   2           HB       THR   2 -11.157  -1.887  -4.006
  159    HG1  THR   2           HG1      THR   2 -12.552  -2.173  -2.222
  160   HG21  THR   2          HG21      THR   2 -12.928  -2.245  -5.785
  161   HG22  THR   2          HG22      THR   2 -13.450  -1.297  -4.393
  162   HG23  THR   2          HG23      THR   2 -13.924  -2.990  -4.535
  163    H    LEU   3           HN       LEU   3 -10.996  -5.188  -2.428
  164    HA   LEU   3           HA       LEU   3  -8.381  -4.500  -1.705
  165    HB2  LEU   3           HB2      LEU   3 -10.193  -6.785  -0.981
  166    HB3  LEU   3           HB1      LEU   3  -8.536  -6.731  -0.379
  167    HG   LEU   3           HG       LEU   3  -9.078  -4.317   0.356
  168   HD11  LEU   3          HD11      LEU   3 -11.571  -4.086   0.883
  169   HD12  LEU   3          HD12      LEU   3 -11.831  -5.424  -0.237
  170   HD13  LEU   3          HD13      LEU   3 -11.122  -3.916  -0.814
  171   HD21  LEU   3          HD21      LEU   3 -10.300  -5.206   2.417
  172   HD22  LEU   3          HD22      LEU   3  -8.784  -6.015   2.019
  173   HD23  LEU   3          HD23      LEU   3 -10.323  -6.776   1.613
  174    H    GLU   4           HN       GLU   4  -9.588  -7.361  -3.442
  175    HA   GLU   4           HA       GLU   4  -7.147  -8.698  -3.742
  176    HB2  GLU   4           HB2      GLU   4  -9.617  -8.640  -5.482
  177    HB3  GLU   4           HB1      GLU   4  -8.252  -9.717  -5.780
  178    HG2  GLU   4           HG2      GLU   4  -8.518 -10.755  -3.608
  179    HG3  GLU   4           HG1      GLU   4  -9.754  -9.585  -3.153
  180    H    LYS   5           HN       LYS   5  -8.720  -6.324  -5.875
  181    HA   LYS   5           HA       LYS   5  -6.818  -6.322  -7.928
  182    HB2  LYS   5           HB2      LYS   5  -9.000  -5.214  -8.127
  183    HB3  LYS   5           HB1      LYS   5  -8.509  -4.020  -6.925
  184    HG2  LYS   5           HG2      LYS   5  -6.731  -3.216  -8.368
  185    HG3  LYS   5           HG1      LYS   5  -7.048  -4.498  -9.537
  186    HD2  LYS   5           HD2      LYS   5  -8.105  -2.488 -10.359
  187    HD3  LYS   5           HD1      LYS   5  -9.380  -3.570  -9.798
  188    HE2  LYS   5           HE2      LYS   5  -9.519  -2.358  -7.677
  189    HE3  LYS   5           HE1      LYS   5  -8.184  -1.313  -8.163
  190    HZ1  LYS   5           HZ1      LYS   5  -9.669  -0.819 -10.184
  191    HZ2  LYS   5           HZ2      LYS   5 -10.038  -0.076  -8.701
  192    HZ3  LYS   5           HZ3      LYS   5 -10.931  -1.423  -9.225
  193    H    LEU   6           HN       LEU   6  -7.011  -4.310  -4.998
  194    HA   LEU   6           HA       LEU   6  -4.762  -2.715  -5.477
  195    HB2  LEU   6           HB2      LEU   6  -6.355  -2.221  -3.689
  196    HB3  LEU   6           HB1      LEU   6  -5.878  -3.689  -2.836
  197    HG   LEU   6           HG       LEU   6  -3.570  -2.820  -2.636
  198   HD11  LEU   6          HD11      LEU   6  -3.400  -1.429  -4.589
  199   HD12  LEU   6          HD12      LEU   6  -3.249  -0.362  -3.194
  200   HD13  LEU   6          HD13      LEU   6  -4.771  -0.445  -4.082
  201   HD21  LEU   6          HD21      LEU   6  -4.031  -1.197  -0.928
  202   HD22  LEU   6          HD22      LEU   6  -5.395  -2.314  -0.932
  203   HD23  LEU   6          HD23      LEU   6  -5.549  -0.730  -1.693
  204    H    MET   7           HN       MET   7  -5.031  -5.819  -3.759
  205    HA   MET   7           HA       MET   7  -2.354  -6.071  -2.982
  206    HB2  MET   7           HB2      MET   7  -4.161  -7.540  -2.166
  207    HB3  MET   7           HB1      MET   7  -4.279  -8.272  -3.767
  208    HG2  MET   7           HG2      MET   7  -2.895  -9.692  -2.354
  209    HG3  MET   7           HG1      MET   7  -1.877  -8.947  -3.585
  210    HE1  MET   7           HE1      MET   7   0.527  -9.106  -0.583
  211    HE2  MET   7           HE2      MET   7   0.303  -9.403  -2.305
  212    HE3  MET   7           HE3      MET   7  -0.676 -10.282  -1.133
  213    H    LYS   8           HN       LYS   8  -3.981  -7.184  -5.946
  214    HA   LYS   8           HA       LYS   8  -1.790  -8.443  -7.146
  215    HB2  LYS   8           HB2      LYS   8  -4.170  -7.021  -8.350
  216    HB3  LYS   8           HB1      LYS   8  -3.001  -7.934  -9.306
  217    HG2  LYS   8           HG2      LYS   8  -3.474  -9.951  -7.967
  218    HG3  LYS   8           HG1      LYS   8  -4.644  -9.043  -7.010
  219    HD2  LYS   8           HD2      LYS   8  -5.976  -8.608  -9.040
  220    HD3  LYS   8           HD1      LYS   8  -4.807  -9.512 -10.002
  221    HE2  LYS   8           HE2      LYS   8  -5.272 -11.538  -8.676
  222    HE3  LYS   8           HE1      LYS   8  -6.436 -10.638  -7.704
  223    HZ1  LYS   8           HZ1      LYS   8  -7.617 -11.805  -9.390
  224    HZ2  LYS   8           HZ2      LYS   8  -6.594 -11.213 -10.611
  225    HZ3  LYS   8           HZ3      LYS   8  -7.647 -10.158  -9.797
  226    H    ALA   9           HN       ALA   9  -2.904  -5.073  -7.400
  227    HA   ALA   9           HA       ALA   9  -0.986  -4.162  -9.224
  228    HB1  ALA   9           HB1      ALA   9  -2.299  -2.651  -6.953
  229    HB2  ALA   9           HB2      ALA   9  -2.949  -2.837  -8.582
  230    HB3  ALA   9           HB3      ALA   9  -1.466  -1.919  -8.324
  231    H    PHE  10           HN       PHE  10  -0.906  -4.218  -5.666
  232    HA   PHE  10           HA       PHE  10   1.585  -2.992  -5.310
  233    HB2  PHE  10           HB2      PHE  10  -0.332  -4.059  -3.656
  234    HB3  PHE  10           HB1      PHE  10   1.015  -5.175  -3.434
  235    HD1  PHE  10           HD1      PHE  10  -0.348  -2.023  -2.497
  236    HD2  PHE  10           HD2      PHE  10   3.370  -4.089  -3.083
  237    HE1  PHE  10           HE1      PHE  10   0.805  -0.353  -1.070
  238    HE2  PHE  10           HE2      PHE  10   4.523  -2.422  -1.655
  239    HZ   PHE  10           HZ       PHE  10   3.240  -0.554  -0.648
  240    H    GLU  11           HN       GLU  11   0.772  -6.438  -5.679
  241    HA   GLU  11           HA       GLU  11   3.356  -7.481  -5.400
  242    HB2  GLU  11           HB2      GLU  11   0.982  -8.453  -7.001
  243    HB3  GLU  11           HB1      GLU  11   2.464  -9.388  -6.802
  244    HG2  GLU  11           HG2      GLU  11   0.709  -8.375  -4.545
  245    HG3  GLU  11           HG1      GLU  11   0.768 -10.038  -5.126
  246    H    SER  12           HN       SER  12   1.630  -6.420  -8.326
  247    HA   SER  12           HA       SER  12   3.621  -7.052 -10.191
  248    HB2  SER  12           HB2      SER  12   2.529  -5.451 -11.673
  249    HB3  SER  12           HB1      SER  12   1.311  -6.377 -10.804
  250    HG   SER  12           HG       SER  12   2.225  -3.742 -10.301
  251    H    LEU  13           HN       LEU  13   3.057  -4.049  -8.367
  252    HA   LEU  13           HA       LEU  13   5.149  -2.536  -9.453
  253    HB2  LEU  13           HB2      LEU  13   3.424  -1.541  -8.040
  254    HB3  LEU  13           HB1      LEU  13   3.997  -2.468  -6.653
  255    HG   LEU  13           HG       LEU  13   6.083  -0.897  -8.034
  256   HD11  LEU  13          HD11      LEU  13   4.192   0.671  -8.205
  257   HD12  LEU  13          HD12      LEU  13   5.352   1.234  -7.002
  258   HD13  LEU  13          HD13      LEU  13   3.852   0.461  -6.487
  259   HD21  LEU  13          HD21      LEU  13   5.191  -1.392  -5.182
  260   HD22  LEU  13          HD22      LEU  13   6.515  -0.299  -5.586
  261   HD23  LEU  13          HD23      LEU  13   6.633  -2.012  -5.986
  262    H    LYS  14           HN       LYS  14   5.117  -4.672  -6.606
  263    HA   LYS  14           HA       LYS  14   7.757  -4.278  -5.760
  264    HB2  LYS  14           HB2      LYS  14   5.900  -6.652  -5.597
  265    HB3  LYS  14           HB1      LYS  14   7.512  -6.675  -4.886
  266    HG2  LYS  14           HG2      LYS  14   6.976  -4.825  -3.437
  267    HG3  LYS  14           HG1      LYS  14   5.434  -4.564  -4.257
  268    HD2  LYS  14           HD2      LYS  14   4.561  -6.655  -3.469
  269    HD3  LYS  14           HD1      LYS  14   6.143  -7.166  -2.880
  270    HE2  LYS  14           HE2      LYS  14   6.122  -5.498  -1.151
  271    HE3  LYS  14           HE1      LYS  14   4.683  -4.735  -1.821
  272    HZ1  LYS  14           HZ1      LYS  14   4.909  -7.378  -0.510
  273    HZ2  LYS  14           HZ2      LYS  14   3.564  -6.951  -1.456
  274    HZ3  LYS  14           HZ3      LYS  14   3.938  -6.063  -0.057
  275    H    SER  15           HN       SER  15   6.414  -6.680  -8.025
  276    HA   SER  15           HA       SER  15   8.787  -8.058  -8.591
  277    HB2  SER  15           HB2      SER  15   6.376  -7.528 -10.343
  278    HB3  SER  15           HB1      SER  15   7.658  -8.669 -10.740
  279    HG   SER  15           HG       SER  15   5.884  -8.706  -8.527
  280    H    PHE  16           HN       PHE  16   7.322  -5.240 -10.198
  281    HA   PHE  16           HA       PHE  16   9.227  -4.904 -12.220
  282    HB2  PHE  16           HB2      PHE  16   6.991  -3.471 -11.217
  283    HB3  PHE  16           HB1      PHE  16   8.343  -2.341 -11.296
  284    HD1  PHE  16           HD1      PHE  16   6.889  -5.140 -13.342
  285    HD2  PHE  16           HD2      PHE  16   8.682  -1.236 -13.311
  286    HE1  PHE  16           HE1      PHE  16   6.645  -5.008 -15.807
  287    HE2  PHE  16           HE2      PHE  16   8.437  -1.104 -15.775
  288    HZ   PHE  16           HZ       PHE  16   7.420  -2.990 -17.023
  289    H    GLN  17           HN       GLN  17   9.108  -3.522  -8.944
  290    HA   GLN  17           HA       GLN  17  11.422  -1.954  -9.088
  291    HB2  GLN  17           HB2      GLN  17   9.791  -1.837  -7.236
  292    HB3  GLN  17           HB1      GLN  17  10.325  -3.423  -6.679
  293    HG2  GLN  17           HG2      GLN  17  12.593  -2.565  -6.329
  294    HG3  GLN  17           HG1      GLN  17  12.109  -0.986  -6.946
  295   HE21  GLN  17          HE21      GLN  17  13.094  -0.832  -4.438
  296   HE22  GLN  17          HE22      GLN  17  11.863  -0.694  -3.278
  297    H1   ALA   1           HT1      ALA   1   8.392  13.792   3.436
  298    H2   ALA   1           HT2      ALA   1   6.726  14.104   3.311
  299    H3   ALA   1           HT3      ALA   1   7.325  12.542   3.017
  300    HA   ALA   1           HA       ALA   1   8.203  12.692   5.427
  301    HB1  ALA   1           HB1      ALA   1   7.673  15.033   5.790
  302    HB2  ALA   1           HB2      ALA   1   6.623  14.060   6.821
  303    HB3  ALA   1           HB3      ALA   1   5.991  14.763   5.333
  304    H    THR   2           HN       THR   2   4.933  13.057   4.041
  305    HA   THR   2           HA       THR   2   3.725  11.061   5.656
  306    HB   THR   2           HB       THR   2   1.887  11.157   4.006
  307    HG1  THR   2           HG1      THR   2   2.173  12.552   2.222
  308   HG21  THR   2          HG21      THR   2   2.245  12.928   5.785
  309   HG22  THR   2          HG22      THR   2   1.297  13.450   4.393
  310   HG23  THR   2          HG23      THR   2   2.990  13.924   4.535
  311    H    LEU   3           HN       LEU   3   5.188  10.996   2.428
  312    HA   LEU   3           HA       LEU   3   4.500   8.381   1.705
  313    HB2  LEU   3           HB2      LEU   3   6.785  10.193   0.981
  314    HB3  LEU   3           HB1      LEU   3   6.731   8.536   0.379
  315    HG   LEU   3           HG       LEU   3   4.317   9.078  -0.356
  316   HD11  LEU   3          HD11      LEU   3   4.086  11.571  -0.883
  317   HD12  LEU   3          HD12      LEU   3   5.424  11.831   0.237
  318   HD13  LEU   3          HD13      LEU   3   3.916  11.122   0.814
  319   HD21  LEU   3          HD21      LEU   3   5.206  10.300  -2.417
  320   HD22  LEU   3          HD22      LEU   3   6.015   8.784  -2.019
  321   HD23  LEU   3          HD23      LEU   3   6.776  10.323  -1.613
  322    H    GLU   4           HN       GLU   4   7.361   9.588   3.442
  323    HA   GLU   4           HA       GLU   4   8.698   7.147   3.742
  324    HB2  GLU   4           HB2      GLU   4   8.640   9.617   5.482
  325    HB3  GLU   4           HB1      GLU   4   9.717   8.252   5.780
  326    HG2  GLU   4           HG2      GLU   4  10.755   8.518   3.608
  327    HG3  GLU   4           HG1      GLU   4   9.585   9.754   3.153
  328    H    LYS   5           HN       LYS   5   6.324   8.720   5.875
  329    HA   LYS   5           HA       LYS   5   6.327   6.812   7.922
  330    HB2  LYS   5           HB2      LYS   5   5.236   9.017   8.107
  331    HB3  LYS   5           HB1      LYS   5   4.003   8.496   6.960
  332    HG2  LYS   5           HG2      LYS   5   3.004   7.062   8.470
  333    HG3  LYS   5           HG1      LYS   5   4.507   6.770   9.346
  334    HD2  LYS   5           HD2      LYS   5   3.002   8.123  10.725
  335    HD3  LYS   5           HD1      LYS   5   4.402   9.084  10.252
  336    HE2  LYS   5           HE2      LYS   5   3.075  10.065   8.393
  337    HE3  LYS   5           HE1      LYS   5   1.672   9.143   8.933
  338    HZ1  LYS   5           HZ1      LYS   5   2.418  10.332  11.203
  339    HZ2  LYS   5           HZ2      LYS   5   1.270  10.982  10.133
  340    HZ3  LYS   5           HZ3      LYS   5   2.883  11.513  10.079
  341    H    LEU   6           HN       LEU   6   4.310   7.011   4.998
  342    HA   LEU   6           HA       LEU   6   2.714   4.762   5.476
  343    HB2  LEU   6           HB2      LEU   6   2.221   6.356   3.688
  344    HB3  LEU   6           HB1      LEU   6   3.690   5.880   2.836
  345    HG   LEU   6           HG       LEU   6   2.823   3.572   2.634
  346   HD11  LEU   6          HD11      LEU   6   1.430   3.388   4.579
  347   HD12  LEU   6          HD12      LEU   6   0.358   3.261   3.187
  348   HD13  LEU   6          HD13      LEU   6   0.455   4.772   4.090
  349   HD21  LEU   6          HD21      LEU   6   1.203   4.032   0.925
  350   HD22  LEU   6          HD22      LEU   6   2.317   5.400   0.933
  351   HD23  LEU   6          HD23      LEU   6   0.732   5.549   1.691
  352    H    MET   7           HN       MET   7   5.819   5.031   3.759
  353    HA   MET   7           HA       MET   7   6.071   2.354   2.982
  354    HB2  MET   7           HB2      MET   7   7.540   4.161   2.166
  355    HB3  MET   7           HB1      MET   7   8.272   4.279   3.767
  356    HG2  MET   7           HG2      MET   7   9.692   2.895   2.354
  357    HG3  MET   7           HG1      MET   7   8.947   1.877   3.585
  358    HE1  MET   7           HE1      MET   7   9.106  -0.527   0.583
  359    HE2  MET   7           HE2      MET   7   9.403  -0.303   2.305
  360    HE3  MET   7           HE3      MET   7  10.282   0.676   1.133
