*HEADER    SIGNALING PROTEIN                       18-JAN-17   5UJL              
*TITLE     REPRESENTATIVE 1-CONFORMER ENSEMBLES OF K27-LINKED UB2 FROM RDC DATA  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: UBIQUITIN;                                                 
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 FRAGMENT: RESIDUES 1-76;                                             
*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: UBB;                                                           
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562                                         
*KEYWDS    DIUBIQUITIN, K27-LINKAGE, POST-TRANSLATIONAL MODIFICATION, SIGNALING  
*KEYWDS   2 PROTEIN                                                              
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    2                                                                     
*AUTHOR    C.A.CASTANEDA,D.FUSHMAN                                               
*REVDAT   1   25-OCT-17 5UJL    0                                                
# Restraints file 1: K27_both_RDC_for_armor_b72_edited.txt
  2  A  N    2  A  H  -12.690000  1.00
*  3  A  N    3  A  H   14.820000  1.00
*  4  A  N    4  A  H   18.310000  1.00
*  5  A  N    5  A  H    9.920000  1.00
  6  A  N    6  A  H   17.150000  1.00
*  7  A  N    7  A  H   -1.550000  1.00
*  8  A  N    8  A  H   18.040000  1.00
*  9  A  N    9  A  H    6.910000  1.00
* 10  A  N   10  A  H   10.330000  1.00
* 11  A  N   11  A  H  -17.030000  1.00
* 12  A  N   12  A  H   10.440000  1.00
 13  A  N   13  A  H    3.190000  1.00
* 14  A  N   14  A  H   21.050000  1.00
 15  A  N   15  A  H   19.730000  1.00
* 16  A  N   16  A  H    3.290000  1.00
 17  A  N   17  A  H    2.880000  1.00
 18  A  N   18  A  H  -20.410000  1.00
 20  A  N   20  A  H  -20.110000  1.00
 21  A  N   21  A  H    4.660000  1.00
* 22  A  N   22  A  H   17.560000  1.00
* 23  A  N   23  A  H   13.770000  1.00
* 25  A  N   25  A  H   15.840000  1.00
 26  A  N   26  A  H   15.970000  1.00
 27  A  N   27  A  H   18.390000  1.00
 28  A  N   28  A  H   10.910000  1.00
* 29  A  N   29  A  H   14.290000  1.00
 30  A  N   30  A  H   16.520000  1.00
 31  A  N   31  A  H   14.610000  1.00
 32  A  N   32  A  H   10.830000  1.00
 33  A  N   33  A  H   14.720000  1.00
 34  A  N   34  A  H   17.860000  1.00
* 35  A  N   35  A  H  -23.050000  1.00
* 36  A  N   36  A  H  -22.870000  1.00
 39  A  N   39  A  H   20.910000  1.00
 40  A  N   40  A  H   -7.460000  1.00
 41  A  N   41  A  H   17.420000  1.00
* 42  A  N   42  A  H   14.220000  1.00
 43  A  N   43  A  H   17.510000  1.00
 44  A  N   44  A  H   16.140000  1.00
 45  A  N   45  A  H   -0.220000  1.00
* 46  A  N   46  A  H    6.620000  1.00
* 47  A  N   47  A  H   10.880000  1.00
* 48  A  N   48  A  H  -21.150000  1.00
 49  A  N   49  A  H   -5.530000  1.00
 50  A  N   50  A  H   14.430000  1.00
 51  A  N   51  A  H   -5.400000  1.00
* 52  A  N   52  A  H  -38.910000  1.00
 54  A  N   54  A  H   -2.910000  1.00
 55  A  N   55  A  H   18.440000  1.00
 56  A  N   56  A  H   14.950000  1.00
* 57  A  N   57  A  H   14.950000  1.00
% 58  A  N   58  A  H   14.480000  1.00
* 59  A  N   59  A  H   12.810000  1.00
 60  A  N   60  A  H   17.740000  1.00
 61  A  N   61  A  H   17.040000  1.00
 62  A  N   62  A  H    4.290000  1.00
 63  A  N   63  A  H  -13.230000  1.00
 64  A  N   64  A  H   22.090000  1.00
 65  A  N   65  A  H   12.950000  1.00
* 66  A  N   66  A  H   21.760000  1.00
 67  A  N   67  A  H    9.580000  1.00
* 68  A  N   68  A  H   18.230000  1.00
 69  A  N   69  A  H   11.350000  1.00
* 71  A  N   71  A  H   31.280000  1.00
* 72  A  N   72  A  H    8.210000  1.00
%* 73  A  N   73  A  H   19.270000  1.00
%* 74  A  N   74  A  H   13.700000  1.00
%* 75  A  N   75  A  H   11.320000  1.00
%* 76  A  N   76  A  H   10.870000  1.00
  2  B  N    2  B  H   -8.100000  1.00
  3  B  N    3  B  H   15.490000  1.00
*  4  B  N    4  B  H   11.790000  1.00
  5  B  N    5  B  H   -2.350000  1.00
  6  B  N    6  B  H    2.650000  1.00
  7  B  N    7  B  H  -24.170000  1.00
*  8  B  N    8  B  H   -5.230000  1.00
*  9  B  N    9  B  H   12.360000  1.00
* 10  B  N   10  B  H   -8.500000  1.00
* 11  B  N   11  B  H  -21.030000  1.00
* 12  B  N   12  B  H  -14.640000  1.00
 13  B  N   13  B  H  -11.460000  1.00
 14  B  N   14  B  H    9.960000  1.00
 15  B  N   15  B  H   13.040000  1.00
* 16  B  N   16  B  H   10.550000  1.00
 17  B  N   17  B  H   -5.240000  1.00
 18  B  N   18  B  H  -17.210000  1.00
* 20  B  N   20  B  H  -17.320000  1.00
 21  B  N   21  B  H  -17.940000  1.00
 22  B  N   22  B  H   12.820000  1.00
* 23  B  N   23  B  H    0.790000  1.00
* 25  B  N   25  B  H   16.670000  1.00
* 26  B  N   26  B  H    0.250000  1.00
 28  B  N   28  B  H   14.860000  1.00
* 29  B  N   29  B  H   12.570000  1.00
 30  B  N   30  B  H   -2.760000  1.00
* 31  B  N   31  B  H    8.420000  1.00
 32  B  N   32  B  H   15.460000  1.00
 33  B  N   33  B  H    7.020000  1.00
 34  B  N   34  B  H    4.860000  1.00
 35  B  N   35  B  H   12.460000  1.00
* 36  B  N   36  B  H   -9.300000  1.00
* 39  B  N   39  B  H   13.480000  1.00
 40  B  N   40  B  H   -9.540000  1.00
* 41  B  N   41  B  H    8.630000  1.00
* 42  B  N   42  B  H  -10.140000  1.00
 43  B  N   43  B  H   -4.880000  1.00
 44  B  N   44  B  H   -5.140000  1.00
 45  B  N   45  B  H  -23.910000  1.00
 46  B  N   46  B  H  -11.830000  1.00
 47  B  N   47  B  H    2.940000  1.00
* 48  B  N   48  B  H  -23.270000  1.00
* 49  B  N   49  B  H  -11.410000  1.00
* 50  B  N   50  B  H    9.800000  1.00
* 51  B  N   51  B  H   11.420000  1.00
* 52  B  N   52  B  H    0.330000  1.00
* 54  B  N   54  B  H   16.360000  1.00
 55  B  N   55  B  H   15.010000  1.00
 56  B  N   56  B  H    9.740000  1.00
 57  B  N   57  B  H   10.650000  1.00
 58  B  N   58  B  H   14.250000  1.00
 59  B  N   59  B  H    3.940000  1.00
 60  B  N   60  B  H    8.330000  1.00
 61  B  N   61  B  H   -6.400000  1.00
* 62  B  N   62  B  H   12.010000  1.00
* 63  B  N   63  B  H   16.520000  1.00
 64  B  N   64  B  H   12.200000  1.00
 65  B  N   65  B  H   12.260000  1.00
 66  B  N   66  B  H   13.840000  1.00
 67  B  N   67  B  H   -1.380000  1.00
 68  B  N   68  B  H   -3.750000  1.00
% 69  B  N   69  B  H  -14.870000  1.00
* 70  B  N   70  B  H    7.990000  1.00
* 71  B  N   71  B  H    8.640000  1.00
* 72  B  N   72  B  H    6.090000  1.00
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1 -24.863   7.082   4.308
    2    H2   MET   1           HT2      MET   1 -23.499   6.405   3.552
    3    H3   MET   1           HT3      MET   1 -23.456   7.973   4.146
    4    HA   MET   1           HA       MET   1 -23.512   7.339   6.379
    5    HB2  MET   1           HB1      MET   1 -23.615   4.976   7.137
    6    HB3  MET   1           HB2      MET   1 -25.063   5.352   6.153
    7    HG2  MET   1           HG1      MET   1 -23.905   4.247   4.146
    8    HG3  MET   1           HG2      MET   1 -22.547   3.813   5.217
    9    HE1  MET   1           HE1      MET   1 -24.070   0.451   4.343
   10    HE2  MET   1           HE2      MET   1 -23.927   1.932   3.345
   11    HE3  MET   1           HE3      MET   1 -22.608   1.488   4.474
   12    H    GLN   2           HN       GLN   2 -21.386   6.722   7.631
   13    HA   GLN   2           HA       GLN   2 -19.396   7.214   5.605
   14    HB2  GLN   2           HB1      GLN   2 -19.620   8.743   7.415
   15    HB3  GLN   2           HB2      GLN   2 -19.507   7.421   8.607
   16    HG2  GLN   2           HG1      GLN   2 -17.094   7.053   8.061
   17    HG3  GLN   2           HG2      GLN   2 -17.189   8.260   6.720
   18   HE21  GLN   2          HE21      GLN   2 -17.666   9.775  10.550
   19   HE22  GLN   2          HE22      GLN   2 -18.408   8.242  10.152
   20    H    ILE   3           HN       ILE   3 -17.597   6.015   5.144
   21    HA   ILE   3           HA       ILE   3 -16.943   3.846   7.035
   22    HB   ILE   3           HB       ILE   3 -15.870   2.485   5.299
   23   HG12  ILE   3          HG11      ILE   3 -17.396   4.278   3.309
   24   HG13  ILE   3          HG12      ILE   3 -15.623   4.355   3.579
   25   HG21  ILE   3          HG21      ILE   3 -18.002   1.450   4.539
   26   HG22  ILE   3          HG22      ILE   3 -18.185   2.042   6.230
   27   HG23  ILE   3          HG23      ILE   3 -18.892   2.975   4.880
   28   HD11  ILE   3           HD1      ILE   3 -16.130   2.978   1.571
   29   HD12  ILE   3           HD2      ILE   3 -15.384   1.965   2.861
   30   HD13  ILE   3           HD3      ILE   3 -17.159   1.875   2.544
   31    H    PHE   4           HN       PHE   4 -14.777   3.483   7.420
   32    HA   PHE   4           HA       PHE   4 -13.036   5.815   6.849
   33    HB2  PHE   4           HB1      PHE   4 -13.024   3.759   9.171
   34    HB3  PHE   4           HB2      PHE   4 -11.805   5.074   8.942
   35    HD1  PHE   4           HD1      PHE   4 -12.321   7.347   9.509
   36    HD2  PHE   4           HD2      PHE   4 -15.346   4.304   9.810
   37    HE1  PHE   4           HE1      PHE   4 -13.709   8.856  10.907
   38    HE2  PHE   4           HE2      PHE   4 -16.739   5.836  11.180
   39    HZ   PHE   4           HZ       PHE   4 -15.904   8.077  11.758
   40    H    VAL   5           HN       VAL   5 -12.111   4.985   4.851
   41    HA   VAL   5           HA       VAL   5 -10.955   2.300   4.960
   42    HB   VAL   5           HB       VAL   5 -10.752   4.389   2.768
   43   HG11  VAL   5          HG11      VAL   5 -10.205   2.388   1.371
   44   HG12  VAL   5          HG12      VAL   5  -8.999   2.622   2.674
   45   HG13  VAL   5          HG13      VAL   5 -10.249   1.331   2.830
   46   HG21  VAL   5          HG21      VAL   5 -12.586   2.992   1.681
   47   HG22  VAL   5          HG22      VAL   5 -12.819   2.150   3.257
   48   HG23  VAL   5          HG23      VAL   5 -13.136   3.917   3.116
   49    H    LYS   6           HN       LYS   6  -8.959   1.973   5.911
   50    HA   LYS   6           HA       LYS   6  -7.277   4.366   6.262
   51    HB2  LYS   6           HB1      LYS   6  -7.367   1.685   7.683
   52    HB3  LYS   6           HB2      LYS   6  -6.160   2.979   8.026
   53    HG2  LYS   6           HG1      LYS   6  -7.957   4.604   8.542
   54    HG3  LYS   6           HG2      LYS   6  -9.216   3.407   8.092
   55    HD2  LYS   6           HD1      LYS   6  -8.460   1.924   9.953
   56    HD3  LYS   6           HD2      LYS   6  -7.324   3.200  10.513
   57    HE2  LYS   6           HE1      LYS   6  -9.103   4.747  11.062
   58    HE3  LYS   6           HE2      LYS   6 -10.302   3.867  10.034
   59    HZ1  LYS   6           HZ1      LYS   6 -10.442   3.588  12.534
   60    HZ2  LYS   6           HZ2      LYS   6 -10.581   2.224  11.551
   61    HZ3  LYS   6           HZ3      LYS   6  -9.117   2.530  12.382
   62    H    THR   7           HN       THR   7  -5.903   4.792   4.661
   63    HA   THR   7           HA       THR   7  -4.590   2.676   3.236
   64    HB   THR   7           HB       THR   7  -4.065   5.668   3.177
   65    HG1  THR   7           HG1      THR   7  -5.501   5.720   1.601
   66   HG21  THR   7          HG21      THR   7  -3.133   5.087   0.879
   67   HG22  THR   7          HG22      THR   7  -2.184   4.283   2.175
   68   HG23  THR   7          HG23      THR   7  -3.400   3.340   1.227
   69    H    LEU   8           HN       LEU   8  -3.256   1.534   4.375
   70    HA   LEU   8           HA       LEU   8  -1.648   0.888   5.771
   71    HB2  LEU   8           HB1      LEU   8  -0.184   2.576   3.682
   72    HB3  LEU   8           HB2      LEU   8   0.559   1.240   4.630
   73    HG   LEU   8           HG       LEU   8  -1.785   0.988   2.643
   74   HD11  LEU   8          HD11      LEU   8  -0.111  -0.307   1.281
   75   HD12  LEU   8          HD12      LEU   8   0.295   1.437   1.492
   76   HD13  LEU   8          HD13      LEU   8   1.175   0.182   2.445
   77   HD21  LEU   8          HD21      LEU   8  -1.276  -1.545   2.940
   78   HD22  LEU   8          HD22      LEU   8  -0.402  -1.097   4.447
   79   HD23  LEU   8          HD23      LEU   8  -2.155  -0.739   4.281