  361    H    LYS   8           HN       LYS   8   7.184   3.981   5.946
  362    HA   LYS   8           HA       LYS   8   8.443   1.790   7.146
  363    HB2  LYS   8           HB2      LYS   8   7.021   4.170   8.350
  364    HB3  LYS   8           HB1      LYS   8   7.934   3.001   9.306
  365    HG2  LYS   8           HG2      LYS   8   9.951   3.474   7.967
  366    HG3  LYS   8           HG1      LYS   8   9.043   4.644   7.010
  367    HD2  LYS   8           HD2      LYS   8   8.608   5.976   9.040
  368    HD3  LYS   8           HD1      LYS   8   9.512   4.807  10.002
  369    HE2  LYS   8           HE2      LYS   8  11.538   5.272   8.676
  370    HE3  LYS   8           HE1      LYS   8  10.638   6.436   7.704
  371    HZ1  LYS   8           HZ1      LYS   8  11.805   7.617   9.390
  372    HZ2  LYS   8           HZ2      LYS   8  11.213   6.594  10.611
  373    HZ3  LYS   8           HZ3      LYS   8  10.158   7.647   9.797
  374    H    ALA   9           HN       ALA   9   5.073   2.904   7.400
  375    HA   ALA   9           HA       ALA   9   4.162   0.986   9.224
  376    HB1  ALA   9           HB1      ALA   9   2.651   2.299   6.953
  377    HB2  ALA   9           HB2      ALA   9   2.837   2.949   8.582
  378    HB3  ALA   9           HB3      ALA   9   1.919   1.466   8.324
  379    H    PHE  10           HN       PHE  10   4.218   0.906   5.666
  380    HA   PHE  10           HA       PHE  10   2.992  -1.585   5.309
  381    HB2  PHE  10           HB2      PHE  10   4.058   0.332   3.656
  382    HB3  PHE  10           HB1      PHE  10   5.177  -1.013   3.436
  383    HD1  PHE  10           HD1      PHE  10   1.913   0.296   2.661
  384    HD2  PHE  10           HD2      PHE  10   4.207  -3.323   2.918
  385    HE1  PHE  10           HE1      PHE  10   0.247  -0.861   1.234
  386    HE2  PHE  10           HE2      PHE  10   2.544  -4.481   1.489
  387    HZ   PHE  10           HZ       PHE  10   0.563  -3.250   0.647
  388    H    GLU  11           HN       GLU  11   6.438  -0.772   5.679
  389    HA   GLU  11           HA       GLU  11   7.481  -3.356   5.400
  390    HB2  GLU  11           HB2      GLU  11   8.453  -0.982   7.001
  391    HB3  GLU  11           HB1      GLU  11   9.388  -2.464   6.802
  392    HG2  GLU  11           HG2      GLU  11   8.375  -0.709   4.545
  393    HG3  GLU  11           HG1      GLU  11  10.038  -0.768   5.126
  394    H    SER  12           HN       SER  12   6.420  -1.630   8.326
  395    HA   SER  12           HA       SER  12   7.053  -3.621  10.191
  396    HB2  SER  12           HB2      SER  12   5.441  -2.535  11.668
  397    HB3  SER  12           HB1      SER  12   6.385  -1.320  10.812
  398    HG   SER  12           HG       SER  12   4.674  -0.851   9.571
  399    H    LEU  13           HN       LEU  13   4.049  -3.057   8.367
  400    HA   LEU  13           HA       LEU  13   2.538  -5.150   9.454
  401    HB2  LEU  13           HB2      LEU  13   1.537  -3.425   8.049
  402    HB3  LEU  13           HB1      LEU  13   2.462  -3.991   6.658
  403    HG   LEU  13           HG       LEU  13   0.893  -6.082   8.035
  404   HD11  LEU  13          HD11      LEU  13  -0.678  -4.195   8.206
  405   HD12  LEU  13          HD12      LEU  13  -1.235  -5.352   6.997
  406   HD13  LEU  13          HD13      LEU  13  -0.463  -3.850   6.489
  407   HD21  LEU  13          HD21      LEU  13   1.393  -5.188   5.186
  408   HD22  LEU  13          HD22      LEU  13   0.301  -6.513   5.586
  409   HD23  LEU  13          HD23      LEU  13   2.014  -6.630   5.989
  410    H    LYS  14           HN       LYS  14   4.672  -5.117   6.606
  411    HA   LYS  14           HA       LYS  14   4.278  -7.757   5.760
  412    HB2  LYS  14           HB2      LYS  14   6.647  -5.896   5.593
  413    HB3  LYS  14           HB1      LYS  14   6.682  -7.513   4.895
  414    HG2  LYS  14           HG2      LYS  14   4.838  -6.999   3.431
  415    HG3  LYS  14           HG1      LYS  14   4.560  -5.455   4.242
  416    HD2  LYS  14           HD2      LYS  14   6.640  -4.563   3.456
  417    HD3  LYS  14           HD1      LYS  14   7.180  -6.144   2.893
  418    HE2  LYS  14           HE2      LYS  14   5.556  -6.168   1.135
  419    HE3  LYS  14           HE1      LYS  14   4.729  -4.758   1.789
  420    HZ1  LYS  14           HZ1      LYS  14   7.384  -4.894   0.497
  421    HZ2  LYS  14           HZ2      LYS  14   6.932  -3.574   1.467
  422    HZ3  LYS  14           HZ3      LYS  14   6.049  -3.941   0.063
  423    H    SER  15           HN       SER  15   6.680  -6.414   8.025
  424    HA   SER  15           HA       SER  15   8.058  -8.786   8.591
  425    HB2  SER  15           HB2      SER  15   7.529  -6.375  10.343
  426    HB3  SER  15           HB1      SER  15   8.670  -7.659  10.740
  427    HG   SER  15           HG       SER  15   9.006  -5.545   9.147
  428    H    PHE  16           HN       PHE  16   5.240  -7.322  10.198
  429    HA   PHE  16           HA       PHE  16   4.907  -9.233  12.215
  430    HB2  PHE  16           HB2      PHE  16   2.832  -7.561  10.775
  431    HB3  PHE  16           HB1      PHE  16   2.531  -8.470  12.256
  432    HD1  PHE  16           HD1      PHE  16   2.771  -5.293  11.397
  433    HD2  PHE  16           HD2      PHE  16   5.026  -8.077  13.767
  434    HE1  PHE  16           HE1      PHE  16   3.692  -3.414  12.728
  435    HE2  PHE  16           HE2      PHE  16   5.946  -6.199  15.098
  436    HZ   PHE  16           HZ       PHE  16   5.280  -3.867  14.578
  437    H    GLN  17           HN       GLN  17   3.522  -9.108   8.944
  438    HA   GLN  17           HA       GLN  17   1.954 -11.422   9.088
  439    HB2  GLN  17           HB2      GLN  17   1.837  -9.791   7.236
  440    HB3  GLN  17           HB1      GLN  17   3.423 -10.325   6.679
  441    HG2  GLN  17           HG2      GLN  17   2.565 -12.593   6.329
  442    HG3  GLN  17           HG1      GLN  17   0.986 -12.109   6.946
  443   HE21  GLN  17          HE21      GLN  17   0.832 -13.094   4.438
  444   HE22  GLN  17          HE22      GLN  17   0.694 -11.863   3.278
  445    H1   ALA   1           HT1      ALA   1  -8.392 -13.792   3.436
  446    H2   ALA   1           HT2      ALA   1  -6.726 -14.104   3.311
  447    H3   ALA   1           HT3      ALA   1  -7.325 -12.542   3.017
  448    HA   ALA   1           HA       ALA   1  -8.203 -12.692   5.427
  449    HB1  ALA   1           HB1      ALA   1  -7.673 -15.033   5.790
  450    HB2  ALA   1           HB2      ALA   1  -6.623 -14.060   6.821
  451    HB3  ALA   1           HB3      ALA   1  -5.991 -14.763   5.333
  452    H    THR   2           HN       THR   2  -4.933 -13.057   4.041
  453    HA   THR   2           HA       THR   2  -3.725 -11.061   5.656
  454    HB   THR   2           HB       THR   2  -1.887 -11.157   4.006
  455    HG1  THR   2           HG1      THR   2  -2.173 -12.552   2.222
  456   HG21  THR   2          HG21      THR   2  -2.245 -12.928   5.785
  457   HG22  THR   2          HG22      THR   2  -1.297 -13.450   4.393
  458   HG23  THR   2          HG23      THR   2  -2.990 -13.924   4.535
  459    H    LEU   3           HN       LEU   3  -5.188 -10.996   2.428
  460    HA   LEU   3           HA       LEU   3  -4.500  -8.381   1.705
  461    HB2  LEU   3           HB2      LEU   3  -6.785 -10.193   0.981
  462    HB3  LEU   3           HB1      LEU   3  -6.731  -8.536   0.379
  463    HG   LEU   3           HG       LEU   3  -4.317  -9.078  -0.356
  464   HD11  LEU   3          HD11      LEU   3  -4.086 -11.571  -0.883
  465   HD12  LEU   3          HD12      LEU   3  -5.424 -11.831   0.237
  466   HD13  LEU   3          HD13      LEU   3  -3.916 -11.122   0.814
  467   HD21  LEU   3          HD21      LEU   3  -5.206 -10.300  -2.417
  468   HD22  LEU   3          HD22      LEU   3  -6.015  -8.784  -2.019
  469   HD23  LEU   3          HD23      LEU   3  -6.776 -10.323  -1.613
  470    H    GLU   4           HN       GLU   4  -7.361  -9.588   3.442
  471    HA   GLU   4           HA       GLU   4  -8.698  -7.147   3.742
  472    HB2  GLU   4           HB2      GLU   4  -8.640  -9.617   5.482
  473    HB3  GLU   4           HB1      GLU   4  -9.717  -8.252   5.780
  474    HG2  GLU   4           HG2      GLU   4 -10.755  -8.518   3.608
  475    HG3  GLU   4           HG1      GLU   4  -9.585  -9.754   3.153
  476    H    LYS   5           HN       LYS   5  -6.324  -8.720   5.875
  477    HA   LYS   5           HA       LYS   5  -6.322  -6.818   7.928
  478    HB2  LYS   5           HB2      LYS   5  -5.214  -9.000   8.127
  479    HB3  LYS   5           HB1      LYS   5  -4.020  -8.509   6.925
  480    HG2  LYS   5           HG2      LYS   5  -3.216  -6.731   8.368
  481    HG3  LYS   5           HG1      LYS   5  -4.498  -7.048   9.537
  482    HD2  LYS   5           HD2      LYS   5  -2.488  -8.105  10.359
  483    HD3  LYS   5           HD1      LYS   5  -3.570  -9.380   9.798
  484    HE2  LYS   5           HE2      LYS   5  -2.358  -9.519   7.677
  485    HE3  LYS   5           HE1      LYS   5  -1.313  -8.184   8.163
  486    HZ1  LYS   5           HZ1      LYS   5  -0.819  -9.669  10.184
  487    HZ2  LYS   5           HZ2      LYS   5  -0.076 -10.038   8.701
  488    HZ3  LYS   5           HZ3      LYS   5  -1.423 -10.931   9.225
  489    H    LEU   6           HN       LEU   6  -4.310  -7.011   4.998
  490    HA   LEU   6           HA       LEU   6  -2.714  -4.762   5.477
  491    HB2  LEU   6           HB2      LEU   6  -2.221  -6.354   3.689
  492    HB3  LEU   6           HB1      LEU   6  -3.689  -5.879   2.836
  493    HG   LEU   6           HG       LEU   6  -2.821  -3.570   2.635
  494   HD11  LEU   6          HD11      LEU   6  -1.431  -3.395   4.586
  495   HD12  LEU   6          HD12      LEU   6  -0.361  -3.252   3.193
  496   HD13  LEU   6          HD13      LEU   6  -0.449  -4.770   4.085
  497   HD21  LEU   6          HD21      LEU   6  -1.196  -4.032   0.927
  498   HD22  LEU   6          HD22      LEU   6  -2.315  -5.394   0.931
  499   HD23  LEU   6          HD23      LEU   6  -0.732  -5.552   1.692
  500    H    MET   7           HN       MET   7  -5.819  -5.031   3.759
  501    HA   MET   7           HA       MET   7  -6.071  -2.354   2.982
  502    HB2  MET   7           HB2      MET   7  -7.540  -4.161   2.166
  503    HB3  MET   7           HB1      MET   7  -8.272  -4.279   3.767
  504    HG2  MET   7           HG2      MET   7  -9.692  -2.895   2.354
  505    HG3  MET   7           HG1      MET   7  -8.947  -1.877   3.585
  506    HE1  MET   7           HE1      MET   7  -9.106   0.527   0.583
  507    HE2  MET   7           HE2      MET   7  -9.403   0.303   2.305
  508    HE3  MET   7           HE3      MET   7 -10.282  -0.676   1.133
  509    H    LYS   8           HN       LYS   8  -7.184  -3.981   5.946
  510    HA   LYS   8           HA       LYS   8  -8.443  -1.790   7.146
  511    HB2  LYS   8           HB2      LYS   8  -7.021  -4.170   8.350
  512    HB3  LYS   8           HB1      LYS   8  -7.934  -3.001   9.306
  513    HG2  LYS   8           HG2      LYS   8  -9.951  -3.474   7.967
  514    HG3  LYS   8           HG1      LYS   8  -9.043  -4.644   7.010
  515    HD2  LYS   8           HD2      LYS   8  -8.608  -5.976   9.040
  516    HD3  LYS   8           HD1      LYS   8  -9.512  -4.807  10.002
  517    HE2  LYS   8           HE2      LYS   8 -11.538  -5.272   8.676
  518    HE3  LYS   8           HE1      LYS   8 -10.638  -6.436   7.704
  519    HZ1  LYS   8           HZ1      LYS   8 -11.805  -7.617   9.390
  520    HZ2  LYS   8           HZ2      LYS   8 -11.213  -6.594  10.611
  521    HZ3  LYS   8           HZ3      LYS   8 -10.158  -7.647   9.797
  522    H    ALA   9           HN       ALA   9  -5.073  -2.904   7.400
  523    HA   ALA   9           HA       ALA   9  -4.162  -0.986   9.224
  524    HB1  ALA   9           HB1      ALA   9  -2.651  -2.299   6.953
  525    HB2  ALA   9           HB2      ALA   9  -2.837  -2.949   8.582
  526    HB3  ALA   9           HB3      ALA   9  -1.919  -1.466   8.324
  527    H    PHE  10           HN       PHE  10  -4.218  -0.906   5.666
  528    HA   PHE  10           HA       PHE  10  -2.992   1.585   5.310
  529    HB2  PHE  10           HB2      PHE  10  -4.059  -0.332   3.656
  530    HB3  PHE  10           HB1      PHE  10  -5.176   1.014   3.435
  531    HD1  PHE  10           HD1      PHE  10  -2.063  -0.358   2.439
  532    HD2  PHE  10           HD2      PHE  10  -4.053   3.382   3.136
  533    HE1  PHE  10           HE1      PHE  10  -0.397   0.795   1.010
  534    HE2  PHE  10           HE2      PHE  10  -2.389   4.535   1.706
  535    HZ   PHE  10           HZ       PHE  10  -0.560   3.242   0.642
  536    H    GLU  11           HN       GLU  11  -6.438   0.772   5.679
  537    HA   GLU  11           HA       GLU  11  -7.481   3.356   5.400
  538    HB2  GLU  11           HB2      GLU  11  -8.453   0.982   7.001
  539    HB3  GLU  11           HB1      GLU  11  -9.388   2.464   6.802
  540    HG2  GLU  11           HG2      GLU  11  -8.375   0.709   4.545
  541    HG3  GLU  11           HG1      GLU  11 -10.038   0.768   5.126
  542    H    SER  12           HN       SER  12  -6.420   1.630   8.326
  543    HA   SER  12           HA       SER  12  -7.053   3.622  10.190
  544    HB2  SER  12           HB2      SER  12  -5.440   2.535  11.668
  545    HB3  SER  12           HB1      SER  12  -6.389   1.323  10.814
  546    HG   SER  12           HG       SER  12  -3.708   2.060  10.525
  547    H    LEU  13           HN       LEU  13  -4.049   3.057   8.367
  548    HA   LEU  13           HA       LEU  13  -2.535   5.149   9.452
  549    HB2  LEU  13           HB2      LEU  13  -1.542   3.424   8.038
  550    HB3  LEU  13           HB1      LEU  13  -2.470   3.999   6.652
  551    HG   LEU  13           HG       LEU  13  -0.898   6.083   8.033
  552   HD11  LEU  13          HD11      LEU  13   0.667   4.188   8.204
  553   HD12  LEU  13          HD12      LEU  13   1.234   5.353   7.007
  554   HD13  LEU  13          HD13      LEU  13   0.462   3.856   6.484
  555   HD21  LEU  13          HD21      LEU  13  -1.392   5.192   5.181
  556   HD22  LEU  13          HD22      LEU  13  -0.299   6.515   5.585
  557   HD23  LEU  13          HD23      LEU  13  -2.012   6.634   5.984
  558    H    LYS  14           HN       LYS  14  -4.672   5.117   6.606
  559    HA   LYS  14           HA       LYS  14  -4.278   7.757   5.761
  560    HB2  LYS  14           HB2      LYS  14  -6.652   5.901   5.597
  561    HB3  LYS  14           HB1      LYS  14  -6.672   7.511   4.883
  562    HG2  LYS  14           HG2      LYS  14  -4.816   6.973   3.441