   80    H    THR   9           HN       THR   9  -0.026   4.067   5.240
   81    HA   THR   9           HA       THR   9   1.053   3.843   7.900
   82    HB   THR   9           HB       THR   9   2.254   5.997   7.260
   83    HG1  THR   9           HG1      THR   9   2.194   6.510   5.118
   84   HG21  THR   9          HG21      THR   9   3.761   4.795   5.669
   85   HG22  THR   9          HG22      THR   9   3.259   3.706   7.013
   86   HG23  THR   9          HG23      THR   9   2.504   3.538   5.384
   87    H    GLY  10           HN       GLY  10  -1.879   5.031   6.877
   88    HA2  GLY  10           HA2      GLY  10  -3.055   5.608   8.997
   89    HA3  GLY  10           HA1      GLY  10  -1.920   6.989   9.147
   90    H    LYS  11           HN       LYS  11  -2.554   6.813   5.943
   91    HA   LYS  11           HA       LYS  11  -4.154   9.169   6.045
   92    HB2  LYS  11           HB1      LYS  11  -2.437   8.886   4.349
   93    HB3  LYS  11           HB2      LYS  11  -3.203   7.392   3.759
   94    HG2  LYS  11           HG1      LYS  11  -3.561   9.203   2.196
   95    HG3  LYS  11           HG2      LYS  11  -5.138   8.681   2.842
   96    HD2  LYS  11           HD1      LYS  11  -5.539  10.712   3.914
   97    HD3  LYS  11           HD2      LYS  11  -3.808  10.960   4.327
   98    HE2  LYS  11           HE1      LYS  11  -4.583  12.711   2.744
   99    HE3  LYS  11           HE2      LYS  11  -3.266  11.691   2.036
  100    HZ1  LYS  11           HZ1      LYS  11  -5.055  12.020   0.404
  101    HZ2  LYS  11           HZ2      LYS  11  -5.042  10.401   0.871
  102    HZ3  LYS  11           HZ3      LYS  11  -6.201  11.321   1.423
  103    H    THR  12           HN       THR  12  -6.119   8.939   6.928
  104    HA   THR  12           HA       THR  12  -7.752   6.625   6.270
  105    HB   THR  12           HB       THR  12  -8.272   8.867   8.264
  106    HG1  THR  12           HG1      THR  12  -6.488   7.429   8.705
  107   HG21  THR  12          HG21      THR  12  -9.920   7.155   9.188
  108   HG22  THR  12          HG22      THR  12 -10.413   7.747   7.566
  109   HG23  THR  12          HG23      THR  12  -9.639   6.126   7.732
  110    H    ILE  13           HN       ILE  13  -8.973   6.613   4.534
  111    HA   ILE  13           HA       ILE  13  -9.993   9.051   3.400
  112    HB   ILE  13           HB       ILE  13 -10.789   6.322   2.391
  113   HG12  ILE  13          HG11      ILE  13  -8.075   7.572   1.727
  114   HG13  ILE  13          HG12      ILE  13  -8.256   6.201   2.856
  115   HG21  ILE  13          HG21      ILE  13 -10.753   7.587   0.246
  116   HG22  ILE  13          HG22      ILE  13 -11.734   8.478   1.455
  117   HG23  ILE  13          HG23      ILE  13 -10.052   9.019   1.068
  118   HD11  ILE  13           HD1      ILE  13  -7.686   5.392   0.584
  119   HD12  ILE  13           HD2      ILE  13  -9.273   4.764   1.141
  120   HD13  ILE  13           HD3      ILE  13  -9.209   6.091  -0.063
  121    H    THR  14           HN       THR  14 -11.573   9.825   4.908
  122    HA   THR  14           HA       THR  14 -13.818   8.190   5.625
  123    HB   THR  14           HB       THR  14 -14.956  10.347   6.240
  124    HG1  THR  14           HG1      THR  14 -13.561  12.082   6.409
  125   HG21  THR  14          HG21      THR  14 -13.464  10.685   8.199
  126   HG22  THR  14          HG22      THR  14 -13.611   8.945   7.813
  127   HG23  THR  14          HG23      THR  14 -12.106   9.836   7.361
  128    H    LEU  15           HN       LEU  15 -15.325   7.413   4.246
  129    HA   LEU  15           HA       LEU  15 -16.021   9.093   1.880
  130    HB2  LEU  15           HB1      LEU  15 -16.141   6.052   2.219
  131    HB3  LEU  15           HB2      LEU  15 -16.605   6.951   0.741
  132    HG   LEU  15           HG       LEU  15 -13.763   6.894   1.935
  133   HD11  LEU  15          HD11      LEU  15 -13.230   5.220   0.264
  134   HD12  LEU  15          HD12      LEU  15 -14.637   4.629   1.205
  135   HD13  LEU  15          HD13      LEU  15 -14.885   5.304  -0.453
  136   HD21  LEU  15          HD21      LEU  15 -13.129   7.697  -0.395
  137   HD22  LEU  15          HD22      LEU  15 -14.864   7.843  -0.803
  138   HD23  LEU  15          HD23      LEU  15 -14.156   8.891   0.476
  139    H    GLU  16           HN       GLU  16 -18.184   9.544   1.537
  140    HA   GLU  16           HA       GLU  16 -20.168   8.378   3.343
  141    HB2  GLU  16           HB1      GLU  16 -19.971  10.812   1.680
  142    HB3  GLU  16           HB2      GLU  16 -21.434   9.887   1.243
  143    HG2  GLU  16           HG1      GLU  16 -20.756  10.824   4.114
  144    HG3  GLU  16           HG2      GLU  16 -21.946  11.577   2.985
  145    H    VAL  17           HN       VAL  17 -20.836   6.358   2.831
  146    HA   VAL  17           HA       VAL  17 -20.996   5.636  -0.030
  147    HB   VAL  17           HB       VAL  17 -20.887   3.289   0.599
  148   HG11  VAL  17          HG11      VAL  17 -18.439   3.312   0.946
  149   HG12  VAL  17          HG12      VAL  17 -18.928   4.613  -0.197
  150   HG13  VAL  17          HG13      VAL  17 -18.497   5.030   1.505
  151   HG21  VAL  17          HG21      VAL  17 -20.093   2.623   2.847
  152   HG22  VAL  17          HG22      VAL  17 -20.091   4.329   3.407
  153   HG23  VAL  17          HG23      VAL  17 -21.651   3.507   3.012
  154    H    GLU  18           HN       GLU  18 -22.649   4.394  -0.762
  155    HA   GLU  18           HA       GLU  18 -25.164   5.449   0.111
  156    HB2  GLU  18           HB1      GLU  18 -24.424   3.408  -2.062
  157    HB3  GLU  18           HB2      GLU  18 -25.971   4.310  -1.995
  158    HG2  GLU  18           HG1      GLU  18 -24.916   6.373  -2.685
  159    HG3  GLU  18           HG2      GLU  18 -23.260   5.738  -2.359
  160    HA   PRO  19           HA       PRO  19 -26.598   1.403   1.742
  161    HB2  PRO  19           HB2      PRO  19 -29.327   1.437   1.233
  162    HB3  PRO  19           HB1      PRO  19 -28.589   2.553   2.448
  163    HG2  PRO  19           HG2      PRO  19 -29.215   3.169  -0.504
  164    HG3  PRO  19           HG1      PRO  19 -29.730   4.118   0.951
  165    HD2  PRO  19           HD2      PRO  19 -27.477   4.760  -0.523
  166    HD3  PRO  19           HD1      PRO  19 -27.476   4.945   1.292
  167    H    SER  20           HN       SER  20 -26.799   2.410  -1.577
  168    HA   SER  20           HA       SER  20 -27.378  -0.223  -2.635
  169    HB2  SER  20           HB1      SER  20 -27.016   1.308  -4.855
  170    HB3  SER  20           HB2      SER  20 -28.519   1.391  -3.884
  171    HG   SER  20           HG1      SER  20 -26.432   3.308  -4.062
  172    H    ASP  21           HN       ASP  21 -24.597   1.158  -1.423
  173    HA   ASP  21           HA       ASP  21 -23.096   1.442  -3.682
  174    HB2  ASP  21           HB1      ASP  21 -22.854   2.113  -0.983
  175    HB3  ASP  21           HB2      ASP  21 -21.505   0.965  -1.177
  176    H    THR  22           HN       THR  22 -21.119   0.634  -4.359
  177    HA   THR  22           HA       THR  22 -20.758  -2.261  -4.082
  178    HB   THR  22           HB       THR  22 -20.475  -2.631  -6.487
  179    HG1  THR  22           HG1      THR  22 -20.184  -0.953  -7.583
  180   HG21  THR  22          HG21      THR  22 -22.857  -2.524  -7.109
  181   HG22  THR  22          HG22      THR  22 -22.742  -2.971  -5.361
  182   HG23  THR  22          HG23      THR  22 -23.193  -1.296  -5.840
  183    H    ILE  23           HN       ILE  23 -18.619  -2.969  -5.161
  184    HA   ILE  23           HA       ILE  23 -16.820  -1.352  -3.592
  185    HB   ILE  23           HB       ILE  23 -16.651  -4.056  -4.888
  186   HG12  ILE  23          HG11      ILE  23 -18.134  -3.635  -2.860
  187   HG13  ILE  23          HG12      ILE  23 -16.920  -4.906  -2.704
  188   HG21  ILE  23          HG21      ILE  23 -14.470  -4.361  -3.612
  189   HG22  ILE  23          HG22      ILE  23 -14.342  -3.210  -4.977
  190   HG23  ILE  23          HG23      ILE  23 -14.439  -2.581  -3.290
  191   HD11  ILE  23           HD1      ILE  23 -17.142  -3.437  -0.648
  192   HD12  ILE  23           HD2      ILE  23 -15.463  -3.442  -1.304
  193   HD13  ILE  23           HD3      ILE  23 -16.547  -2.031  -1.591
  194    H    GLU  24           HN       GLU  24 -17.139  -1.879  -7.119
  195    HA   GLU  24           HA       GLU  24 -14.690  -0.455  -7.625
  196    HB2  GLU  24           HB1      GLU  24 -15.144  -0.658  -9.934
  197    HB3  GLU  24           HB2      GLU  24 -15.517  -2.231  -9.163
  198    HG2  GLU  24           HG1      GLU  24 -17.616  -0.136 -10.100
  199    HG3  GLU  24           HG2      GLU  24 -17.154  -1.653 -10.946
  200    H    ASN  25           HN       ASN  25 -18.135   0.280  -7.382
  201    HA   ASN  25           HA       ASN  25 -18.030   3.051  -7.892
  202    HB2  ASN  25           HB1      ASN  25 -20.103   1.638  -7.652
  203    HB3  ASN  25           HB2      ASN  25 -19.810   1.540  -5.884
  204   HD21  ASN  25          HD21      ASN  25 -22.357   4.071  -6.078
  205   HD22  ASN  25          HD22      ASN  25 -22.181   2.376  -6.365
  206    H    VAL  26           HN       VAL  26 -17.680   1.444  -4.613
  207    HA   VAL  26           HA       VAL  26 -16.684   3.721  -3.342
  208    HB   VAL  26           HB       VAL  26 -16.292   0.775  -2.790
  209   HG11  VAL  26          HG11      VAL  26 -15.431   1.501  -0.507
  210   HG12  VAL  26          HG12      VAL  26 -14.259   1.874  -1.817
  211   HG13  VAL  26          HG13      VAL  26 -15.284   3.188  -1.121
  212   HG21  VAL  26          HG21      VAL  26 -17.819   1.508  -0.833
  213   HG22  VAL  26          HG22      VAL  26 -17.910   3.135  -1.582
  214   HG23  VAL  26          HG23      VAL  26 -18.569   1.716  -2.455
  215    H    LYS  27           HN       LYS  27 -14.722   1.347  -5.257
  216    HA   LYS  27           HA       LYS  27 -12.300   2.715  -4.837
  217    HB2  LYS  27           HB1      LYS  27 -13.215   1.144  -7.300
  218    HB3  LYS  27           HB2      LYS  27 -11.563   1.810  -7.084
  219    HG2  LYS  27           HG1      LYS  27 -11.326   0.471  -4.942
  220    HG3  LYS  27           HG2      LYS  27 -12.871  -0.341  -5.323
  221    HD2  LYS  27           HD1      LYS  27 -11.913  -1.052  -7.565
  222    HD3  LYS  27           HD2      LYS  27 -10.352  -0.290  -7.091
  223    HE2  LYS  27           HE1      LYS  27 -10.211  -1.909  -5.118
  224    HE3  LYS  27           HE2      LYS  27 -11.742  -2.680  -5.713
  225    HZ1  LYS  27           HZ1      LYS  27 -10.029  -3.924  -6.674
  226    HZ2  LYS  27           HZ2      LYS  27 -10.575  -2.960  -7.886
  227    HZ3  LYS  27           HZ3      LYS  27  -9.113  -2.535  -7.150
  228    H    ALA  28           HN       ALA  28 -14.879   3.469  -7.263
  229    HA   ALA  28           HA       ALA  28 -13.502   5.642  -8.416
  230    HB1  ALA  28           HB1      ALA  28 -15.511   4.525  -9.419
  231    HB2  ALA  28           HB2      ALA  28 -16.530   5.215  -8.112
  232    HB3  ALA  28           HB3      ALA  28 -15.720   6.314  -9.285
  233    H    LYS  29           HN       LYS  29 -15.704   5.553  -5.569
  234    HA   LYS  29           HA       LYS  29 -15.523   8.297  -4.933
  235    HB2  LYS  29           HB1      LYS  29 -15.974   5.876  -3.097
  236    HB3  LYS  29           HB2      LYS  29 -16.248   7.590  -2.635
  237    HG2  LYS  29           HG1      LYS  29 -18.009   7.810  -4.383
  238    HG3  LYS  29           HG2      LYS  29 -17.806   6.089  -4.841
  239    HD2  LYS  29           HD1      LYS  29 -18.477   5.377  -2.509
  240    HD3  LYS  29           HD2      LYS  29 -18.570   7.101  -2.032
  241    HE2  LYS  29           HE1      LYS  29 -20.822   6.516  -2.324
  242    HE3  LYS  29           HE2      LYS  29 -20.423   7.376  -3.862
  243    HZ1  LYS  29           HZ1      LYS  29 -21.679   5.384  -4.294
  244    HZ2  LYS  29           HZ2      LYS  29 -20.126   5.090  -4.873
  245    HZ3  LYS  29           HZ3      LYS  29 -20.660   4.425  -3.392
  246    H    ILE  30           HN       ILE  30 -13.147   5.747  -4.364