  563    HG3  LYS  14           HG1      LYS  14  -4.563   5.430   4.262
  564    HD2  LYS  14           HD2      LYS  14  -6.658   4.565   3.467
  565    HD3  LYS  14           HD1      LYS  14  -7.155   6.149   2.871
  566    HE2  LYS  14           HE2      LYS  14  -5.468   6.114   1.157
  567    HE3  LYS  14           HE1      LYS  14  -4.730   4.665   1.832
  568    HZ1  LYS  14           HZ1      LYS  14  -7.365   4.924   0.508
  569    HZ2  LYS  14           HZ2      LYS  14  -6.949   3.568   1.444
  570    HZ3  LYS  14           HZ3      LYS  14  -6.055   3.948   0.050
  571    H    SER  15           HN       SER  15  -6.680   6.414   8.025
  572    HA   SER  15           HA       SER  15  -8.058   8.787   8.591
  573    HB2  SER  15           HB2      SER  15  -8.869   6.580   9.304
  574    HB3  SER  15           HB1      SER  15  -7.511   6.429  10.415
  575    HG   SER  15           HG       SER  15  -8.341   8.019  11.654
  576    H    PHE  16           HN       PHE  16  -5.240   7.322  10.198
  577    HA   PHE  16           HA       PHE  16  -4.900   9.224  12.222
  578    HB2  PHE  16           HB2      PHE  16  -3.682   7.133  12.254
  579    HB3  PHE  16           HB1      PHE  16  -2.868   7.537  10.744
  580    HD1  PHE  16           HD1      PHE  16  -3.315   8.695  14.271
  581    HD2  PHE  16           HD2      PHE  16  -0.853   8.755  10.751
  582    HE1  PHE  16           HE1      PHE  16  -1.527   9.855  15.540
  583    HE2  PHE  16           HE2      PHE  16   0.935   9.915  12.023
  584    HZ   PHE  16           HZ       PHE  16   0.597  10.463  14.416
  585    H    GLN  17           HN       GLN  17  -3.522   9.108   8.944
  586    HA   GLN  17           HA       GLN  17  -1.954  11.422   9.088
  587    HB2  GLN  17           HB2      GLN  17  -1.838   9.790   7.236
  588    HB3  GLN  17           HB1      GLN  17  -3.424  10.325   6.679
  589    HG2  GLN  17           HG2      GLN  17  -2.563  12.593   6.329
  590    HG3  GLN  17           HG1      GLN  17  -0.985  12.107   6.945
  591   HE21  GLN  17          HE21      GLN  17  -0.833  13.092   4.436
  592   HE22  GLN  17          HE22      GLN  17  -0.693  11.859   3.277
  Start of MODEL    9
    1    H1   ALA   1           HT1      ALA   1  13.712   8.417  -7.377
    2    H2   ALA   1           HT2      ALA   1  14.069   9.721  -6.348
    3    H3   ALA   1           HT3      ALA   1  12.456   9.256  -6.607
    4    HA   ALA   1           HA       ALA   1  14.509   7.555  -5.305
    5    HB1  ALA   1           HB1      ALA   1  14.123   9.266  -3.743
    6    HB2  ALA   1           HB2      ALA   1  12.929   8.051  -3.287
    7    HB3  ALA   1           HB3      ALA   1  12.439   9.459  -4.229
    8    H    THR   2           HN       THR   2  13.653   5.595  -4.495
    9    HA   THR   2           HA       THR   2  11.690   4.367  -6.127
   10    HB   THR   2           HB       THR   2  11.902   2.462  -4.568
   11    HG1  THR   2           HG1      THR   2  12.163   3.245  -2.600
   12   HG21  THR   2          HG21      THR   2  14.372   2.164  -4.814
   13   HG22  THR   2          HG22      THR   2  14.492   3.856  -5.296
   14   HG23  THR   2          HG23      THR   2  13.594   2.716  -6.297
   15    H    LEU   3           HN       LEU   3  11.596   5.710  -2.851
   16    HA   LEU   3           HA       LEU   3   9.037   4.849  -2.104
   17    HB2  LEU   3           HB2      LEU   3  10.457   7.429  -1.392
   18    HB3  LEU   3           HB1      LEU   3   9.065   6.762  -0.540
   19    HG   LEU   3           HG       LEU   3  11.728   5.348  -0.875
   20   HD11  LEU   3          HD11      LEU   3  12.048   7.199   0.620
   21   HD12  LEU   3          HD12      LEU   3  11.851   5.766   1.630
   22   HD13  LEU   3          HD13      LEU   3  10.510   6.893   1.427
   23   HD21  LEU   3          HD21      LEU   3  10.726   3.868   0.919
   24   HD22  LEU   3          HD22      LEU   3   9.933   3.748  -0.650
   25   HD23  LEU   3          HD23      LEU   3   9.188   4.686   0.645
   26    H    GLU   4           HN       GLU   4  10.045   7.824  -3.777
   27    HA   GLU   4           HA       GLU   4   7.526   9.024  -3.996
   28    HB2  GLU   4           HB2      GLU   4   9.963   9.162  -5.778
   29    HB3  GLU   4           HB1      GLU   4   8.533  10.166  -6.021
   30    HG2  GLU   4           HG2      GLU   4   8.778  11.153  -3.822
   31    HG3  GLU   4           HG1      GLU   4  10.089  10.044  -3.424
   32    H    LYS   5           HN       LYS   5   9.196   6.810  -6.225
   33    HA   LYS   5           HA       LYS   5   7.261   6.755  -8.247
   34    HB2  LYS   5           HB2      LYS   5   9.505   5.783  -8.505
   35    HB3  LYS   5           HB1      LYS   5   9.094   4.520  -7.343
   36    HG2  LYS   5           HG2      LYS   5   7.283   3.738  -8.811
   37    HG3  LYS   5           HG1      LYS   5   7.657   5.016  -9.968
   38    HD2  LYS   5           HD2      LYS   5   9.929   4.082 -10.258
   39    HD3  LYS   5           HD1      LYS   5   9.537   2.791  -9.121
   40    HE2  LYS   5           HE2      LYS   5   8.055   3.323 -11.713
   41    HE3  LYS   5           HE1      LYS   5   9.269   2.065 -11.485
   42    HZ1  LYS   5           HZ1      LYS   5   7.340   0.929 -11.069
   43    HZ2  LYS   5           HZ2      LYS   5   6.562   2.263 -10.360
   44    HZ3  LYS   5           HZ3      LYS   5   7.756   1.415  -9.499
   45    H    LEU   6           HN       LEU   6   7.623   4.675  -5.382
   46    HA   LEU   6           HA       LEU   6   5.464   2.961  -5.868
   47    HB2  LEU   6           HB2      LEU   6   7.114   2.515  -4.122
   48    HB3  LEU   6           HB1      LEU   6   6.570   3.932  -3.223
   49    HG   LEU   6           HG       LEU   6   4.421   2.047  -3.960
   50   HD11  LEU   6          HD11      LEU   6   6.281   0.480  -3.440
   51   HD12  LEU   6          HD12      LEU   6   5.004   0.416  -2.225
   52   HD13  LEU   6          HD13      LEU   6   6.501   1.286  -1.886
   53   HD21  LEU   6          HD21      LEU   6   3.908   3.891  -2.519
   54   HD22  LEU   6          HD22      LEU   6   5.303   3.563  -1.491
   55   HD23  LEU   6          HD23      LEU   6   3.925   2.462  -1.486
   56    H    MET   7           HN       MET   7   5.581   6.026  -4.066
   57    HA   MET   7           HA       MET   7   2.909   6.100  -3.237
   58    HB2  MET   7           HB2      MET   7   4.641   7.651  -2.413
   59    HB3  MET   7           HB1      MET   7   4.689   8.430  -3.995
   60    HG2  MET   7           HG2      MET   7   3.246   9.749  -2.576
   61    HG3  MET   7           HG1      MET   7   2.225   8.913  -3.743
   62    HE1  MET   7           HE1      MET   7   1.115  10.239  -1.406
   63    HE2  MET   7           HE2      MET   7   0.141   9.115  -0.462
   64    HE3  MET   7           HE3      MET   7  -0.021   9.152  -2.216
   65    H    LYS   8           HN       LYS   8   4.414   7.391  -6.192
   66    HA   LYS   8           HA       LYS   8   2.132   8.554  -7.320
   67    HB2  LYS   8           HB2      LYS   8   4.571   7.311  -8.603
   68    HB3  LYS   8           HB1      LYS   8   3.333   8.178  -9.514
   69    HG2  LYS   8           HG2      LYS   8   3.707  10.181  -8.120
   70    HG3  LYS   8           HG1      LYS   8   4.952   9.318  -7.216
   71    HD2  LYS   8           HD2      LYS   8   6.285   9.047  -9.255
   72    HD3  LYS   8           HD1      LYS   8   5.027   9.844 -10.202
   73    HE2  LYS   8           HE2      LYS   8   6.805  11.445  -9.663
   74    HE3  LYS   8           HE1      LYS   8   5.318  11.892  -8.827
   75    HZ1  LYS   8           HZ1      LYS   8   6.142  11.245  -6.812
   76    HZ2  LYS   8           HZ2      LYS   8   7.571  11.788  -7.554
   77    HZ3  LYS   8           HZ3      LYS   8   7.230  10.125  -7.474
   78    H    ALA   9           HN       ALA   9   3.437   5.264  -7.693
   79    HA   ALA   9           HA       ALA   9   1.540   4.297  -9.513
   80    HB1  ALA   9           HB1      ALA   9   3.138   2.907  -7.359
   81    HB2  ALA   9           HB2      ALA   9   3.483   2.980  -9.087
   82    HB3  ALA   9           HB3      ALA   9   2.111   2.040  -8.501
   83    H    PHE  10           HN       PHE  10   1.524   4.243  -5.954
   84    HA   PHE  10           HA       PHE  10  -0.887   2.864  -5.600
   85    HB2  PHE  10           HB2      PHE  10   0.702   3.361  -3.770
   86    HB3  PHE  10           HB1      PHE  10   0.237   5.062  -3.851
   87    HD1  PHE  10           HD1      PHE  10  -1.048   1.628  -3.229
   88    HD2  PHE  10           HD2      PHE  10  -1.783   5.844  -2.854
   89    HE1  PHE  10           HE1      PHE  10  -3.019   1.157  -1.804
   90    HE2  PHE  10           HE2      PHE  10  -3.755   5.371  -1.425
   91    HZ   PHE  10           HZ       PHE  10  -4.372   3.026  -0.902
   92    H    GLU  11           HN       GLU  11  -0.281   6.360  -5.872
   93    HA   GLU  11           HA       GLU  11  -2.915   7.240  -5.519
   94    HB2  GLU  11           HB2      GLU  11  -0.628   8.393  -7.125
   95    HB3  GLU  11           HB1      GLU  11  -2.159   9.234  -6.883
   96    HG2  GLU  11           HG2      GLU  11  -0.315   8.268  -4.677
   97    HG3  GLU  11           HG1      GLU  11  -0.482   9.939  -5.212
   98    H    SER  12           HN       SER  12  -1.184   6.368  -8.504
   99    HA   SER  12           HA       SER  12  -3.242   6.937 -10.317
  100    HB2  SER  12           HB2      SER  12  -2.092   5.432 -11.858
  101    HB3  SER  12           HB1      SER  12  -0.921   6.429 -11.000
  102    HG   SER  12           HG       SER  12  -0.329   4.716  -9.804
  103    H    LEU  13           HN       LEU  13  -2.472   3.919  -8.594
  104    HA   LEU  13           HA       LEU  13  -4.489   2.318  -9.691
  105    HB2  LEU  13           HB2      LEU  13  -2.677   1.397  -8.327
  106    HB3  LEU  13           HB1      LEU  13  -3.295   2.241  -6.908
  107    HG   LEU  13           HG       LEU  13  -5.414   0.971  -7.085
  108   HD11  LEU  13          HD11      LEU  13  -5.356  -1.044  -8.651
  109   HD12  LEU  13          HD12      LEU  13  -3.980  -0.275  -9.441
  110   HD13  LEU  13          HD13      LEU  13  -5.552   0.524  -9.433
  111   HD21  LEU  13          HD21      LEU  13  -4.394  -1.314  -6.588
  112   HD22  LEU  13          HD22      LEU  13  -3.761   0.023  -5.628
  113   HD23  LEU  13          HD23      LEU  13  -2.830  -0.606  -6.987
  114    H    LYS  14           HN       LYS  14  -4.532   4.368  -6.782
  115    HA   LYS  14           HA       LYS  14  -7.133   3.783  -5.934
  116    HB2  LYS  14           HB2      LYS  14  -5.324   6.150  -5.573
  117    HB3  LYS  14           HB1      LYS  14  -6.990   6.216  -4.996
  118    HG2  LYS  14           HG2      LYS  14  -5.219   3.873  -4.317
  119    HG3  LYS  14           HG1      LYS  14  -5.170   5.354  -3.357
  120    HD2  LYS  14           HD2      LYS  14  -7.598   5.194  -2.967
  121    HD3  LYS  14           HD1      LYS  14  -7.661   3.721  -3.933
  122    HE2  LYS  14           HE2      LYS  14  -5.953   4.030  -1.452
  123    HE3  LYS  14           HE1      LYS  14  -7.563   3.313  -1.450
  124    HZ1  LYS  14           HZ1      LYS  14  -5.277   2.356  -3.086
  125    HZ2  LYS  14           HZ2      LYS  14  -6.819   1.647  -3.001
  126    HZ3  LYS  14           HZ3      LYS  14  -5.803   1.644  -1.640
  127    H    SER  15           HN       SER  15  -5.969   6.337  -8.118
  128    HA   SER  15           HA       SER  15  -8.428   7.589  -8.602
  129    HB2  SER  15           HB2      SER  15  -6.023   7.255 -10.409
  130    HB3  SER  15           HB1      SER  15  -7.376   8.329 -10.750
  131    HG   SER  15           HG       SER  15  -5.479   9.237  -9.607
  132    H    PHE  16           HN       PHE  16  -6.830   4.911 -10.318
  133    HA   PHE  16           HA       PHE  16  -8.749   4.523 -12.319
  134    HB2  PHE  16           HB2      PHE  16  -6.568   3.425 -12.384
  135    HB3  PHE  16           HB1      PHE  16  -6.982   2.478 -10.954
  136    HD1  PHE  16           HD1      PHE  16  -7.935   3.133 -14.493
  137    HD2  PHE  16           HD2      PHE  16  -8.307   0.506 -11.116
  138    HE1  PHE  16           HE1      PHE  16  -9.051   1.446 -15.928
  139    HE2  PHE  16           HE2      PHE  16  -9.422  -1.179 -12.551
  140    HZ   PHE  16           HZ       PHE  16  -9.794  -0.711 -14.956
  141    H    GLN  17           HN       GLN  17  -8.490   3.054  -9.088
  142    HA   GLN  17           HA       GLN  17 -10.712   1.358  -9.243
  143    HB2  GLN  17           HB2      GLN  17  -8.890   1.581  -7.402
  144    HB3  GLN  17           HB1      GLN  17  -9.976   2.782  -6.701
  145    HG2  GLN  17           HG2      GLN  17 -11.014   0.078  -7.523
  146    HG3  GLN  17           HG1      GLN  17 -10.234   0.300  -5.958
  147   HE21  GLN  17          HE21      GLN  17 -13.128  -0.276  -6.518
  148   HE22  GLN  17          HE22      GLN  17 -13.987   1.006  -5.809
  149    H1   ALA   1           HT1      ALA   1 -13.712  -8.417  -7.377
  150    H2   ALA   1           HT2      ALA   1 -14.069  -9.721  -6.348
  151    H3   ALA   1           HT3      ALA   1 -12.456  -9.256  -6.607
  152    HA   ALA   1           HA       ALA   1 -14.509  -7.555  -5.305
  153    HB1  ALA   1           HB1      ALA   1 -14.123  -9.266  -3.743
  154    HB2  ALA   1           HB2      ALA   1 -12.929  -8.051  -3.287
  155    HB3  ALA   1           HB3      ALA   1 -12.439  -9.459  -4.229
  156    H    THR   2           HN       THR   2 -13.653  -5.595  -4.495
  157    HA   THR   2           HA       THR   2 -11.690  -4.367  -6.127
  158    HB   THR   2           HB       THR   2 -11.902  -2.462  -4.568
  159    HG1  THR   2           HG1      THR   2 -12.163  -3.245  -2.600
  160   HG21  THR   2          HG21      THR   2 -14.372  -2.164  -4.814
  161   HG22  THR   2          HG22      THR   2 -14.492  -3.856  -5.296
  162   HG23  THR   2          HG23      THR   2 -13.594  -2.716  -6.297
  163    H    LEU   3           HN       LEU   3 -11.596  -5.710  -2.851
  164    HA   LEU   3           HA       LEU   3  -9.037  -4.849  -2.104
  165    HB2  LEU   3           HB2      LEU   3 -10.457  -7.429  -1.392
  166    HB3  LEU   3           HB1      LEU   3  -9.065  -6.762  -0.540
  167    HG   LEU   3           HG       LEU   3 -11.728  -5.348  -0.875
  168   HD11  LEU   3          HD11      LEU   3 -12.048  -7.199   0.620
  169   HD12  LEU   3          HD12      LEU   3 -11.851  -5.766   1.630
  170   HD13  LEU   3          HD13      LEU   3 -10.510  -6.893   1.427
  171   HD21  LEU   3          HD21      LEU   3 -10.726  -3.868   0.919
  172   HD22  LEU   3          HD22      LEU   3  -9.933  -3.748  -0.650