  247    HA   ILE  30           HA       ILE  30 -11.476   7.490  -2.715
  248    HB   ILE  30           HB       ILE  30 -11.096   4.724  -3.922
  249   HG12  ILE  30          HG11      ILE  30 -11.327   5.711  -1.014
  250   HG13  ILE  30          HG12      ILE  30 -12.681   5.036  -1.974
  251   HG21  ILE  30          HG21      ILE  30  -8.940   4.644  -2.557
  252   HG22  ILE  30          HG22      ILE  30  -8.847   5.819  -3.898
  253   HG23  ILE  30          HG23      ILE  30  -9.125   6.403  -2.218
  254   HD11  ILE  30           HD1      ILE  30 -11.769   3.288  -0.487
  255   HD12  ILE  30           HD2      ILE  30 -11.469   2.855  -2.208
  256   HD13  ILE  30           HD3      ILE  30 -10.124   3.485  -1.189
  257    H    GLN  31           HN       GLN  31 -11.623   6.439  -6.122
  258    HA   GLN  31           HA       GLN  31  -9.218   7.605  -6.976
  259    HB2  GLN  31           HB1      GLN  31 -10.626   5.835  -8.142
  260    HB3  GLN  31           HB2      GLN  31 -11.775   7.143  -8.584
  261    HG2  GLN  31           HG1      GLN  31  -9.790   8.292  -9.841
  262    HG3  GLN  31           HG2      GLN  31  -8.801   6.844  -9.454
  263   HE21  GLN  31          HE21      GLN  31 -11.924   6.530 -12.153
  264   HE22  GLN  31          HE22      GLN  31 -12.000   7.733 -10.876
  265    H    ASP  32           HN       ASP  32 -12.325   9.073  -6.356
  266    HA   ASP  32           HA       ASP  32 -11.827  11.699  -7.281
  267    HB2  ASP  32           HB1      ASP  32 -14.047  10.745  -6.633
  268    HB3  ASP  32           HB2      ASP  32 -13.430  10.357  -4.996
  269    H    LYS  33           HN       LYS  33 -12.230  11.792  -3.985
  270    HA   LYS  33           HA       LYS  33 -10.537  13.283  -2.913
  271    HB2  LYS  33           HB1      LYS  33 -12.334  11.986  -1.882
  272    HB3  LYS  33           HB2      LYS  33 -11.316  10.520  -1.833
  273    HG2  LYS  33           HG1      LYS  33  -9.895  11.437  -0.090
  274    HG3  LYS  33           HG2      LYS  33 -10.500  13.109  -0.380
  275    HD2  LYS  33           HD1      LYS  33 -12.765  12.490   0.349
  276    HD3  LYS  33           HD2      LYS  33 -12.276  10.779   0.602
  277    HE2  LYS  33           HE1      LYS  33 -10.843  11.352   2.505
  278    HE3  LYS  33           HE2      LYS  33 -10.980  13.127   2.157
  279    HZ1  LYS  33           HZ1      LYS  33 -12.523  12.244   3.965
  280    HZ2  LYS  33           HZ2      LYS  33 -13.293  13.051   2.674
  281    HZ3  LYS  33           HZ3      LYS  33 -13.314  11.375   2.791
  282    H    GLU  34           HN       GLU  34  -9.237   9.982  -3.560
  283    HA   GLU  34           HA       GLU  34  -6.639  10.877  -2.445
  284    HB2  GLU  34           HB1      GLU  34  -7.713   8.074  -3.004
  285    HB3  GLU  34           HB2      GLU  34  -6.124   8.454  -2.257
  286    HG2  GLU  34           HG1      GLU  34  -8.857   9.201  -0.979
  287    HG3  GLU  34           HG2      GLU  34  -7.933   7.693  -0.667
  288    H    GLY  35           HN       GLY  35  -8.210  10.161  -5.461
  289    HA2  GLY  35           HA2      GLY  35  -7.411  10.182  -7.556
  290    HA3  GLY  35           HA1      GLY  35  -5.796  10.576  -6.901
  291    H    ILE  36           HN       ILE  36  -7.105   7.590  -5.801
  292    HA   ILE  36           HA       ILE  36  -4.861   6.314  -7.113
  293    HB   ILE  36           HB       ILE  36  -6.755   5.111  -5.083
  294   HG12  ILE  36          HG11      ILE  36  -4.021   6.414  -4.538
  295   HG13  ILE  36          HG12      ILE  36  -5.556   7.294  -4.319
  296   HG21  ILE  36          HG21      ILE  36  -4.800   3.550  -4.699
  297   HG22  ILE  36          HG22      ILE  36  -5.310   3.460  -6.413
  298   HG23  ILE  36          HG23      ILE  36  -3.850   4.412  -5.959
  299   HD11  ILE  36           HD1      ILE  36  -4.816   6.358  -2.160
  300   HD12  ILE  36           HD2      ILE  36  -6.375   5.625  -2.672
  301   HD13  ILE  36           HD3      ILE  36  -4.847   4.690  -2.838
  302    HA   PRO  37           HA       PRO  37  -7.855   4.455  -9.946
  303    HB2  PRO  37           HB2      PRO  37  -6.137   3.086 -11.714
  304    HB3  PRO  37           HB1      PRO  37  -6.359   4.878 -11.696
  305    HG2  PRO  37           HG2      PRO  37  -4.190   3.252 -10.255
  306    HG3  PRO  37           HG1      PRO  37  -3.954   4.656 -11.373
  307    HD2  PRO  37           HD2      PRO  37  -4.002   4.997  -8.646
  308    HD3  PRO  37           HD1      PRO  37  -4.853   6.205  -9.718
  309    HA   PRO  38           HA       PRO  38  -8.975   0.840  -8.314
  310    HB2  PRO  38           HB2      PRO  38  -9.431  -0.532 -11.040
  311    HB3  PRO  38           HB1      PRO  38 -10.587  -0.448  -9.657
  312    HG2  PRO  38           HG1      PRO  38 -10.883   1.301 -11.708
  313    HG3  PRO  38           HG2      PRO  38 -10.915   1.960 -10.020
  314    HD2  PRO  38           HD2      PRO  38  -8.553   1.942 -11.991
  315    HD3  PRO  38           HD1      PRO  38  -9.195   3.290 -10.954
  316    H    ASP  39           HN       ASP  39  -6.502  -0.243 -10.661
  317    HA   ASP  39           HA       ASP  39  -6.212  -2.823  -9.452
  318    HB2  ASP  39           HB1      ASP  39  -5.491  -2.331 -11.829
  319    HB3  ASP  39           HB2      ASP  39  -4.242  -1.195 -11.199
  320    H    GLN  40           HN       GLN  40  -4.701   0.345  -9.070
  321    HA   GLN  40           HA       GLN  40  -2.719  -0.435  -7.222
  322    HB2  GLN  40           HB1      GLN  40  -3.943   2.225  -8.091
  323    HB3  GLN  40           HB2      GLN  40  -2.686   2.163  -6.813
  324    HG2  GLN  40           HG1      GLN  40  -1.779   2.703  -9.129
  325    HG3  GLN  40           HG2      GLN  40  -0.997   1.306  -8.318
  326   HE21  GLN  40          HE21      GLN  40  -1.913  -1.028 -10.783
  327   HE22  GLN  40          HE22      GLN  40  -0.989  -0.649  -9.371
  328    H    GLN  41           HN       GLN  41  -6.090   0.378  -6.839
  329    HA   GLN  41           HA       GLN  41  -5.919   0.407  -3.946