  173   HD23  LEU   3          HD23      LEU   3  -9.188  -4.686   0.645
  174    H    GLU   4           HN       GLU   4 -10.045  -7.824  -3.777
  175    HA   GLU   4           HA       GLU   4  -7.526  -9.024  -3.996
  176    HB2  GLU   4           HB2      GLU   4  -9.963  -9.162  -5.778
  177    HB3  GLU   4           HB1      GLU   4  -8.533 -10.166  -6.021
  178    HG2  GLU   4           HG2      GLU   4  -8.778 -11.153  -3.822
  179    HG3  GLU   4           HG1      GLU   4 -10.089 -10.044  -3.424
  180    H    LYS   5           HN       LYS   5  -9.196  -6.810  -6.225
  181    HA   LYS   5           HA       LYS   5  -7.258  -6.757  -8.243
  182    HB2  LYS   5           HB2      LYS   5  -9.575  -5.775  -8.363
  183    HB3  LYS   5           HB1      LYS   5  -8.979  -4.419  -7.405
  184    HG2  LYS   5           HG2      LYS   5  -7.361  -3.840  -9.102
  185    HG3  LYS   5           HG1      LYS   5  -7.721  -5.306 -10.015
  186    HD2  LYS   5           HD2      LYS   5 -10.093  -4.478 -10.249
  187    HD3  LYS   5           HD1      LYS   5  -9.565  -2.950  -9.542
  188    HE2  LYS   5           HE2      LYS   5  -8.318  -4.197 -12.005
  189    HE3  LYS   5           HE1      LYS   5  -9.563  -2.952 -12.056
  190    HZ1  LYS   5           HZ1      LYS   5  -7.433  -1.917 -12.229
  191    HZ2  LYS   5           HZ2      LYS   5  -6.860  -2.726 -10.849
  192    HZ3  LYS   5           HZ3      LYS   5  -8.070  -1.543 -10.702
  193    H    LEU   6           HN       LEU   6  -7.623  -4.675  -5.382
  194    HA   LEU   6           HA       LEU   6  -5.464  -2.961  -5.868
  195    HB2  LEU   6           HB2      LEU   6  -7.114  -2.515  -4.122
  196    HB3  LEU   6           HB1      LEU   6  -6.570  -3.932  -3.223
  197    HG   LEU   6           HG       LEU   6  -4.421  -2.047  -3.960
  198   HD11  LEU   6          HD11      LEU   6  -6.281  -0.480  -3.440
  199   HD12  LEU   6          HD12      LEU   6  -5.004  -0.416  -2.225
  200   HD13  LEU   6          HD13      LEU   6  -6.501  -1.286  -1.886
  201   HD21  LEU   6          HD21      LEU   6  -3.908  -3.891  -2.519
  202   HD22  LEU   6          HD22      LEU   6  -5.303  -3.563  -1.491
  203   HD23  LEU   6          HD23      LEU   6  -3.925  -2.462  -1.486
  204    H    MET   7           HN       MET   7  -5.581  -6.026  -4.066
  205    HA   MET   7           HA       MET   7  -2.909  -6.100  -3.237
  206    HB2  MET   7           HB2      MET   7  -4.641  -7.651  -2.413
  207    HB3  MET   7           HB1      MET   7  -4.689  -8.430  -3.995
  208    HG2  MET   7           HG2      MET   7  -3.246  -9.749  -2.576
  209    HG3  MET   7           HG1      MET   7  -2.225  -8.913  -3.743
  210    HE1  MET   7           HE1      MET   7  -1.115 -10.239  -1.406
  211    HE2  MET   7           HE2      MET   7  -0.141  -9.115  -0.462
  212    HE3  MET   7           HE3      MET   7   0.021  -9.152  -2.216
  213    H    LYS   8           HN       LYS   8  -4.414  -7.391  -6.192
  214    HA   LYS   8           HA       LYS   8  -2.132  -8.554  -7.320
  215    HB2  LYS   8           HB2      LYS   8  -4.571  -7.311  -8.603
  216    HB3  LYS   8           HB1      LYS   8  -3.333  -8.178  -9.514
  217    HG2  LYS   8           HG2      LYS   8  -3.707 -10.181  -8.120
  218    HG3  LYS   8           HG1      LYS   8  -4.952  -9.318  -7.216
  219    HD2  LYS   8           HD2      LYS   8  -6.285  -9.047  -9.255
  220    HD3  LYS   8           HD1      LYS   8  -5.027  -9.844 -10.202
  221    HE2  LYS   8           HE2      LYS   8  -6.805 -11.445  -9.663
  222    HE3  LYS   8           HE1      LYS   8  -5.318 -11.892  -8.827
  223    HZ1  LYS   8           HZ1      LYS   8  -6.142 -11.245  -6.812
  224    HZ2  LYS   8           HZ2      LYS   8  -7.571 -11.788  -7.554
  225    HZ3  LYS   8           HZ3      LYS   8  -7.230 -10.125  -7.474
  226    H    ALA   9           HN       ALA   9  -3.437  -5.264  -7.693
  227    HA   ALA   9           HA       ALA   9  -1.540  -4.297  -9.513
  228    HB1  ALA   9           HB1      ALA   9  -3.254  -2.984  -7.421
  229    HB2  ALA   9           HB2      ALA   9  -3.389  -2.901  -9.177
  230    HB3  ALA   9           HB3      ALA   9  -2.090  -2.040  -8.351
  231    H    PHE  10           HN       PHE  10  -1.524  -4.243  -5.954
  232    HA   PHE  10           HA       PHE  10   0.887  -2.864  -5.600
  233    HB2  PHE  10           HB2      PHE  10  -0.702  -3.361  -3.770
  234    HB3  PHE  10           HB1      PHE  10  -0.237  -5.062  -3.851
  235    HD1  PHE  10           HD1      PHE  10   1.048  -1.628  -3.229
  236    HD2  PHE  10           HD2      PHE  10   1.783  -5.844  -2.854
  237    HE1  PHE  10           HE1      PHE  10   3.019  -1.157  -1.804
  238    HE2  PHE  10           HE2      PHE  10   3.755  -5.371  -1.425
  239    HZ   PHE  10           HZ       PHE  10   4.372  -3.026  -0.902
  240    H    GLU  11           HN       GLU  11   0.281  -6.360  -5.872
  241    HA   GLU  11           HA       GLU  11   2.915  -7.240  -5.519
  242    HB2  GLU  11           HB2      GLU  11   0.628  -8.393  -7.125
  243    HB3  GLU  11           HB1      GLU  11   2.159  -9.234  -6.883
  244    HG2  GLU  11           HG2      GLU  11   0.315  -8.268  -4.677
  245    HG3  GLU  11           HG1      GLU  11   0.482  -9.939  -5.212
  246    H    SER  12           HN       SER  12   1.184  -6.368  -8.504
  247    HA   SER  12           HA       SER  12   3.242  -6.937 -10.316
  248    HB2  SER  12           HB2      SER  12   2.094  -5.416 -11.854
  249    HB3  SER  12           HB1      SER  12   0.933  -6.440 -11.016
  250    HG   SER  12           HG       SER  12   0.337  -4.752  -9.773
  251    H    LEU  13           HN       LEU  13   2.472  -3.919  -8.594
  252    HA   LEU  13           HA       LEU  13   4.489  -2.318  -9.691
  253    HB2  LEU  13           HB2      LEU  13   2.677  -1.396  -8.328
  254    HB3  LEU  13           HB1      LEU  13   3.294  -2.240  -6.909
  255    HG   LEU  13           HG       LEU  13   5.414  -0.971  -7.085
  256   HD11  LEU  13          HD11      LEU  13   5.354   1.045  -8.650
  257   HD12  LEU  13          HD12      LEU  13   3.980   0.274  -9.442
  258   HD13  LEU  13          HD13      LEU  13   5.554  -0.522  -9.432
  259   HD21  LEU  13          HD21      LEU  13   4.395   1.314  -6.587
  260   HD22  LEU  13          HD22      LEU  13   3.761  -0.023  -5.628
  261   HD23  LEU  13          HD23      LEU  13   2.830   0.606  -6.987
  262    H    LYS  14           HN       LYS  14   4.532  -4.368  -6.782
  263    HA   LYS  14           HA       LYS  14   7.133  -3.783  -5.934
  264    HB2  LYS  14           HB2      LYS  14   5.324  -6.150  -5.573
  265    HB3  LYS  14           HB1      LYS  14   6.990  -6.216  -4.996
  266    HG2  LYS  14           HG2      LYS  14   5.219  -3.873  -4.317
  267    HG3  LYS  14           HG1      LYS  14   5.170  -5.354  -3.357
  268    HD2  LYS  14           HD2      LYS  14   7.598  -5.194  -2.967
  269    HD3  LYS  14           HD1      LYS  14   7.661  -3.721  -3.933
  270    HE2  LYS  14           HE2      LYS  14   5.953  -4.030  -1.452
  271    HE3  LYS  14           HE1      LYS  14   7.563  -3.313  -1.450
  272    HZ1  LYS  14           HZ1      LYS  14   5.277  -2.356  -3.086
  273    HZ2  LYS  14           HZ2      LYS  14   6.819  -1.647  -3.001
  274    HZ3  LYS  14           HZ3      LYS  14   5.803  -1.644  -1.640
  275    H    SER  15           HN       SER  15   5.969  -6.337  -8.118
  276    HA   SER  15           HA       SER  15   8.428  -7.589  -8.602
  277    HB2  SER  15           HB2      SER  15   6.286  -8.550  -9.324
  278    HB3  SER  15           HB1      SER  15   6.075  -7.237 -10.479
  279    HG   SER  15           HG       SER  15   7.962  -9.335 -10.462
  280    H    PHE  16           HN       PHE  16   6.830  -4.911 -10.318
  281    HA   PHE  16           HA       PHE  16   8.751  -4.525 -12.317
  282    HB2  PHE  16           HB2      PHE  16   6.752  -2.710 -11.000
  283    HB3  PHE  16           HB1      PHE  16   7.892  -2.074 -12.186
  284    HD1  PHE  16           HD1      PHE  16   4.714  -3.518 -11.783
  285    HD2  PHE  16           HD2      PHE  16   8.131  -3.591 -14.384
  286    HE1  PHE  16           HE1      PHE  16   3.299  -4.402 -13.616
  287    HE2  PHE  16           HE2      PHE  16   6.715  -4.476 -16.218
  288    HZ   PHE  16           HZ       PHE  16   4.299  -4.880 -15.834
  289    H    GLN  17           HN       GLN  17   8.490  -3.054  -9.088
  290    HA   GLN  17           HA       GLN  17  10.712  -1.358  -9.243
  291    HB2  GLN  17           HB2      GLN  17   8.890  -1.581  -7.402
  292    HB3  GLN  17           HB1      GLN  17   9.976  -2.782  -6.701
  293    HG2  GLN  17           HG2      GLN  17  11.014  -0.078  -7.523
  294    HG3  GLN  17           HG1      GLN  17  10.234  -0.300  -5.958
  295   HE21  GLN  17          HE21      GLN  17  13.128   0.276  -6.517
  296   HE22  GLN  17          HE22      GLN  17  13.987  -1.006  -5.809
  297    H1   ALA   1           HT1      ALA   1   8.417  13.712   7.377
  298    H2   ALA   1           HT2      ALA   1   9.721  14.069   6.348
  299    H3   ALA   1           HT3      ALA   1   9.256  12.456   6.607
  300    HA   ALA   1           HA       ALA   1   7.555  14.509   5.305
  301    HB1  ALA   1           HB1      ALA   1   9.266  14.123   3.743
  302    HB2  ALA   1           HB2      ALA   1   8.051  12.929   3.287
  303    HB3  ALA   1           HB3      ALA   1   9.459  12.439   4.229
  304    H    THR   2           HN       THR   2   5.595  13.653   4.495
  305    HA   THR   2           HA       THR   2   4.367  11.690   6.127
  306    HB   THR   2           HB       THR   2   2.462  11.902   4.568
  307    HG1  THR   2           HG1      THR   2   3.245  12.163   2.600
  308   HG21  THR   2          HG21      THR   2   2.164  14.372   4.814
  309   HG22  THR   2          HG22      THR   2   3.856  14.492   5.296
  310   HG23  THR   2          HG23      THR   2   2.716  13.594   6.297
  311    H    LEU   3           HN       LEU   3   5.710  11.596   2.851
  312    HA   LEU   3           HA       LEU   3   4.849   9.037   2.104
  313    HB2  LEU   3           HB2      LEU   3   7.429  10.457   1.392
  314    HB3  LEU   3           HB1      LEU   3   6.762   9.065   0.540
  315    HG   LEU   3           HG       LEU   3   5.348  11.728   0.875
  316   HD11  LEU   3          HD11      LEU   3   7.199  12.048  -0.620
  317   HD12  LEU   3          HD12      LEU   3   5.766  11.851  -1.630
  318   HD13  LEU   3          HD13      LEU   3   6.893  10.510  -1.427
  319   HD21  LEU   3          HD21      LEU   3   3.868  10.726  -0.919
  320   HD22  LEU   3          HD22      LEU   3   3.748   9.933   0.650
  321   HD23  LEU   3          HD23      LEU   3   4.686   9.188  -0.645
  322    H    GLU   4           HN       GLU   4   7.824  10.045   3.777
  323    HA   GLU   4           HA       GLU   4   9.024   7.526   3.996
  324    HB2  GLU   4           HB2      GLU   4   9.162   9.963   5.778
  325    HB3  GLU   4           HB1      GLU   4  10.166   8.533   6.021
  326    HG2  GLU   4           HG2      GLU   4  11.153   8.778   3.822
  327    HG3  GLU   4           HG1      GLU   4  10.044  10.089   3.424
  328    H    LYS   5           HN       LYS   5   6.810   9.196   6.225
  329    HA   LYS   5           HA       LYS   5   6.757   7.258   8.244
  330    HB2  LYS   5           HB2      LYS   5   5.776   9.575   8.363
  331    HB3  LYS   5           HB1      LYS   5   4.419   8.980   7.405
  332    HG2  LYS   5           HG2      LYS   5   3.839   7.362   9.101
  333    HG3  LYS   5           HG1      LYS   5   5.305   7.721  10.014
  334    HD2  LYS   5           HD2      LYS   5   4.477  10.094  10.246
  335    HD3  LYS   5           HD1      LYS   5   2.949   9.563   9.541
  336    HE2  LYS   5           HE2      LYS   5   4.200   8.321  12.005
  337    HE3  LYS   5           HE1      LYS   5   2.952   9.565  12.055
  338    HZ1  LYS   5           HZ1      LYS   5   1.926   7.430  12.233
  339    HZ2  LYS   5           HZ2      LYS   5   2.729   6.862  10.848
  340    HZ3  LYS   5           HZ3      LYS   5   1.542   8.069  10.709
  341    H    LEU   6           HN       LEU   6   4.675   7.623   5.382
  342    HA   LEU   6           HA       LEU   6   2.961   5.464   5.868
  343    HB2  LEU   6           HB2      LEU   6   2.515   7.114   4.122
  344    HB3  LEU   6           HB1      LEU   6   3.932   6.570   3.223
  345    HG   LEU   6           HG       LEU   6   2.047   4.421   3.960
  346   HD11  LEU   6          HD11      LEU   6   0.480   6.281   3.440
  347   HD12  LEU   6          HD12      LEU   6   0.416   5.004   2.225
  348   HD13  LEU   6          HD13      LEU   6   1.286   6.501   1.886
  349   HD21  LEU   6          HD21      LEU   6   3.891   3.908   2.519
  350   HD22  LEU   6          HD22      LEU   6   3.563   5.303   1.491
  351   HD23  LEU   6          HD23      LEU   6   2.462   3.925   1.486
  352    H    MET   7           HN       MET   7   6.026   5.581   4.066
  353    HA   MET   7           HA       MET   7   6.100   2.909   3.237
  354    HB2  MET   7           HB2      MET   7   7.651   4.641   2.413
  355    HB3  MET   7           HB1      MET   7   8.430   4.689   3.995
  356    HG2  MET   7           HG2      MET   7   9.749   3.246   2.576
  357    HG3  MET   7           HG1      MET   7   8.913   2.225   3.743
  358    HE1  MET   7           HE1      MET   7  10.239   1.115   1.406
  359    HE2  MET   7           HE2      MET   7   9.115   0.141   0.462
  360    HE3  MET   7           HE3      MET   7   9.152  -0.021   2.216
  361    H    LYS   8           HN       LYS   8   7.391   4.414   6.192
  362    HA   LYS   8           HA       LYS   8   8.554   2.132   7.320
  363    HB2  LYS   8           HB2      LYS   8   7.311   4.571   8.603
  364    HB3  LYS   8           HB1      LYS   8   8.178   3.333   9.514
  365    HG2  LYS   8           HG2      LYS   8  10.181   3.707   8.120
  366    HG3  LYS   8           HG1      LYS   8   9.318   4.952   7.216
  367    HD2  LYS   8           HD2      LYS   8   9.047   6.285   9.255
  368    HD3  LYS   8           HD1      LYS   8   9.844   5.027  10.202
  369    HE2  LYS   8           HE2      LYS   8  11.445   6.805   9.663
  370    HE3  LYS   8           HE1      LYS   8  11.892   5.318   8.827
  371    HZ1  LYS   8           HZ1      LYS   8  11.245   6.142   6.812
  372    HZ2  LYS   8           HZ2      LYS   8  11.788   7.571   7.554
  373    HZ3  LYS   8           HZ3      LYS   8  10.125   7.230   7.474
  374    H    ALA   9           HN       ALA   9   5.264   3.437   7.693
  375    HA   ALA   9           HA       ALA   9   4.297   1.540   9.513
  376    HB1  ALA   9           HB1      ALA   9   2.974   3.237   7.410
  377    HB2  ALA   9           HB2      ALA   9   2.913   3.403   9.165
  378    HB3  ALA   9           HB3      ALA   9   2.039   2.092   8.373
  379    H    PHE  10           HN       PHE  10   4.243   1.524   5.954
  380    HA   PHE  10           HA       PHE  10   2.864  -0.887   5.600
  381    HB2  PHE  10           HB2      PHE  10   3.361   0.702   3.770
  382    HB3  PHE  10           HB1      PHE  10   5.062   0.237   3.851
  383    HD1  PHE  10           HD1      PHE  10   1.628  -1.048   3.229
  384    HD2  PHE  10           HD2      PHE  10   5.844  -1.783   2.854
  385    HE1  PHE  10           HE1      PHE  10   1.157  -3.019   1.804
  386    HE2  PHE  10           HE2      PHE  10   5.371  -3.755   1.425
  387    HZ   PHE  10           HZ       PHE  10   3.026  -4.372   0.902
  388    H    GLU  11           HN       GLU  11   6.360  -0.281   5.872
  389    HA   GLU  11           HA       GLU  11   7.240  -2.915   5.519
  390    HB2  GLU  11           HB2      GLU  11   8.393  -0.628   7.125
  391    HB3  GLU  11           HB1      GLU  11   9.234  -2.159   6.883
  392    HG2  GLU  11           HG2      GLU  11   8.268  -0.315   4.677
  393    HG3  GLU  11           HG1      GLU  11   9.939  -0.482   5.212
  394    H    SER  12           HN       SER  12   6.368  -1.184   8.504
  395    HA   SER  12           HA       SER  12   6.936  -3.234  10.327
  396    HB2  SER  12           HB2      SER  12   4.827  -1.066  10.430
  397    HB3  SER  12           HB1      SER  12   5.260  -2.092  11.794
  398    HG   SER  12           HG       SER  12   7.103  -0.510  10.325
  399    H    LEU  13           HN       LEU  13   3.919  -2.472   8.594
  400    HA   LEU  13           HA       LEU  13   2.318  -4.489   9.691
  401    HB2  LEU  13           HB2      LEU  13   1.396  -2.677   8.328
  402    HB3  LEU  13           HB1      LEU  13   2.240  -3.294   6.909
  403    HG   LEU  13           HG       LEU  13   0.971  -5.414   7.085
  404   HD11  LEU  13          HD11      LEU  13  -1.045  -5.354   8.650
  405   HD12  LEU  13          HD12      LEU  13  -0.274  -3.980   9.442
  406   HD13  LEU  13          HD13      LEU  13   0.522  -5.554   9.432
  407   HD21  LEU  13          HD21      LEU  13  -1.314  -4.395   6.587
  408   HD22  LEU  13          HD22      LEU  13   0.023  -3.761   5.628
  409   HD23  LEU  13          HD23      LEU  13  -0.606  -2.830   6.987
  410    H    LYS  14           HN       LYS  14   4.368  -4.532   6.782
  411    HA   LYS  14           HA       LYS  14   3.783  -7.133   5.934
  412    HB2  LYS  14           HB2      LYS  14   6.150  -5.324   5.573
  413    HB3  LYS  14           HB1      LYS  14   6.216  -6.990   4.996
  414    HG2  LYS  14           HG2      LYS  14   3.873  -5.219   4.317
  415    HG3  LYS  14           HG1      LYS  14   5.354  -5.170   3.357
  416    HD2  LYS  14           HD2      LYS  14   5.194  -7.598   2.967
  417    HD3  LYS  14           HD1      LYS  14   3.721  -7.661   3.933
  418    HE2  LYS  14           HE2      LYS  14   4.030  -5.953   1.452
  419    HE3  LYS  14           HE1      LYS  14   3.313  -7.563   1.450
  420    HZ1  LYS  14           HZ1      LYS  14   2.356  -5.277   3.086
  421    HZ2  LYS  14           HZ2      LYS  14   1.647  -6.819   3.001
  422    HZ3  LYS  14           HZ3      LYS  14   1.644  -5.803   1.640
  423    H    SER  15           HN       SER  15   6.337  -5.969   8.118
  424    HA   SER  15           HA       SER  15   7.589  -8.428   8.602
  425    HB2  SER  15           HB2      SER  15   8.550  -6.287   9.324
  426    HB3  SER  15           HB1      SER  15   7.237  -6.075  10.479
  427    HG   SER  15           HG       SER  15   8.402  -7.224  11.784
  428    H    PHE  16           HN       PHE  16   4.911  -6.830  10.318
  429    HA   PHE  16           HA       PHE  16   4.519  -8.748  12.321
  430    HB2  PHE  16           HB2      PHE  16   2.523  -6.938  10.940
  431    HB3  PHE  16           HB1      PHE  16   2.163  -7.884  12.381
  432    HD1  PHE  16           HD1      PHE  16   2.552  -4.701  11.634
  433    HD2  PHE  16           HD2      PHE  16   4.657  -7.654  13.940
  434    HE1  PHE  16           HE1      PHE  16   3.519  -2.909  13.050
  435    HE2  PHE  16           HE2      PHE  16   5.622  -5.861  15.355
  436    HZ   PHE  16           HZ       PHE  16   5.054  -3.489  14.911
  437    H    GLN  17           HN       GLN  17   3.054  -8.490   9.088
  438    HA   GLN  17           HA       GLN  17   1.358 -10.712   9.243
  439    HB2  GLN  17           HB2      GLN  17   1.581  -8.890   7.402
  440    HB3  GLN  17           HB1      GLN  17   2.782  -9.976   6.701
  441    HG2  GLN  17           HG2      GLN  17   0.078 -11.014   7.523
  442    HG3  GLN  17           HG1      GLN  17   0.300 -10.234   5.958
  443   HE21  GLN  17          HE21      GLN  17  -0.276 -13.128   6.517
  444   HE22  GLN  17          HE22      GLN  17   1.006 -13.987   5.809
  445    H1   ALA   1           HT1      ALA   1  -8.417 -13.712   7.377
  446    H2   ALA   1           HT2      ALA   1  -9.721 -14.069   6.348
  447    H3   ALA   1           HT3      ALA   1  -9.256 -12.456   6.607
  448    HA   ALA   1           HA       ALA   1  -7.555 -14.509   5.305
  449    HB1  ALA   1           HB1      ALA   1  -9.266 -14.123   3.743
  450    HB2  ALA   1           HB2      ALA   1  -8.051 -12.929   3.287
  451    HB3  ALA   1           HB3      ALA   1  -9.459 -12.439   4.229
  452    H    THR   2           HN       THR   2  -5.595 -13.653   4.495
  453    HA   THR   2           HA       THR   2  -4.367 -11.690   6.127
  454    HB   THR   2           HB       THR   2  -2.462 -11.902   4.568
  455    HG1  THR   2           HG1      THR   2  -3.245 -12.163   2.600
  456   HG21  THR   2          HG21      THR   2  -2.164 -14.372   4.814
  457   HG22  THR   2          HG22      THR   2  -3.856 -14.492   5.296
  458   HG23  THR   2          HG23      THR   2  -2.716 -13.594   6.297
  459    H    LEU   3           HN       LEU   3  -5.710 -11.596   2.851
  460    HA   LEU   3           HA       LEU   3  -4.849  -9.037   2.104
  461    HB2  LEU   3           HB2      LEU   3  -7.429 -10.457   1.392
  462    HB3  LEU   3           HB1      LEU   3  -6.762  -9.065   0.540
  463    HG   LEU   3           HG       LEU   3  -5.348 -11.728   0.875
  464   HD11  LEU   3          HD11      LEU   3  -7.199 -12.048  -0.620
  465   HD12  LEU   3          HD12      LEU   3  -5.766 -11.851  -1.630
  466   HD13  LEU   3          HD13      LEU   3  -6.893 -10.510  -1.427
  467   HD21  LEU   3          HD21      LEU   3  -3.868 -10.726  -0.919
  468   HD22  LEU   3          HD22      LEU   3  -3.748  -9.933   0.650
  469   HD23  LEU   3          HD23      LEU   3  -4.686  -9.188  -0.645
  470    H    GLU   4           HN       GLU   4  -7.824 -10.045   3.777
  471    HA   GLU   4           HA       GLU   4  -9.024  -7.526   3.996
  472    HB2  GLU   4           HB2      GLU   4  -9.162  -9.963   5.778
  473    HB3  GLU   4           HB1      GLU   4 -10.166  -8.533   6.021
  474    HG2  GLU   4           HG2      GLU   4 -11.153  -8.778   3.822
  475    HG3  GLU   4           HG1      GLU   4 -10.044 -10.089   3.424
  476    H    LYS   5           HN       LYS   5  -6.810  -9.196   6.225
  477    HA   LYS   5           HA       LYS   5  -6.755  -7.261   8.247
  478    HB2  LYS   5           HB2      LYS   5  -5.783  -9.505   8.505
  479    HB3  LYS   5           HB1      LYS   5  -4.520  -9.094   7.343
  480    HG2  LYS   5           HG2      LYS   5  -3.738  -7.283   8.811
  481    HG3  LYS   5           HG1      LYS   5  -5.016  -7.657   9.968
  482    HD2  LYS   5           HD2      LYS   5  -4.082  -9.929  10.258
  483    HD3  LYS   5           HD1      LYS   5  -2.791  -9.537   9.121
  484    HE2  LYS   5           HE2      LYS   5  -3.323  -8.055  11.713
  485    HE3  LYS   5           HE1      LYS   5  -2.065  -9.269  11.485
  486    HZ1  LYS   5           HZ1      LYS   5  -0.929  -7.340  11.069
  487    HZ2  LYS   5           HZ2      LYS   5  -2.263  -6.562  10.360
  488    HZ3  LYS   5           HZ3      LYS   5  -1.415  -7.756   9.499
  489    H    LEU   6           HN       LEU   6  -4.675  -7.623   5.382
  490    HA   LEU   6           HA       LEU   6  -2.961  -5.464   5.868
  491    HB2  LEU   6           HB2      LEU   6  -2.515  -7.114   4.122
  492    HB3  LEU   6           HB1      LEU   6  -3.932  -6.570   3.223
  493    HG   LEU   6           HG       LEU   6  -2.047  -4.421   3.960
  494   HD11  LEU   6          HD11      LEU   6  -0.480  -6.281   3.440
  495   HD12  LEU   6          HD12      LEU   6  -0.416  -5.004   2.225
  496   HD13  LEU   6          HD13      LEU   6  -1.286  -6.501   1.886
  497   HD21  LEU   6          HD21      LEU   6  -3.891  -3.908   2.519
  498   HD22  LEU   6          HD22      LEU   6  -3.563  -5.303   1.491
  499   HD23  LEU   6          HD23      LEU   6  -2.462  -3.925   1.486
  500    H    MET   7           HN       MET   7  -6.026  -5.581   4.066
  501    HA   MET   7           HA       MET   7  -6.100  -2.909   3.237
  502    HB2  MET   7           HB2      MET   7  -7.651  -4.641   2.413
  503    HB3  MET   7           HB1      MET   7  -8.430  -4.689   3.995
  504    HG2  MET   7           HG2      MET   7  -9.749  -3.246   2.576
  505    HG3  MET   7           HG1      MET   7  -8.913  -2.225   3.743
  506    HE1  MET   7           HE1      MET   7 -10.239  -1.115   1.406
  507    HE2  MET   7           HE2      MET   7  -9.115  -0.141   0.462
  508    HE3  MET   7           HE3      MET   7  -9.152   0.021   2.216
  509    H    LYS   8           HN       LYS   8  -7.391  -4.414   6.192
  510    HA   LYS   8           HA       LYS   8  -8.554  -2.132   7.320
  511    HB2  LYS   8           HB2      LYS   8  -7.311  -4.571   8.603
  512    HB3  LYS   8           HB1      LYS   8  -8.178  -3.333   9.514
  513    HG2  LYS   8           HG2      LYS   8 -10.181  -3.707   8.120
  514    HG3  LYS   8           HG1      LYS   8  -9.318  -4.952   7.216
  515    HD2  LYS   8           HD2      LYS   8  -9.047  -6.285   9.255
  516    HD3  LYS   8           HD1      LYS   8  -9.844  -5.027  10.202
  517    HE2  LYS   8           HE2      LYS   8 -11.445  -6.805   9.663
  518    HE3  LYS   8           HE1      LYS   8 -11.892  -5.318   8.827
  519    HZ1  LYS   8           HZ1      LYS   8 -11.245  -6.142   6.812
  520    HZ2  LYS   8           HZ2      LYS   8 -11.788  -7.571   7.554
  521    HZ3  LYS   8           HZ3      LYS   8 -10.125  -7.230   7.474
  522    H    ALA   9           HN       ALA   9  -5.264  -3.437   7.693
  523    HA   ALA   9           HA       ALA   9  -4.297  -1.540   9.513
  524    HB1  ALA   9           HB1      ALA   9  -2.907  -3.138   7.360
  525    HB2  ALA   9           HB2      ALA   9  -2.980  -3.483   9.087
  526    HB3  ALA   9           HB3      ALA   9  -2.040  -2.111   8.502
  527    H    PHE  10           HN       PHE  10  -4.243  -1.524   5.954
  528    HA   PHE  10           HA       PHE  10  -2.864   0.887   5.600
  529    HB2  PHE  10           HB2      PHE  10  -3.361  -0.702   3.770
  530    HB3  PHE  10           HB1      PHE  10  -5.062  -0.237   3.851
  531    HD1  PHE  10           HD1      PHE  10  -1.628   1.048   3.229
  532    HD2  PHE  10           HD2      PHE  10  -5.844   1.783   2.854
  533    HE1  PHE  10           HE1      PHE  10  -1.157   3.019   1.804
  534    HE2  PHE  10           HE2      PHE  10  -5.371   3.755   1.425
  535    HZ   PHE  10           HZ       PHE  10  -3.026   4.372   0.902
  536    H    GLU  11           HN       GLU  11  -6.360   0.281   5.872
  537    HA   GLU  11           HA       GLU  11  -7.240   2.915   5.519
  538    HB2  GLU  11           HB2      GLU  11  -8.393   0.628   7.125
  539    HB3  GLU  11           HB1      GLU  11  -9.234   2.159   6.883
  540    HG2  GLU  11           HG2      GLU  11  -8.268   0.315   4.677
  541    HG3  GLU  11           HG1      GLU  11  -9.939   0.482   5.212
  542    H    SER  12           HN       SER  12  -6.368   1.184   8.504
  543    HA   SER  12           HA       SER  12  -6.937   3.242  10.317
  544    HB2  SER  12           HB2      SER  12  -5.433   2.089  11.860
  545    HB3  SER  12           HB1      SER  12  -6.427   0.919  10.999
  546    HG   SER  12           HG       SER  12  -3.701   1.524  10.734
  547    H    LEU  13           HN       LEU  13  -3.919   2.472   8.594
  548    HA   LEU  13           HA       LEU  13  -2.318   4.489   9.691
  549    HB2  LEU  13           HB2      LEU  13  -1.397   2.677   8.327
  550    HB3  LEU  13           HB1      LEU  13  -2.241   3.295   6.908
  551    HG   LEU  13           HG       LEU  13  -0.972   5.414   7.085
  552   HD11  LEU  13          HD11      LEU  13   1.044   5.356   8.650
  553   HD12  LEU  13          HD12      LEU  13   0.276   3.980   9.440
  554   HD13  LEU  13          HD13      LEU  13  -0.524   5.551   9.433
  555   HD21  LEU  13          HD21      LEU  13   1.314   4.394   6.589
  556   HD22  LEU  13          HD22      LEU  13  -0.022   3.764   5.627
  557   HD23  LEU  13          HD23      LEU  13   0.605   2.830   6.985
  558    H    LYS  14           HN       LYS  14  -4.368   4.532   6.782
  559    HA   LYS  14           HA       LYS  14  -3.783   7.133   5.934
  560    HB2  LYS  14           HB2      LYS  14  -6.150   5.324   5.573
  561    HB3  LYS  14           HB1      LYS  14  -6.216   6.990   4.996
  562    HG2  LYS  14           HG2      LYS  14  -3.873   5.219   4.317
  563    HG3  LYS  14           HG1      LYS  14  -5.354   5.170   3.357
  564    HD2  LYS  14           HD2      LYS  14  -5.194   7.598   2.967
  565    HD3  LYS  14           HD1      LYS  14  -3.721   7.661   3.933
  566    HE2  LYS  14           HE2      LYS  14  -4.030   5.953   1.452
  567    HE3  LYS  14           HE1      LYS  14  -3.313   7.563   1.450
  568    HZ1  LYS  14           HZ1      LYS  14  -2.356   5.277   3.086
  569    HZ2  LYS  14           HZ2      LYS  14  -1.647   6.819   3.001
  570    HZ3  LYS  14           HZ3      LYS  14  -1.644   5.803   1.640
  571    H    SER  15           HN       SER  15  -6.337   5.969   8.118
  572    HA   SER  15           HA       SER  15  -7.589   8.428   8.602
  573    HB2  SER  15           HB2      SER  15  -7.255   6.023  10.409
  574    HB3  SER  15           HB1      SER  15  -8.329   7.377  10.750
  575    HG   SER  15           HG       SER  15  -8.525   5.346   8.863
  576    H    PHE  16           HN       PHE  16  -4.911   6.830  10.318
  577    HA   PHE  16           HA       PHE  16  -4.523   8.749  12.319