  330    HB2  GLN  41           HB1      GLN  41  -8.293   0.254  -5.889
  331    HB3  GLN  41           HB2      GLN  41  -8.443   0.360  -4.099
  332    HG2  GLN  41           HG1      GLN  41  -7.211   2.600  -4.170
  333    HG3  GLN  41           HG2      GLN  41  -7.249   2.513  -5.975
  334   HE21  GLN  41          HE21      GLN  41 -10.465   3.989  -5.913
  335   HE22  GLN  41          HE22      GLN  41  -8.848   4.033  -6.548
  336    H    ARG  42           HN       ARG  42  -5.229  -1.607  -3.066
  337    HA   ARG  42           HA       ARG  42  -7.111  -3.847  -3.616
  338    HB2  ARG  42           HB1      ARG  42  -4.409  -3.944  -2.201
  339    HB3  ARG  42           HB2      ARG  42  -5.453  -5.343  -2.628
  340    HG2  ARG  42           HG1      ARG  42  -3.954  -3.442  -4.563
  341    HG3  ARG  42           HG2      ARG  42  -3.463  -5.094  -4.071
  342    HD2  ARG  42           HD1      ARG  42  -5.675  -5.932  -5.223
  343    HD3  ARG  42           HD2      ARG  42  -5.801  -4.240  -5.905
  344    HE   ARG  42           HE       ARG  42  -3.099  -5.190  -6.229
  345   HH11  ARG  42          HH11      ARG  42  -5.329  -5.180  -9.377
  346   HH12  ARG  42          HH12      ARG  42  -6.202  -5.177  -7.870
  347   HH21  ARG  42          HH21      ARG  42  -3.414  -5.166  -9.545
  348   HH22  ARG  42          HH22      ARG  42  -2.265  -5.197  -8.265
  349    H    LEU  43           HN       LEU  43  -8.851  -3.491  -2.236
  350    HA   LEU  43           HA       LEU  43  -8.403  -2.395   0.402
  351    HB2  LEU  43           HB1      LEU  43 -10.842  -3.422  -1.116
  352    HB3  LEU  43           HB2      LEU  43 -10.952  -2.816   0.571
  353    HG   LEU  43           HG       LEU  43  -9.782  -1.062  -1.647
  354   HD11  LEU  43          HD11      LEU  43 -12.052  -0.115  -2.016
  355   HD12  LEU  43          HD12      LEU  43 -12.008  -1.854  -2.476
  356   HD13  LEU  43          HD13      LEU  43 -12.772  -1.351  -0.922
  357   HD21  LEU  43          HD21      LEU  43 -10.624   0.749  -0.146
  358   HD22  LEU  43          HD22      LEU  43 -11.300  -0.472   0.990
  359   HD23  LEU  43          HD23      LEU  43  -9.518  -0.347   0.761
  360    H    ILE  44           HN       ILE  44  -8.852  -3.423   2.412
  361    HA   ILE  44           HA       ILE  44  -9.324  -6.351   2.352
  362    HB   ILE  44           HB       ILE  44  -7.423  -4.886   4.235
  363   HG12  ILE  44          HG11      ILE  44  -6.881  -6.925   1.990
  364   HG13  ILE  44          HG12      ILE  44  -6.463  -5.182   1.957
  365   HG21  ILE  44          HG21      ILE  44  -6.959  -7.192   5.150
  366   HG22  ILE  44          HG22      ILE  44  -8.672  -6.768   5.380
  367   HG23  ILE  44          HG23      ILE  44  -8.196  -7.886   4.046
  368   HD11  ILE  44           HD1      ILE  44  -4.440  -6.463   2.480
  369   HD12  ILE  44           HD2      ILE  44  -4.919  -5.529   3.943
  370   HD13  ILE  44           HD3      ILE  44  -5.240  -7.302   3.849
  371    H    PHE  45           HN       PHE  45 -10.981  -7.044   3.634
  372    HA   PHE  45           HA       PHE  45 -11.667  -5.550   5.987
  373    HB2  PHE  45           HB1      PHE  45 -12.949  -4.197   4.324
  374    HB3  PHE  45           HB2      PHE  45 -13.758  -5.686   3.721
  375    HD1  PHE  45           HD1      PHE  45 -13.166  -3.732   6.898
  376    HD2  PHE  45           HD2      PHE  45 -15.759  -6.385   4.742
  377    HE1  PHE  45           HE1      PHE  45 -14.850  -3.544   8.702
  378    HE2  PHE  45           HE2      PHE  45 -17.419  -6.245   6.562
  379    HZ   PHE  45           HZ       PHE  45 -16.998  -4.797   8.526
  380    H    ALA  46           HN       ALA  46 -12.381  -6.820   7.523
  381    HA   ALA  46           HA       ALA  46 -12.689  -8.754   8.623
  382    HB1  ALA  46           HB1      ALA  46 -14.800  -7.482   8.544
  383    HB2  ALA  46           HB2      ALA  46 -15.299  -8.380   7.075
  384    HB3  ALA  46           HB3      ALA  46 -15.122  -9.250   8.646
  385    H    GLY  47           HN       GLY  47 -11.147 -10.256   7.825
  386    HA2  GLY  47           HA2      GLY  47 -10.652 -12.395   7.307
  387    HA3  GLY  47           HA1      GLY  47 -12.333 -12.659   6.740
  388    H    LYS  48           HN       LYS  48 -11.943 -10.232   4.886
  389    HA   LYS  48           HA       LYS  48 -10.854 -11.923   2.725
  390    HB2  LYS  48           HB1      LYS  48 -13.043  -9.775   2.758
  391    HB3  LYS  48           HB2      LYS  48 -12.568 -10.739   1.322
  392    HG2  LYS  48           HG1      LYS  48 -13.387 -12.783   2.263
  393    HG3  LYS  48           HG2      LYS  48 -13.638 -12.101   3.895
  394    HD2  LYS  48           HD1      LYS  48 -15.122 -10.751   1.608
  395    HD3  LYS  48           HD2      LYS  48 -15.606 -12.417   2.016
  396    HE2  LYS  48           HE1      LYS  48 -17.059 -10.856   3.215
  397    HE3  LYS  48           HE2      LYS  48 -16.074 -11.808   4.386
  398    HZ1  LYS  48           HZ1      LYS  48 -16.347  -9.218   4.575
  399    HZ2  LYS  48           HZ2      LYS  48 -14.880 -10.005   4.989
  400    HZ3  LYS  48           HZ3      LYS  48 -15.021  -9.213   3.505
  401    H    GLN  49           HN       GLN  49  -9.358 -11.110   1.307
  402    HA   GLN  49           HA       GLN  49  -8.811  -8.221   1.256
  403    HB2  GLN  49           HB1      GLN  49  -6.893  -9.897   0.859
  404    HB3  GLN  49           HB2      GLN  49  -7.799 -10.457  -0.583
  405    HG2  GLN  49           HG1      GLN  49  -7.709  -7.815  -1.270
  406    HG3  GLN  49           HG2      GLN  49  -6.371  -7.763  -0.082
  407   HE21  GLN  49          HE21      GLN  49  -5.949  -9.588  -3.741
  408   HE22  GLN  49          HE22      GLN  49  -7.464  -8.904  -3.216
  409    H    LEU  50           HN       LEU  50  -9.781  -6.925  -0.404
  410    HA   LEU  50           HA       LEU  50 -12.130  -8.250  -1.537
  411    HB2  LEU  50           HB1      LEU  50 -11.521  -5.276  -1.514
  412    HB3  LEU  50           HB2      LEU  50 -13.098  -6.081  -1.718
  413    HG   LEU  50           HG       LEU  50 -11.406  -5.799   0.835
  414   HD11  LEU  50          HD11      LEU  50 -13.349  -4.544   1.694
  415   HD12  LEU  50          HD12      LEU  50 -12.865  -3.849   0.105
  416   HD13  LEU  50          HD13      LEU  50 -14.294  -4.918   0.209
  417   HD21  LEU  50          HD21      LEU  50 -13.217  -7.013   2.085
  418   HD22  LEU  50          HD22      LEU  50 -13.967  -7.486   0.518
  419   HD23  LEU  50          HD23      LEU  50 -12.338  -8.089   0.953
  420    H    GLU  51           HN       GLU  51 -12.902  -7.715  -3.645
  421    HA   GLU  51           HA       GLU  51 -10.779  -7.802  -5.643
  422    HB2  GLU  51           HB1      GLU  51 -13.796  -8.388  -5.787
  423    HB3  GLU  51           HB2      GLU  51 -12.593  -8.813  -7.058
  424    HG2  GLU  51           HG1      GLU  51 -12.055 -10.788  -6.037
  425    HG3  GLU  51           HG2      GLU  51 -11.883 -10.035  -4.416
  426    H    ASP  52           HN       ASP  52 -13.424  -7.106  -7.314
  427    HA   ASP  52           HA       ASP  52 -13.315  -4.174  -7.166
  428    HB2  ASP  52           HB1      ASP  52 -12.865  -5.976  -9.634
  429    HB3  ASP  52           HB2      ASP  52 -13.543  -4.301  -9.800
  430    H    GLY  53           HN       GLY  53 -15.163  -6.517  -9.232
  431    HA2  GLY  53           HA2      GLY  53 -17.512  -4.909  -8.706
  432    HA3  GLY  53           HA1      GLY  53 -17.362  -6.326  -9.783
  433    H    ARG  54           HN       ARG  54 -17.667  -5.395  -6.380
  434    HA   ARG  54           HA       ARG  54 -19.666  -7.536  -6.034
  435    HB2  ARG  54           HB1      ARG  54 -17.457  -6.832  -3.999
  436    HB3  ARG  54           HB2      ARG  54 -18.848  -7.912  -3.648
  437    HG2  ARG  54           HG1      ARG  54 -16.567  -8.499  -5.644
  438    HG3  ARG  54           HG2      ARG  54 -16.788  -9.116  -3.979
  439    HD2  ARG  54           HD1      ARG  54 -19.128 -10.055  -4.925
  440    HD3  ARG  54           HD2      ARG  54 -18.315  -9.871  -6.530
  441    HE   ARG  54           HE       ARG  54 -16.326 -11.145  -5.501
  442   HH11  ARG  54          HH11      ARG  54 -18.576 -11.762  -2.439
  443   HH12  ARG  54          HH12      ARG  54 -19.338 -11.554  -3.736
  444   HH21  ARG  54          HH21      ARG  54 -16.392 -12.756  -2.592
  445   HH22  ARG  54          HH22      ARG  54 -15.424 -11.898  -3.776
  446    H    THR  55           HN       THR  55 -20.975  -7.026  -3.847
  447    HA   THR  55           HA       THR  55 -21.467  -4.136  -3.847
  448    HB   THR  55           HB       THR  55 -23.442  -4.434  -2.599
  449    HG1  THR  55           HG1      THR  55 -24.013  -6.323  -1.704
  450   HG21  THR  55          HG21      THR  55 -24.754  -5.853  -4.153
  451   HG22  THR  55          HG22      THR  55 -23.524  -4.935  -5.092
  452   HG23  THR  55          HG23      THR  55 -23.265  -6.680  -4.730
  453    H    LEU  56           HN       LEU  56 -21.782  -3.014  -1.617
  454    HA   LEU  56           HA       LEU  56 -19.700  -3.767   0.211
  455    HB2  LEU  56           HB1      LEU  56 -21.827  -1.646   0.091
  456    HB3  LEU  56           HB2      LEU  56 -21.262  -2.110   1.728
  457    HG   LEU  56           HG       LEU  56 -18.893  -1.752   1.043
  458   HD11  LEU  56          HD11      LEU  56 -18.301  -0.527  -0.990
  459   HD12  LEU  56          HD12      LEU  56 -19.154  -2.022  -1.466
  460   HD13  LEU  56          HD13      LEU  56 -20.011  -0.450  -1.519
  461   HD21  LEU  56          HD21      LEU  56 -19.000   0.744   1.114
  462   HD22  LEU  56          HD22      LEU  56 -20.751   0.691   0.712
  463   HD23  LEU  56          HD23      LEU  56 -20.178  -0.002   2.261
  464    H    SER  57           HN       SER  57 -23.151  -4.553   0.037
  465    HA   SER  57           HA       SER  57 -23.380  -5.659   2.617
  466    HB2  SER  57           HB1      SER  57 -25.439  -6.833   1.725
  467    HB3  SER  57           HB2      SER  57 -25.403  -5.043   1.538
  468    HG   SER  57           HG1      SER  57 -26.098  -6.191  -0.353
  469    H    ASP  58           HN       ASP  58 -22.444  -7.254  -0.466
  470    HA   ASP  58           HA       ASP  58 -22.213  -9.871   0.143
  471    HB2  ASP  58           HB1      ASP  58 -21.709  -8.541  -1.988
  472    HB3  ASP  58           HB2      ASP  58 -20.168  -7.994  -1.259
  473    H    TYR  59           HN       TYR  59 -19.668  -7.459   0.749
  474    HA   TYR  59           HA       TYR  59 -18.104  -9.304   2.266
  475    HB2  TYR  59           HB1      TYR  59 -17.897  -6.285   1.721
  476    HB3  TYR  59           HB2      TYR  59 -16.587  -7.220   2.539
  477    HD1  TYR  59           HD1      TYR  59 -16.982  -9.819   0.575
  478    HD2  TYR  59           HD2      TYR  59 -16.530  -5.573   0.001
  479    HE1  TYR  59           HE1      TYR  59 -15.678 -10.229  -1.462
  480    HE2  TYR  59           HE2      TYR  59 -15.245  -6.022  -2.072
  481    HH   TYR  59           HH       TYR  59 -14.470  -9.318  -3.163
  482    H    ASN  60           HN       ASN  60 -20.745  -7.612   3.233
  483    HA   ASN  60           HA       ASN  60 -21.696  -6.906   5.021
  484    HB2  ASN  60           HB1      ASN  60 -20.880  -9.154   5.900
  485    HB3  ASN  60           HB2      ASN  60 -19.587  -8.253   6.779
  486   HD21  ASN  60          HD21      ASN  60 -22.328  -8.763   9.170
  487   HD22  ASN  60          HD22      ASN  60 -21.098  -9.700   8.356
  488    H    ILE  61           HN       ILE  61 -20.262  -4.996   3.771
  489    HA   ILE  61           HA       ILE  61 -18.892  -3.434   5.849
  490    HB   ILE  61           HB       ILE  61 -19.314  -2.942   2.886
  491   HG12  ILE  61          HG11      ILE  61 -16.740  -3.569   4.454
  492   HG13  ILE  61          HG12      ILE  61 -17.704  -4.817   3.602
  493   HG21  ILE  61          HG21      ILE  61 -17.683  -1.007   3.273
  494   HG22  ILE  61          HG22      ILE  61 -19.228  -0.760   4.134
  495   HG23  ILE  61          HG23      ILE  61 -17.779  -1.319   5.044
  496   HD11  ILE  61           HD1      ILE  61 -15.825  -4.115   2.161