  578    HB2  PHE  16           HB2      PHE  16  -3.426   6.567  12.383
  579    HB3  PHE  16           HB1      PHE  16  -2.478   6.982  10.954
  580    HD1  PHE  16           HD1      PHE  16  -3.137   7.939  14.492
  581    HD2  PHE  16           HD2      PHE  16  -0.503   8.300  11.119
  582    HE1  PHE  16           HE1      PHE  16  -1.448   9.049  15.929
  583    HE2  PHE  16           HE2      PHE  16   1.184   9.411  12.556
  584    HZ   PHE  16           HZ       PHE  16   0.713   9.785  14.960
  585    H    GLN  17           HN       GLN  17  -3.054   8.490   9.088
  586    HA   GLN  17           HA       GLN  17  -1.358  10.712   9.243
  587    HB2  GLN  17           HB2      GLN  17  -1.581   8.890   7.402
  588    HB3  GLN  17           HB1      GLN  17  -2.782   9.976   6.701
  589    HG2  GLN  17           HG2      GLN  17  -0.078  11.014   7.523
  590    HG3  GLN  17           HG1      GLN  17  -0.300  10.234   5.958
  591   HE21  GLN  17          HE21      GLN  17   0.276  13.128   6.517
  592   HE22  GLN  17          HE22      GLN  17  -1.006  13.987   5.809
  Start of MODEL   10
    1    H1   ALA   1           HT1      ALA   1  15.987   7.525  -2.571
    2    H2   ALA   1           HT2      ALA   1  15.510   5.902  -2.726
    3    H3   ALA   1           HT3      ALA   1  14.403   7.068  -2.176
    4    HA   ALA   1           HA       ALA   1  14.351   8.141  -4.293
    5    HB1  ALA   1           HB1      ALA   1  16.762   7.724  -4.800
    6    HB2  ALA   1           HB2      ALA   1  15.703   7.322  -6.152
    7    HB3  ALA   1           HB3      ALA   1  16.368   6.039  -5.140
    8    H    THR   2           HN       THR   2  14.804   4.647  -3.806
    9    HA   THR   2           HA       THR   2  12.842   3.822  -5.686
   10    HB   THR   2           HB       THR   2  12.970   1.645  -4.524
   11    HG1  THR   2           HG1      THR   2  14.086   1.468  -2.650
   12   HG21  THR   2          HG21      THR   2  15.573   3.107  -5.016
   13   HG22  THR   2          HG22      THR   2  14.688   2.081  -6.145
   14   HG23  THR   2          HG23      THR   2  15.479   1.368  -4.739
   15    H    LEU   3           HN       LEU   3  12.739   4.494  -2.209
   16    HA   LEU   3           HA       LEU   3  10.144   3.590  -1.671
   17    HB2  LEU   3           HB2      LEU   3  11.715   5.876  -0.457
   18    HB3  LEU   3           HB1      LEU   3  10.219   5.233   0.217
   19    HG   LEU   3           HG       LEU   3  12.699   3.570  -0.305
   20   HD11  LEU   3          HD11      LEU   3  11.664   4.911   2.203
   21   HD12  LEU   3          HD12      LEU   3  13.245   5.111   1.448
   22   HD13  LEU   3          HD13      LEU   3  12.831   3.588   2.235
   23   HD21  LEU   3          HD21      LEU   3  10.753   2.174  -0.309
   24   HD22  LEU   3          HD22      LEU   3  10.045   3.043   1.051
   25   HD23  LEU   3          HD23      LEU   3  11.454   2.016   1.301
   26    H    GLU   4           HN       GLU   4  11.271   6.802  -2.709
   27    HA   GLU   4           HA       GLU   4   8.793   8.104  -2.706
   28    HB2  GLU   4           HB2      GLU   4  11.262   8.526  -4.396
   29    HB3  GLU   4           HB1      GLU   4   9.860   9.593  -4.461
   30    HG2  GLU   4           HG2      GLU   4  11.225  10.643  -2.869
   31    HG3  GLU   4           HG1      GLU   4  10.118   9.704  -1.871
   32    H    LYS   5           HN       LYS   5  10.429   6.326  -5.319
   33    HA   LYS   5           HA       LYS   5   8.525   6.742  -7.327
   34    HB2  LYS   5           HB2      LYS   5  10.424   4.448  -6.815
   35    HB3  LYS   5           HB1      LYS   5   9.420   4.558  -8.261
   36    HG2  LYS   5           HG2      LYS   5  10.440   6.669  -8.882
   37    HG3  LYS   5           HG1      LYS   5  11.338   6.727  -7.365
   38    HD2  LYS   5           HD2      LYS   5  12.842   5.937  -9.090
   39    HD3  LYS   5           HD1      LYS   5  12.464   4.577  -8.032
   40    HE2  LYS   5           HE2      LYS   5  10.783   3.770  -9.616
   41    HE3  LYS   5           HE1      LYS   5  11.065   5.165 -10.657
   42    HZ1  LYS   5           HZ1      LYS   5  12.427   3.648 -11.635
   43    HZ2  LYS   5           HZ2      LYS   5  12.751   2.818 -10.188
   44    HZ3  LYS   5           HZ3      LYS   5  13.519   4.299 -10.512
   45    H    LEU   6           HN       LEU   6   8.775   4.120  -4.932
   46    HA   LEU   6           HA       LEU   6   6.569   2.611  -5.769
   47    HB2  LEU   6           HB2      LEU   6   7.899   2.981  -3.092
   48    HB3  LEU   6           HB1      LEU   6   6.489   1.938  -3.279
   49    HG   LEU   6           HG       LEU   6   8.925   1.668  -5.046
   50   HD11  LEU   6          HD11      LEU   6   9.557  -0.233  -3.534
   51   HD12  LEU   6          HD12      LEU   6   8.315   0.307  -2.404
   52   HD13  LEU   6          HD13      LEU   6   9.696   1.345  -2.760
   53   HD21  LEU   6          HD21      LEU   6   6.459   0.043  -4.423
   54   HD22  LEU   6          HD22      LEU   6   7.904  -0.736  -5.063
   55   HD23  LEU   6          HD23      LEU   6   7.095   0.522  -5.996
   56    H    MET   7           HN       MET   7   6.757   5.253  -3.392
   57    HA   MET   7           HA       MET   7   4.076   5.248  -2.593
   58    HB2  MET   7           HB2      MET   7   5.867   6.537  -1.468
   59    HB3  MET   7           HB1      MET   7   5.914   7.639  -2.844
   60    HG2  MET   7           HG2      MET   7   4.506   8.604  -1.112
   61    HG3  MET   7           HG1      MET   7   3.490   8.132  -2.472
   62    HE1  MET   7           HE1      MET   7   0.948   7.350   0.087
   63    HE2  MET   7           HE2      MET   7   1.631   8.479  -1.079
   64    HE3  MET   7           HE3      MET   7   2.159   8.532   0.601
   65    H    LYS   8           HN       LYS   8   5.668   7.053  -5.214
   66    HA   LYS   8           HA       LYS   8   3.441   8.493  -6.107
   67    HB2  LYS   8           HB2      LYS   8   6.060   7.710  -7.219
   68    HB3  LYS   8           HB1      LYS   8   4.813   8.061  -8.416
   69    HG2  LYS   8           HG2      LYS   8   5.963  10.131  -7.906
   70    HG3  LYS   8           HG1      LYS   8   4.349  10.213  -7.200
   71    HD2  LYS   8           HD2      LYS   8   5.256   9.552  -5.011
   72    HD3  LYS   8           HD1      LYS   8   6.872   9.435  -5.709
   73    HE2  LYS   8           HE2      LYS   8   6.795  11.831  -6.296
   74    HE3  LYS   8           HE1      LYS   8   5.183  11.951  -5.591
   75    HZ1  LYS   8           HZ1      LYS   8   6.444  12.583  -3.824
   76    HZ2  LYS   8           HZ2      LYS   8   7.775  11.627  -4.270
   77    HZ3  LYS   8           HZ3      LYS   8   6.417  10.910  -3.544
   78    H    ALA   9           HN       ALA   9   4.647   5.302  -7.118
   79    HA   ALA   9           HA       ALA   9   2.750   4.780  -9.111
   80    HB1  ALA   9           HB1      ALA   9   4.689   3.365  -8.879
   81    HB2  ALA   9           HB2      ALA   9   3.254   2.369  -8.638
   82    HB3  ALA   9           HB3      ALA   9   4.207   2.893  -7.250
   83    H    PHE  10           HN       PHE  10   2.675   4.021  -5.634
   84    HA   PHE  10           HA       PHE  10   0.217   2.682  -5.583
   85    HB2  PHE  10           HB2      PHE  10   1.829   2.783  -3.686
   86    HB3  PHE  10           HB1      PHE  10   1.349   4.459  -3.412
   87    HD1  PHE  10           HD1      PHE  10   0.117   0.956  -3.501
   88    HD2  PHE  10           HD2      PHE  10  -0.703   5.001  -2.311
   89    HE1  PHE  10           HE1      PHE  10  -1.848   0.176  -2.208
   90    HE2  PHE  10           HE2      PHE  10  -2.668   4.220  -1.016
   91    HZ   PHE  10           HZ       PHE  10  -3.240   1.807  -0.966
   92    H    GLU  11           HN       GLU  11   0.937   6.139  -5.148
   93    HA   GLU  11           HA       GLU  11  -1.673   7.023  -4.650
   94    HB2  GLU  11           HB2      GLU  11   0.671   8.395  -5.981
   95    HB3  GLU  11           HB1      GLU  11  -0.834   9.222  -5.581
   96    HG2  GLU  11           HG2      GLU  11   0.957   7.773  -3.607
   97    HG3  GLU  11           HG1      GLU  11   0.845   9.522  -3.795
   98    H    SER  12           HN       SER  12   0.077   6.704  -7.734
   99    HA   SER  12           HA       SER  12  -1.935   7.691  -9.414
  100    HB2  SER  12           HB2      SER  12  -0.808   6.488 -11.217
  101    HB3  SER  12           HB1      SER  12   0.380   7.253 -10.166
  102    HG   SER  12           HG       SER  12   1.157   5.285 -10.140
  103    H    LEU  13           HN       LEU  13  -1.286   4.367  -8.322
  104    HA   LEU  13           HA       LEU  13  -3.336   3.084  -9.733
  105    HB2  LEU  13           HB2      LEU  13  -1.581   1.845  -8.570
  106    HB3  LEU  13           HB1      LEU  13  -2.175   2.425  -7.014
  107    HG   LEU  13           HG       LEU  13  -4.343   1.298  -7.435
  108   HD11  LEU  13          HD11      LEU  13  -2.932   0.461  -9.978
  109   HD12  LEU  13          HD12      LEU  13  -4.470   1.311  -9.826
  110   HD13  LEU  13          HD13      LEU  13  -4.348  -0.384  -9.352
  111   HD21  LEU  13          HD21      LEU  13  -3.575  -0.908  -6.961
  112   HD22  LEU  13          HD22      LEU  13  -2.319   0.160  -6.337
  113   HD23  LEU  13          HD23      LEU  13  -2.087  -0.669  -7.877
  114    H    LYS  14           HN       LYS  14  -3.359   4.517  -6.476
  115    HA   LYS  14           HA       LYS  14  -5.991   3.865  -5.788
  116    HB2  LYS  14           HB2      LYS  14  -4.138   6.083  -4.956
  117    HB3  LYS  14           HB1      LYS  14  -5.794   6.016  -4.352
  118    HG2  LYS  14           HG2      LYS  14  -3.912   3.653  -4.189
  119    HG3  LYS  14           HG1      LYS  14  -4.039   4.855  -2.905
  120    HD2  LYS  14           HD2      LYS  14  -6.476   4.406  -2.746
  121    HD3  LYS  14           HD1      LYS  14  -6.313   3.162  -3.984
  122    HE2  LYS  14           HE2      LYS  14  -4.758   1.915  -2.550
  123    HE3  LYS  14           HE1      LYS  14  -4.885   3.164  -1.311
  124    HZ1  LYS  14           HZ1      LYS  14  -7.351   1.944  -2.314
  125    HZ2  LYS  14           HZ2      LYS  14  -6.991   2.546  -0.766
  126    HZ3  LYS  14           HZ3      LYS  14  -6.388   1.035  -1.255
  127    H    SER  15           HN       SER  15  -4.713   6.761  -7.406
  128    HA   SER  15           HA       SER  15  -7.122   8.167  -7.653
  129    HB2  SER  15           HB2      SER  15  -4.701   8.118  -9.468
  130    HB3  SER  15           HB1      SER  15  -6.013   9.285  -9.600
  131    HG   SER  15           HG       SER  15  -5.179  10.323  -7.982
  132    H    PHE  16           HN       PHE  16  -5.584   5.831  -9.854
  133    HA   PHE  16           HA       PHE  16  -7.480   5.914 -11.910
  134    HB2  PHE  16           HB2      PHE  16  -5.359   4.784 -12.215
  135    HB3  PHE  16           HB1      PHE  16  -5.751   3.625 -10.945
  136    HD1  PHE  16           HD1      PHE  16  -6.859   4.870 -14.285
  137    HD2  PHE  16           HD2      PHE  16  -7.001   1.674 -11.419
  138    HE1  PHE  16           HE1      PHE  16  -8.001   3.429 -15.949
  139    HE2  PHE  16           HE2      PHE  16  -8.145   0.233 -13.082
  140    HZ   PHE  16           HZ       PHE  16  -8.645   1.111 -15.347
  141    H    GLN  17           HN       GLN  17  -7.321   3.825  -9.034
  142    HA   GLN  17           HA       GLN  17  -9.595   2.278  -9.553
  143    HB2  GLN  17           HB2      GLN  17  -7.818   2.013  -7.691
  144    HB3  GLN  17           HB1      GLN  17  -8.841   3.114  -6.765
  145    HG2  GLN  17           HG2      GLN  17 -10.051   0.727  -8.138
  146    HG3  GLN  17           HG1      GLN  17  -9.269   0.541  -6.572
  147   HE21  GLN  17          HE21      GLN  17 -12.188   0.309  -7.203
  148   HE22  GLN  17          HE22      GLN  17 -12.957   1.466  -6.227
  149    H1   ALA   1           HT1      ALA   1 -15.987  -7.525  -2.571
  150    H2   ALA   1           HT2      ALA   1 -15.510  -5.902  -2.726
  151    H3   ALA   1           HT3      ALA   1 -14.403  -7.068  -2.176
  152    HA   ALA   1           HA       ALA   1 -14.351  -8.141  -4.293
  153    HB1  ALA   1           HB1      ALA   1 -16.762  -7.724  -4.800
  154    HB2  ALA   1           HB2      ALA   1 -15.703  -7.322  -6.152
  155    HB3  ALA   1           HB3      ALA   1 -16.368  -6.039  -5.140
  156    H    THR   2           HN       THR   2 -14.804  -4.647  -3.806
  157    HA   THR   2           HA       THR   2 -12.842  -3.822  -5.686
  158    HB   THR   2           HB       THR   2 -12.970  -1.645  -4.524
  159    HG1  THR   2           HG1      THR   2 -14.086  -1.468  -2.650
  160   HG21  THR   2          HG21      THR   2 -15.573  -3.107  -5.016
  161   HG22  THR   2          HG22      THR   2 -14.688  -2.081  -6.145
  162   HG23  THR   2          HG23      THR   2 -15.479  -1.368  -4.739
  163    H    LEU   3           HN       LEU   3 -12.739  -4.494  -2.209
  164    HA   LEU   3           HA       LEU   3 -10.144  -3.590  -1.671
  165    HB2  LEU   3           HB2      LEU   3 -11.715  -5.876  -0.457
  166    HB3  LEU   3           HB1      LEU   3 -10.219  -5.233   0.217
  167    HG   LEU   3           HG       LEU   3 -12.699  -3.570  -0.305
  168   HD11  LEU   3          HD11      LEU   3 -11.664  -4.911   2.203
  169   HD12  LEU   3          HD12      LEU   3 -13.245  -5.111   1.448
  170   HD13  LEU   3          HD13      LEU   3 -12.831  -3.588   2.235
  171   HD21  LEU   3          HD21      LEU   3 -10.753  -2.174  -0.309
  172   HD22  LEU   3          HD22      LEU   3 -10.045  -3.043   1.051
  173   HD23  LEU   3          HD23      LEU   3 -11.454  -2.016   1.301
  174    H    GLU   4           HN       GLU   4 -11.271  -6.802  -2.709
  175    HA   GLU   4           HA       GLU   4  -8.793  -8.104  -2.706
  176    HB2  GLU   4           HB2      GLU   4 -11.262  -8.526  -4.396
  177    HB3  GLU   4           HB1      GLU   4  -9.860  -9.593  -4.461
  178    HG2  GLU   4           HG2      GLU   4 -11.225 -10.643  -2.869
  179    HG3  GLU   4           HG1      GLU   4 -10.118  -9.704  -1.871
  180    H    LYS   5           HN       LYS   5 -10.429  -6.326  -5.319
  181    HA   LYS   5           HA       LYS   5  -8.525  -6.742  -7.327
  182    HB2  LYS   5           HB2      LYS   5 -10.424  -4.448  -6.815
  183    HB3  LYS   5           HB1      LYS   5  -9.420  -4.558  -8.261
  184    HG2  LYS   5           HG2      LYS   5 -10.440  -6.669  -8.882
  185    HG3  LYS   5           HG1      LYS   5 -11.338  -6.727  -7.365
  186    HD2  LYS   5           HD2      LYS   5 -12.842  -5.937  -9.090
  187    HD3  LYS   5           HD1      LYS   5 -12.464  -4.577  -8.032
  188    HE2  LYS   5           HE2      LYS   5 -10.783  -3.770  -9.616
  189    HE3  LYS   5           HE1      LYS   5 -11.065  -5.165 -10.657
  190    HZ1  LYS   5           HZ1      LYS   5 -12.427  -3.648 -11.635
  191    HZ2  LYS   5           HZ2      LYS   5 -12.751  -2.818 -10.188
  192    HZ3  LYS   5           HZ3      LYS   5 -13.519  -4.299 -10.512
  193    H    LEU   6           HN       LEU   6  -8.775  -4.120  -4.932
  194    HA   LEU   6           HA       LEU   6  -6.569  -2.611  -5.769
  195    HB2  LEU   6           HB2      LEU   6  -7.899  -2.981  -3.092
  196    HB3  LEU   6           HB1      LEU   6  -6.489  -1.938  -3.279
  197    HG   LEU   6           HG       LEU   6  -8.925  -1.668  -5.046
  198   HD11  LEU   6          HD11      LEU   6  -9.557   0.233  -3.535
  199   HD12  LEU   6          HD12      LEU   6  -8.315  -0.307  -2.404
  200   HD13  LEU   6          HD13      LEU   6  -9.696  -1.345  -2.760
  201   HD21  LEU   6          HD21      LEU   6  -6.459  -0.043  -4.423
  202   HD22  LEU   6          HD22      LEU   6  -7.905   0.736  -5.063
  203   HD23  LEU   6          HD23      LEU   6  -7.095  -0.522  -5.996
  204    H    MET   7           HN       MET   7  -6.757  -5.253  -3.392
  205    HA   MET   7           HA       MET   7  -4.076  -5.248  -2.593
  206    HB2  MET   7           HB2      MET   7  -5.867  -6.537  -1.468
  207    HB3  MET   7           HB1      MET   7  -5.914  -7.639  -2.844
  208    HG2  MET   7           HG2      MET   7  -4.506  -8.604  -1.112
  209    HG3  MET   7           HG1      MET   7  -3.490  -8.132  -2.472
  210    HE1  MET   7           HE1      MET   7  -0.948  -7.350   0.087
  211    HE2  MET   7           HE2      MET   7  -1.631  -8.479  -1.079
  212    HE3  MET   7           HE3      MET   7  -2.159  -8.532   0.601
  213    H    LYS   8           HN       LYS   8  -5.668  -7.053  -5.214
  214    HA   LYS   8           HA       LYS   8  -3.441  -8.493  -6.107
  215    HB2  LYS   8           HB2      LYS   8  -6.060  -7.710  -7.219
  216    HB3  LYS   8           HB1      LYS   8  -4.813  -8.061  -8.416
  217    HG2  LYS   8           HG2      LYS   8  -5.963 -10.131  -7.906
  218    HG3  LYS   8           HG1      LYS   8  -4.349 -10.213  -7.200
  219    HD2  LYS   8           HD2      LYS   8  -5.256  -9.552  -5.011
  220    HD3  LYS   8           HD1      LYS   8  -6.872  -9.435  -5.709
  221    HE2  LYS   8           HE2      LYS   8  -6.795 -11.831  -6.296
  222    HE3  LYS   8           HE1      LYS   8  -5.183 -11.951  -5.591
  223    HZ1  LYS   8           HZ1      LYS   8  -6.444 -12.583  -3.824
  224    HZ2  LYS   8           HZ2      LYS   8  -7.775 -11.627  -4.270
  225    HZ3  LYS   8           HZ3      LYS   8  -6.417 -10.910  -3.544
  226    H    ALA   9           HN       ALA   9  -4.647  -5.302  -7.118
  227    HA   ALA   9           HA       ALA   9  -2.750  -4.780  -9.111
  228    HB1  ALA   9           HB1      ALA   9  -4.688  -3.365  -8.879
  229    HB2  ALA   9           HB2      ALA   9  -3.253  -2.369  -8.637
  230    HB3  ALA   9           HB3      ALA   9  -4.207  -2.894  -7.249
  231    H    PHE  10           HN       PHE  10  -2.675  -4.021  -5.634
  232    HA   PHE  10           HA       PHE  10  -0.217  -2.682  -5.583
  233    HB2  PHE  10           HB2      PHE  10  -1.829  -2.783  -3.686
  234    HB3  PHE  10           HB1      PHE  10  -1.349  -4.459  -3.412
  235    HD1  PHE  10           HD1      PHE  10  -0.117  -0.956  -3.501
  236    HD2  PHE  10           HD2      PHE  10   0.703  -5.001  -2.311
  237    HE1  PHE  10           HE1      PHE  10   1.848  -0.176  -2.208
  238    HE2  PHE  10           HE2      PHE  10   2.668  -4.220  -1.016
  239    HZ   PHE  10           HZ       PHE  10   3.240  -1.807  -0.966
  240    H    GLU  11           HN       GLU  11  -0.937  -6.139  -5.148
  241    HA   GLU  11           HA       GLU  11   1.673  -7.023  -4.650
  242    HB2  GLU  11           HB2      GLU  11  -0.671  -8.395  -5.981
  243    HB3  GLU  11           HB1      GLU  11   0.834  -9.222  -5.581
  244    HG2  GLU  11           HG2      GLU  11  -0.957  -7.773  -3.607
  245    HG3  GLU  11           HG1      GLU  11  -0.845  -9.522  -3.795
  246    H    SER  12           HN       SER  12  -0.077  -6.704  -7.734
  247    HA   SER  12           HA       SER  12   1.927  -7.692  -9.424
  248    HB2  SER  12           HB2      SER  12  -0.177  -5.576  -9.928
  249    HB3  SER  12           HB1      SER  12   0.816  -6.304 -11.187
  250    HG   SER  12           HG       SER  12  -0.195  -8.187 -10.916
  251    H    LEU  13           HN       LEU  13   1.286  -4.367  -8.322
  252    HA   LEU  13           HA       LEU  13   3.336  -3.085  -9.733
  253    HB2  LEU  13           HB2      LEU  13   1.581  -1.846  -8.571
  254    HB3  LEU  13           HB1      LEU  13   2.175  -2.425  -7.015
  255    HG   LEU  13           HG       LEU  13   4.343  -1.298  -7.436
  256   HD11  LEU  13          HD11      LEU  13   2.932  -0.456  -9.978
  257   HD12  LEU  13          HD12      LEU  13   4.466  -1.312  -9.829
  258   HD13  LEU  13          HD13      LEU  13   4.352   0.382  -9.353
  259   HD21  LEU  13          HD21      LEU  13   3.575   0.909  -6.962
  260   HD22  LEU  13          HD22      LEU  13   2.318  -0.159  -6.339
  261   HD23  LEU  13          HD23      LEU  13   2.088   0.670  -7.878
  262    H    LYS  14           HN       LYS  14   3.359  -4.517  -6.476
  263    HA   LYS  14           HA       LYS  14   5.991  -3.865  -5.788
  264    HB2  LYS  14           HB2      LYS  14   4.138  -6.083  -4.956
  265    HB3  LYS  14           HB1      LYS  14   5.794  -6.016  -4.352
  266    HG2  LYS  14           HG2      LYS  14   3.912  -3.653  -4.189
  267    HG3  LYS  14           HG1      LYS  14   4.039  -4.855  -2.905
  268    HD2  LYS  14           HD2      LYS  14   6.476  -4.406  -2.746
  269    HD3  LYS  14           HD1      LYS  14   6.313  -3.162  -3.984
  270    HE2  LYS  14           HE2      LYS  14   4.758  -1.915  -2.550
  271    HE3  LYS  14           HE1      LYS  14   4.885  -3.164  -1.311
  272    HZ1  LYS  14           HZ1      LYS  14   7.351  -1.944  -2.314
  273    HZ2  LYS  14           HZ2      LYS  14   6.991  -2.546  -0.766
  274    HZ3  LYS  14           HZ3      LYS  14   6.388  -1.035  -1.255
  275    H    SER  15           HN       SER  15   4.713  -6.761  -7.406
  276    HA   SER  15           HA       SER  15   7.122  -8.167  -7.653
  277    HB2  SER  15           HB2      SER  15   4.700  -8.118  -9.468
  278    HB3  SER  15           HB1      SER  15   6.014  -9.285  -9.600
  279    HG   SER  15           HG       SER  15   4.531  -8.822  -7.224
  280    H    PHE  16           HN       PHE  16   5.584  -5.831  -9.854
  281    HA   PHE  16           HA       PHE  16   7.483  -5.914 -11.908
  282    HB2  PHE  16           HB2      PHE  16   5.756  -3.619 -10.948
  283    HB3  PHE  16           HB1      PHE  16   6.682  -3.602 -12.447
  284    HD1  PHE  16           HD1      PHE  16   3.506  -3.702 -11.622
  285    HD2  PHE  16           HD2      PHE  16   6.348  -6.386 -13.405
  286    HE1  PHE  16           HE1      PHE  16   1.660  -4.895 -12.770
  287    HE2  PHE  16           HE2      PHE  16   4.501  -7.578 -14.551
  288    HZ   PHE  16           HZ       PHE  16   2.157  -6.833 -14.235
  289    H    GLN  17           HN       GLN  17   7.321  -3.825  -9.034
  290    HA   GLN  17           HA       GLN  17   9.595  -2.278  -9.553
  291    HB2  GLN  17           HB2      GLN  17   7.818  -2.013  -7.691
  292    HB3  GLN  17           HB1      GLN  17   8.841  -3.114  -6.765
  293    HG2  GLN  17           HG2      GLN  17  10.051  -0.728  -8.139
  294    HG3  GLN  17           HG1      GLN  17   9.268  -0.540  -6.573
  295   HE21  GLN  17          HE21      GLN  17  12.188  -0.309  -7.202
  296   HE22  GLN  17          HE22      GLN  17  12.956  -1.465  -6.225
  297    H1   ALA   1           HT1      ALA   1   7.525  15.987   2.571
  298    H2   ALA   1           HT2      ALA   1   5.902  15.510   2.726
  299    H3   ALA   1           HT3      ALA   1   7.068  14.403   2.176
  300    HA   ALA   1           HA       ALA   1   8.141  14.351   4.293
  301    HB1  ALA   1           HB1      ALA   1   7.724  16.762   4.800
  302    HB2  ALA   1           HB2      ALA   1   7.322  15.703   6.152
  303    HB3  ALA   1           HB3      ALA   1   6.039  16.368   5.140
  304    H    THR   2           HN       THR   2   4.647  14.804   3.806
  305    HA   THR   2           HA       THR   2   3.822  12.842   5.686
  306    HB   THR   2           HB       THR   2   1.645  12.970   4.524
  307    HG1  THR   2           HG1      THR   2   1.468  14.086   2.650
  308   HG21  THR   2          HG21      THR   2   3.107  15.573   5.016
  309   HG22  THR   2          HG22      THR   2   2.081  14.688   6.145
  310   HG23  THR   2          HG23      THR   2   1.368  15.479   4.739
  311    H    LEU   3           HN       LEU   3   4.494  12.739   2.209
  312    HA   LEU   3           HA       LEU   3   3.590  10.144   1.671
  313    HB2  LEU   3           HB2      LEU   3   5.876  11.715   0.457
  314    HB3  LEU   3           HB1      LEU   3   5.233  10.219  -0.217
  315    HG   LEU   3           HG       LEU   3   3.570  12.699   0.305
  316   HD11  LEU   3          HD11      LEU   3   4.911  11.664  -2.203
  317   HD12  LEU   3          HD12      LEU   3   5.111  13.245  -1.448
  318   HD13  LEU   3          HD13      LEU   3   3.588  12.831  -2.235
  319   HD21  LEU   3          HD21      LEU   3   2.174  10.753   0.309
  320   HD22  LEU   3          HD22      LEU   3   3.043  10.045  -1.051
  321   HD23  LEU   3          HD23      LEU   3   2.016  11.454  -1.301
  322    H    GLU   4           HN       GLU   4   6.802  11.271   2.709
  323    HA   GLU   4           HA       GLU   4   8.104   8.793   2.706
  324    HB2  GLU   4           HB2      GLU   4   8.526  11.262   4.396
  325    HB3  GLU   4           HB1      GLU   4   9.593   9.860   4.461
  326    HG2  GLU   4           HG2      GLU   4  10.643  11.225   2.869
  327    HG3  GLU   4           HG1      GLU   4   9.704  10.118   1.871
  328    H    LYS   5           HN       LYS   5   6.326  10.429   5.319
  329    HA   LYS   5           HA       LYS   5   6.742   8.525   7.327
  330    HB2  LYS   5           HB2      LYS   5   4.448  10.424   6.815
  331    HB3  LYS   5           HB1      LYS   5   4.558   9.420   8.261
  332    HG2  LYS   5           HG2      LYS   5   6.669  10.440   8.882
  333    HG3  LYS   5           HG1      LYS   5   6.727  11.338   7.365
  334    HD2  LYS   5           HD2      LYS   5   5.937  12.842   9.090
  335    HD3  LYS   5           HD1      LYS   5   4.577  12.464   8.032
  336    HE2  LYS   5           HE2      LYS   5   3.770  10.783   9.616
  337    HE3  LYS   5           HE1      LYS   5   5.165  11.065  10.657
  338    HZ1  LYS   5           HZ1      LYS   5   3.648  12.427  11.635
  339    HZ2  LYS   5           HZ2      LYS   5   2.818  12.751  10.188
  340    HZ3  LYS   5           HZ3      LYS   5   4.299  13.519  10.512
  341    H    LEU   6           HN       LEU   6   4.120   8.775   4.932
  342    HA   LEU   6           HA       LEU   6   2.611   6.569   5.769
  343    HB2  LEU   6           HB2      LEU   6   2.981   7.899   3.092
  344    HB3  LEU   6           HB1      LEU   6   1.938   6.489   3.279
  345    HG   LEU   6           HG       LEU   6   1.668   8.925   5.046
  346   HD11  LEU   6          HD11      LEU   6  -0.233   9.557   3.534
  347   HD12  LEU   6          HD12      LEU   6   0.307   8.315   2.404
  348   HD13  LEU   6          HD13      LEU   6   1.345   9.696   2.760
  349   HD21  LEU   6          HD21      LEU   6   0.043   6.459   4.423
  350   HD22  LEU   6          HD22      LEU   6  -0.736   7.904   5.063
  351   HD23  LEU   6          HD23      LEU   6   0.522   7.095   5.996
  352    H    MET   7           HN       MET   7   5.253   6.757   3.392
  353    HA   MET   7           HA       MET   7   5.248   4.076   2.593
  354    HB2  MET   7           HB2      MET   7   6.537   5.867   1.468
  355    HB3  MET   7           HB1      MET   7   7.639   5.914   2.844
  356    HG2  MET   7           HG2      MET   7   8.604   4.506   1.112
  357    HG3  MET   7           HG1      MET   7   8.132   3.490   2.472
  358    HE1  MET   7           HE1      MET   7   7.350   0.948  -0.087
  359    HE2  MET   7           HE2      MET   7   8.479   1.631   1.079
  360    HE3  MET   7           HE3      MET   7   8.532   2.159  -0.601
  361    H    LYS   8           HN       LYS   8   7.053   5.668   5.214
  362    HA   LYS   8           HA       LYS   8   8.493   3.441   6.107
  363    HB2  LYS   8           HB2      LYS   8   7.710   6.060   7.219
  364    HB3  LYS   8           HB1      LYS   8   8.061   4.813   8.416
  365    HG2  LYS   8           HG2      LYS   8  10.131   5.963   7.906
  366    HG3  LYS   8           HG1      LYS   8  10.213   4.349   7.200
  367    HD2  LYS   8           HD2      LYS   8   9.552   5.256   5.011
  368    HD3  LYS   8           HD1      LYS   8   9.435   6.872   5.709
  369    HE2  LYS   8           HE2      LYS   8  11.831   6.795   6.296
  370    HE3  LYS   8           HE1      LYS   8  11.951   5.183   5.591
  371    HZ1  LYS   8           HZ1      LYS   8  12.583   6.444   3.824
  372    HZ2  LYS   8           HZ2      LYS   8  11.627   7.775   4.270
  373    HZ3  LYS   8           HZ3      LYS   8  10.910   6.417   3.544
  374    H    ALA   9           HN       ALA   9   5.302   4.647   7.118
  375    HA   ALA   9           HA       ALA   9   4.780   2.750   9.111
  376    HB1  ALA   9           HB1      ALA   9   3.365   4.688   8.879
  377    HB2  ALA   9           HB2      ALA   9   2.369   3.253   8.637
  378    HB3  ALA   9           HB3      ALA   9   2.894   4.207   7.249
  379    H    PHE  10           HN       PHE  10   4.021   2.675   5.634
  380    HA   PHE  10           HA       PHE  10   2.682   0.217   5.583
  381    HB2  PHE  10           HB2      PHE  10   2.783   1.829   3.686
  382    HB3  PHE  10           HB1      PHE  10   4.459   1.349   3.412
  383    HD1  PHE  10           HD1      PHE  10   0.956   0.117   3.501
  384    HD2  PHE  10           HD2      PHE  10   5.001  -0.703   2.311
  385    HE1  PHE  10           HE1      PHE  10   0.176  -1.848   2.208
  386    HE2  PHE  10           HE2      PHE  10   4.220  -2.668   1.016
  387    HZ   PHE  10           HZ       PHE  10   1.807  -3.240   0.966
  388    H    GLU  11           HN       GLU  11   6.139   0.937   5.148
  389    HA   GLU  11           HA       GLU  11   7.023  -1.673   4.650
  390    HB2  GLU  11           HB2      GLU  11   8.395   0.671   5.981
  391    HB3  GLU  11           HB1      GLU  11   9.222  -0.834   5.581
  392    HG2  GLU  11           HG2      GLU  11   7.773   0.957   3.607
  393    HG3  GLU  11           HG1      GLU  11   9.522   0.845   3.795
  394    H    SER  12           HN       SER  12   6.704   0.077   7.734
  395    HA   SER  12           HA       SER  12   7.692  -1.928   9.422
  396    HB2  SER  12           HB2      SER  12   5.582   0.181   9.930
  397    HB3  SER  12           HB1      SER  12   6.308  -0.815  11.188
  398    HG   SER  12           HG       SER  12   7.573   0.950  11.125
  399    H    LEU  13           HN       LEU  13   4.367  -1.286   8.322
  400    HA   LEU  13           HA       LEU  13   3.085  -3.336   9.733
  401    HB2  LEU  13           HB2      LEU  13   1.846  -1.581   8.571
  402    HB3  LEU  13           HB1      LEU  13   2.425  -2.175   7.015
  403    HG   LEU  13           HG       LEU  13   1.298  -4.343   7.436
  404   HD11  LEU  13          HD11      LEU  13   0.456  -2.932   9.978
  405   HD12  LEU  13          HD12      LEU  13   1.312  -4.467   9.829
  406   HD13  LEU  13          HD13      LEU  13  -0.382  -4.351   9.353
  407   HD21  LEU  13          HD21      LEU  13  -0.909  -3.575   6.962
  408   HD22  LEU  13          HD22      LEU  13   0.159  -2.318   6.338
  409   HD23  LEU  13          HD23      LEU  13  -0.670  -2.088   7.878
  410    H    LYS  14           HN       LYS  14   4.517  -3.359   6.476
  411    HA   LYS  14           HA       LYS  14   3.865  -5.991   5.788
  412    HB2  LYS  14           HB2      LYS  14   6.083  -4.138   4.956
  413    HB3  LYS  14           HB1      LYS  14   6.016  -5.794   4.352
  414    HG2  LYS  14           HG2      LYS  14   3.653  -3.912   4.189
  415    HG3  LYS  14           HG1      LYS  14   4.855  -4.039   2.905
  416    HD2  LYS  14           HD2      LYS  14   4.406  -6.476   2.746
  417    HD3  LYS  14           HD1      LYS  14   3.162  -6.313   3.984
  418    HE2  LYS  14           HE2      LYS  14   1.915  -4.758   2.550
  419    HE3  LYS  14           HE1      LYS  14   3.164  -4.885   1.311
  420    HZ1  LYS  14           HZ1      LYS  14   1.944  -7.351   2.314
  421    HZ2  LYS  14           HZ2      LYS  14   2.546  -6.991   0.766
  422    HZ3  LYS  14           HZ3      LYS  14   1.035  -6.388   1.255
  423    H    SER  15           HN       SER  15   6.761  -4.713   7.406
  424    HA   SER  15           HA       SER  15   8.156  -7.129   7.649
  425    HB2  SER  15           HB2      SER  15   9.399  -6.052   9.454
  426    HB3  SER  15           HB1      SER  15   9.155  -4.917   8.132
  427    HG   SER  15           HG       SER  15   8.630  -4.366  10.506
  428    H    PHE  16           HN       PHE  16   5.831  -5.584   9.854
  429    HA   PHE  16           HA       PHE  16   5.914  -7.482  11.908
  430    HB2  PHE  16           HB2      PHE  16   3.623  -5.752  10.946
  431    HB3  PHE  16           HB1      PHE  16   3.603  -6.676  12.446
  432    HD1  PHE  16           HD1      PHE  16   3.737  -3.496  11.597
  433    HD2  PHE  16           HD2      PHE  16   6.369  -6.360  13.420
  434    HE1  PHE  16           HE1      PHE  16   4.944  -1.658  12.743
  435    HE2  PHE  16           HE2      PHE  16   7.575  -4.522  14.567
  436    HZ   PHE  16           HZ       PHE  16   6.863  -2.171  14.228
  437    H    GLN  17           HN       GLN  17   3.825  -7.321   9.034
  438    HA   GLN  17           HA       GLN  17   2.278  -9.595   9.553
  439    HB2  GLN  17           HB2      GLN  17   2.013  -7.818   7.691
  440    HB3  GLN  17           HB1      GLN  17   3.114  -8.841   6.765
  441    HG2  GLN  17           HG2      GLN  17   0.728 -10.051   8.139
  442    HG3  GLN  17           HG1      GLN  17   0.540  -9.268   6.573
  443   HE21  GLN  17          HE21      GLN  17   0.309 -12.188   7.202
  444   HE22  GLN  17          HE22      GLN  17   1.465 -12.956   6.225
  445    H1   ALA   1           HT1      ALA   1  -7.525 -15.987   2.571
  446    H2   ALA   1           HT2      ALA   1  -5.902 -15.510   2.726
  447    H3   ALA   1           HT3      ALA   1  -7.068 -14.403   2.176
  448    HA   ALA   1           HA       ALA   1  -8.141 -14.351   4.293
  449    HB1  ALA   1           HB1      ALA   1  -7.724 -16.762   4.800
  450    HB2  ALA   1           HB2      ALA   1  -7.322 -15.703   6.152
  451    HB3  ALA   1           HB3      ALA   1  -6.039 -16.368   5.140
  452    H    THR   2           HN       THR   2  -4.647 -14.804   3.806
  453    HA   THR   2           HA       THR   2  -3.822 -12.842   5.686
  454    HB   THR   2           HB       THR   2  -1.645 -12.970   4.524
  455    HG1  THR   2           HG1      THR   2  -1.468 -14.086   2.650
  456   HG21  THR   2          HG21      THR   2  -3.107 -15.573   5.016
  457   HG22  THR   2          HG22      THR   2  -2.081 -14.688   6.145
  458   HG23  THR   2          HG23      THR   2  -1.368 -15.479   4.739
  459    H    LEU   3           HN       LEU   3  -4.494 -12.739   2.209
  460    HA   LEU   3           HA       LEU   3  -3.590 -10.144   1.671
  461    HB2  LEU   3           HB2      LEU   3  -5.876 -11.715   0.457
  462    HB3  LEU   3           HB1      LEU   3  -5.233 -10.219  -0.217
  463    HG   LEU   3           HG       LEU   3  -3.570 -12.699   0.305
  464   HD11  LEU   3          HD11      LEU   3  -4.911 -11.664  -2.203
  465   HD12  LEU   3          HD12      LEU   3  -5.111 -13.245  -1.448
  466   HD13  LEU   3          HD13      LEU   3  -3.588 -12.831  -2.235
  467   HD21  LEU   3          HD21      LEU   3  -2.174 -10.753   0.309
  468   HD22  LEU   3          HD22      LEU   3  -3.043 -10.045  -1.051
  469   HD23  LEU   3          HD23      LEU   3  -2.016 -11.454  -1.301
  470    H    GLU   4           HN       GLU   4  -6.802 -11.271   2.709
  471    HA   GLU   4           HA       GLU   4  -8.104  -8.793   2.706
  472    HB2  GLU   4           HB2      GLU   4  -8.526 -11.262   4.396
  473    HB3  GLU   4           HB1      GLU   4  -9.593  -9.860   4.461
  474    HG2  GLU   4           HG2      GLU   4 -10.643 -11.225   2.869
  475    HG3  GLU   4           HG1      GLU   4  -9.704 -10.118   1.871
  476    H    LYS   5           HN       LYS   5  -6.326 -10.429   5.319
  477    HA   LYS   5           HA       LYS   5  -6.742  -8.525   7.327
  478    HB2  LYS   5           HB2      LYS   5  -4.448 -10.424   6.815
  479    HB3  LYS   5           HB1      LYS   5  -4.558  -9.420   8.261
  480    HG2  LYS   5           HG2      LYS   5  -6.669 -10.440   8.882
  481    HG3  LYS   5           HG1      LYS   5  -6.727 -11.338   7.365
  482    HD2  LYS   5           HD2      LYS   5  -5.937 -12.842   9.090
  483    HD3  LYS   5           HD1      LYS   5  -4.577 -12.464   8.032
  484    HE2  LYS   5           HE2      LYS   5  -3.770 -10.783   9.616
  485    HE3  LYS   5           HE1      LYS   5  -5.165 -11.065  10.657
  486    HZ1  LYS   5           HZ1      LYS   5  -3.648 -12.427  11.635
  487    HZ2  LYS   5           HZ2      LYS   5  -2.818 -12.751  10.188
  488    HZ3  LYS   5           HZ3      LYS   5  -4.299 -13.519  10.512
  489    H    LEU   6           HN       LEU   6  -4.120  -8.775   4.932
  490    HA   LEU   6           HA       LEU   6  -2.611  -6.569   5.769
  491    HB2  LEU   6           HB2      LEU   6  -2.981  -7.899   3.092
  492    HB3  LEU   6           HB1      LEU   6  -1.938  -6.489   3.278
  493    HG   LEU   6           HG       LEU   6  -1.668  -8.925   5.046
  494   HD11  LEU   6          HD11      LEU   6   0.233  -9.557   3.534
  495   HD12  LEU   6          HD12      LEU   6  -0.307  -8.315   2.404
  496   HD13  LEU   6          HD13      LEU   6  -1.345  -9.696   2.760
  497   HD21  LEU   6          HD21      LEU   6  -0.043  -6.459   4.423
  498   HD22  LEU   6          HD22      LEU   6   0.736  -7.904   5.063
  499   HD23  LEU   6          HD23      LEU   6  -0.522  -7.095   5.996
  500    H    MET   7           HN       MET   7  -5.253  -6.757   3.392
  501    HA   MET   7           HA       MET   7  -5.248  -4.076   2.593
  502    HB2  MET   7           HB2      MET   7  -6.537  -5.867   1.468
  503    HB3  MET   7           HB1      MET   7  -7.639  -5.914   2.844
  504    HG2  MET   7           HG2      MET   7  -8.604  -4.506   1.112
  505    HG3  MET   7           HG1      MET   7  -8.132  -3.490   2.472
  506    HE1  MET   7           HE1      MET   7  -7.350  -0.948  -0.087
  507    HE2  MET   7           HE2      MET   7  -8.479  -1.631   1.079
  508    HE3  MET   7           HE3      MET   7  -8.532  -2.159  -0.601
  509    H    LYS   8           HN       LYS   8  -7.053  -5.668   5.214
  510    HA   LYS   8           HA       LYS   8  -8.493  -3.441   6.107
  511    HB2  LYS   8           HB2      LYS   8  -7.710  -6.060   7.219
  512    HB3  LYS   8           HB1      LYS   8  -8.061  -4.813   8.416
  513    HG2  LYS   8           HG2      LYS   8 -10.131  -5.963   7.906
  514    HG3  LYS   8           HG1      LYS   8 -10.213  -4.349   7.200
  515    HD2  LYS   8           HD2      LYS   8  -9.552  -5.256   5.011
  516    HD3  LYS   8           HD1      LYS   8  -9.435  -6.872   5.709
  517    HE2  LYS   8           HE2      LYS   8 -11.831  -6.795   6.296
  518    HE3  LYS   8           HE1      LYS   8 -11.951  -5.183   5.591
  519    HZ1  LYS   8           HZ1      LYS   8 -12.583  -6.444   3.824
  520    HZ2  LYS   8           HZ2      LYS   8 -11.627  -7.775   4.270
  521    HZ3  LYS   8           HZ3      LYS   8 -10.910  -6.417   3.544
  522    H    ALA   9           HN       ALA   9  -5.302  -4.647   7.118
  523    HA   ALA   9           HA       ALA   9  -4.780  -2.750   9.111
  524    HB1  ALA   9           HB1      ALA   9  -3.365  -4.689   8.879
  525    HB2  ALA   9           HB2      ALA   9  -2.369  -3.254   8.638
  526    HB3  ALA   9           HB3      ALA   9  -2.893  -4.207   7.250
  527    H    PHE  10           HN       PHE  10  -4.021  -2.675   5.634
  528    HA   PHE  10           HA       PHE  10  -2.682  -0.217   5.583
  529    HB2  PHE  10           HB2      PHE  10  -2.783  -1.829   3.686
  530    HB3  PHE  10           HB1      PHE  10  -4.459  -1.349   3.412
  531    HD1  PHE  10           HD1      PHE  10  -0.956  -0.117   3.501
  532    HD2  PHE  10           HD2      PHE  10  -5.001   0.703   2.311
  533    HE1  PHE  10           HE1      PHE  10  -0.176   1.848   2.208
  534    HE2  PHE  10           HE2      PHE  10  -4.220   2.668   1.016
  535    HZ   PHE  10           HZ       PHE  10  -1.807   3.240   0.966
  536    H    GLU  11           HN       GLU  11  -6.139  -0.937   5.148
  537    HA   GLU  11           HA       GLU  11  -7.023   1.673   4.650
  538    HB2  GLU  11           HB2      GLU  11  -8.395  -0.671   5.981
  539    HB3  GLU  11           HB1      GLU  11  -9.222   0.834   5.581
  540    HG2  GLU  11           HG2      GLU  11  -7.773  -0.957   3.607
  541    HG3  GLU  11           HG1      GLU  11  -9.522  -0.845   3.795
  542    H    SER  12           HN       SER  12  -6.704  -0.077   7.734
  543    HA   SER  12           HA       SER  12  -7.691   1.934   9.414
  544    HB2  SER  12           HB2      SER  12  -6.488   0.807  11.215
  545    HB3  SER  12           HB1      SER  12  -7.250  -0.381  10.163
  546    HG   SER  12           HG       SER  12  -4.561   0.260  10.522
  547    H    LEU  13           HN       LEU  13  -4.367   1.286   8.322
  548    HA   LEU  13           HA       LEU  13  -3.084   3.336   9.733
  549    HB2  LEU  13           HB2      LEU  13  -1.845   1.581   8.570
  550    HB3  LEU  13           HB1      LEU  13  -2.425   2.175   7.014
  551    HG   LEU  13           HG       LEU  13  -1.298   4.343   7.435
  552   HD11  LEU  13          HD11      LEU  13  -0.460   2.932   9.978
  553   HD12  LEU  13          HD12      LEU  13  -1.311   4.469   9.827
  554   HD13  LEU  13          HD13      LEU  13   0.383   4.349   9.352
  555   HD21  LEU  13          HD21      LEU  13   0.908   3.575   6.961
  556   HD22  LEU  13          HD22      LEU  13  -0.159   2.318   6.338
  557   HD23  LEU  13          HD23      LEU  13   0.669   2.088   7.877
  558    H    LYS  14           HN       LYS  14  -4.517   3.359   6.476
  559    HA   LYS  14           HA       LYS  14  -3.865   5.991   5.788
  560    HB2  LYS  14           HB2      LYS  14  -6.083   4.138   4.956
  561    HB3  LYS  14           HB1      LYS  14  -6.016   5.794   4.352
  562    HG2  LYS  14           HG2      LYS  14  -3.653   3.912   4.189
  563    HG3  LYS  14           HG1      LYS  14  -4.855   4.039   2.905
  564    HD2  LYS  14           HD2      LYS  14  -4.406   6.476   2.746
  565    HD3  LYS  14           HD1      LYS  14  -3.162   6.313   3.984
  566    HE2  LYS  14           HE2      LYS  14  -1.915   4.758   2.550
  567    HE3  LYS  14           HE1      LYS  14  -3.164   4.885   1.311
  568    HZ1  LYS  14           HZ1      LYS  14  -1.944   7.351   2.314
  569    HZ2  LYS  14           HZ2      LYS  14  -2.546   6.991   0.766
  570    HZ3  LYS  14           HZ3      LYS  14  -1.035   6.388   1.255
  571    H    SER  15           HN       SER  15  -6.761   4.713   7.406
  572    HA   SER  15           HA       SER  15  -8.156   7.128   7.649
  573    HB2  SER  15           HB2      SER  15  -9.400   6.050   9.454
  574    HB3  SER  15           HB1      SER  15  -9.152   4.914   8.131
  575    HG   SER  15           HG       SER  15  -7.744   5.105  10.584
  576    H    PHE  16           HN       PHE  16  -5.831   5.584   9.854
  577    HA   PHE  16           HA       PHE  16  -5.914   7.480  11.910
  578    HB2  PHE  16           HB2      PHE  16  -4.784   5.360  12.215
  579    HB3  PHE  16           HB1      PHE  16  -3.624   5.752  10.945
  580    HD1  PHE  16           HD1      PHE  16  -4.871   6.862  14.284
  581    HD2  PHE  16           HD2      PHE  16  -1.673   7.001  11.421
  582    HE1  PHE  16           HE1      PHE  16  -3.432   8.006  15.947
  583    HE2  PHE  16           HE2      PHE  16  -0.233   8.145  13.083
  584    HZ   PHE  16           HZ       PHE  16  -1.113   8.649  15.347
  585    H    GLN  17           HN       GLN  17  -3.825   7.321   9.034
  586    HA   GLN  17           HA       GLN  17  -2.278   9.595   9.553
  587    HB2  GLN  17           HB2      GLN  17  -2.013   7.818   7.691
  588    HB3  GLN  17           HB1      GLN  17  -3.114   8.841   6.765
  589    HG2  GLN  17           HG2      GLN  17  -0.727  10.051   8.138
  590    HG3  GLN  17           HG1      GLN  17  -0.541   9.268   6.572
  591   HE21  GLN  17          HE21      GLN  17  -0.309  12.188   7.203
  592   HE22  GLN  17          HE22      GLN  17  -1.466  12.956   6.227