  497   HD12  ILE  61           HD2      ILE  61 -17.393  -3.610   1.428
  498   HD13  ILE  61           HD3      ILE  61 -16.346  -2.394   2.247
  499    H    GLN  62           HN       GLN  62 -19.888  -1.884   6.956
  500    HA   GLN  62           HA       GLN  62 -22.642  -1.110   6.153
  501    HB2  GLN  62           HB1      GLN  62 -21.601  -1.556   9.008
  502    HB3  GLN  62           HB2      GLN  62 -23.333  -1.406   8.461
  503    HG2  GLN  62           HG1      GLN  62 -23.229  -3.688   7.479
  504    HG3  GLN  62           HG2      GLN  62 -21.489  -3.830   7.924
  505   HE21  GLN  62          HE21      GLN  62 -23.185  -5.480  10.685
  506   HE22  GLN  62          HE22      GLN  62 -22.788  -5.755   8.999
  507    H    LYS  63           HN       LYS  63 -23.286   0.701   8.066
  508    HA   LYS  63           HA       LYS  63 -21.660   2.921   7.852
  509    HB2  LYS  63           HB1      LYS  63 -22.953   4.040   9.328
  510    HB3  LYS  63           HB2      LYS  63 -24.123   2.828   8.749
  511    HG2  LYS  63           HG1      LYS  63 -22.538   2.578  11.439
  512    HG3  LYS  63           HG2      LYS  63 -23.964   3.589  11.240
  513    HD2  LYS  63           HD1      LYS  63 -24.623   1.568  12.328
  514    HD3  LYS  63           HD2      LYS  63 -25.427   1.727  10.740
  515    HE2  LYS  63           HE1      LYS  63 -24.813  -0.636  11.275
  516    HE3  LYS  63           HE2      LYS  63 -24.029  -0.038   9.773
  517    HZ1  LYS  63           HZ1      LYS  63 -22.579  -1.348  11.177
  518    HZ2  LYS  63           HZ2      LYS  63 -21.960   0.237  10.977
  519    HZ3  LYS  63           HZ3      LYS  63 -22.689  -0.210  12.440
  520    H    GLU  64           HN       GLU  64 -20.173   3.976   9.086
  521    HA   GLU  64           HA       GLU  64 -18.313   4.213  10.016
  522    HB2  GLU  64           HB1      GLU  64 -19.482   2.986  12.528
  523    HB3  GLU  64           HB2      GLU  64 -18.279   4.311  12.360
  524    HG2  GLU  64           HG1      GLU  64 -21.307   4.402  11.810
  525    HG3  GLU  64           HG2      GLU  64 -20.330   5.456  12.888
  526    H    SER  65           HN       SER  65 -18.222   1.942   8.473
  527    HA   SER  65           HA       SER  65 -16.803  -0.125   9.916
  528    HB2  SER  65           HB1      SER  65 -17.028   0.209   6.868
  529    HB3  SER  65           HB2      SER  65 -16.400  -1.239   7.737
  530    HG   SER  65           HG1      SER  65 -19.029  -0.185   7.656
  531    H    THR  66           HN       THR  66 -14.631  -0.422  10.159
  532    HA   THR  66           HA       THR  66 -12.782   1.425   8.775
  533    HB   THR  66           HB       THR  66 -12.277  -0.716  10.887
  534    HG1  THR  66           HG1      THR  66 -13.050   1.380  11.476
  535   HG21  THR  66          HG21      THR  66  -9.861   0.164  10.778
  536   HG22  THR  66          HG22      THR  66 -10.338  -0.776   9.341
  537   HG23  THR  66          HG23      THR  66 -10.303   1.011   9.233
  538    H    LEU  67           HN       LEU  67 -12.261   0.906   6.726
  539    HA   LEU  67           HA       LEU  67 -11.764  -1.959   6.119
  540    HB2  LEU  67           HB1      LEU  67 -11.711   0.253   4.018
  541    HB3  LEU  67           HB2      LEU  67 -11.853  -1.516   3.796
  542    HG   LEU  67           HG       LEU  67 -13.987   0.505   4.700
  543   HD11  LEU  67          HD11      LEU  67 -15.135  -0.288   2.615
  544   HD12  LEU  67          HD12      LEU  67 -13.487   0.333   2.232
  545   HD13  LEU  67          HD13      LEU  67 -13.791  -1.440   2.295
  546   HD21  LEU  67          HD21      LEU  67 -15.631  -1.328   4.799
  547   HD22  LEU  67          HD22      LEU  67 -14.358  -2.546   4.480
  548   HD23  LEU  67          HD23      LEU  67 -14.356  -1.613   6.027
  549    H    HIS  68           HN       HIS  68  -9.615  -2.306   4.928
  550    HA   HIS  68           HA       HIS  68  -7.697  -0.090   5.509
  551    HB2  HIS  68           HB1      HIS  68  -6.998  -3.044   5.175
  552    HB3  HIS  68           HB2      HIS  68  -5.889  -1.693   5.611
  553    HD2  HIS  68           HD2      HIS  68  -7.693  -4.484   7.338
  554    HE1  HIS  68           HE1      HIS  68  -7.123  -1.420  10.219
  555    HE2  HIS  68           HE2      HIS  68  -7.672  -3.889   9.857
  556    H    LEU  69           HN       LEU  69  -6.351   0.571   3.778
  557    HA   LEU  69           HA       LEU  69  -6.902  -0.744   1.173
  558    HB2  LEU  69           HB1      LEU  69  -7.730   1.634   1.300
  559    HB3  LEU  69           HB2      LEU  69  -6.071   2.166   1.680
  560    HG   LEU  69           HG       LEU  69  -5.331   1.205  -0.580
  561   HD11  LEU  69          HD11      LEU  69  -7.139   0.799  -2.270
  562   HD12  LEU  69          HD12      LEU  69  -7.212  -0.429  -0.958
  563   HD13  LEU  69          HD13      LEU  69  -8.384   0.948  -0.998
  564   HD21  LEU  69          HD21      LEU  69  -6.333   3.061  -1.926
  565   HD22  LEU  69          HD22      LEU  69  -7.558   3.340  -0.636
  566   HD23  LEU  69          HD23      LEU  69  -5.813   3.628  -0.297
  567    H    VAL  70           HN       VAL  70  -5.228  -1.831   0.305
  568    HA   VAL  70           HA       VAL  70  -2.500  -1.076   1.122
  569    HB   VAL  70           HB       VAL  70  -3.420  -3.617  -0.291
  570   HG11  VAL  70          HG11      VAL  70  -1.107  -4.396   0.438
  571   HG12  VAL  70          HG12      VAL  70  -1.009  -3.026  -0.722
  572   HG13  VAL  70          HG13      VAL  70  -0.750  -2.746   1.042
  573   HG21  VAL  70          HG21      VAL  70  -2.978  -4.702   1.960
  574   HG22  VAL  70          HG22      VAL  70  -2.832  -3.067   2.697
  575   HG23  VAL  70          HG23      VAL  70  -4.396  -3.597   1.978
  576    H    LEU  71           HN       LEU  71  -1.224  -0.058  -0.340
  577    HA   LEU  71           HA       LEU  71  -2.340   0.516  -2.952
  578    HB2  LEU  71           HB1      LEU  71   0.239   1.476  -1.616
  579    HB3  LEU  71           HB2      LEU  71  -0.470   2.130  -3.136
  580    HG   LEU  71           HG       LEU  71  -1.690   2.303  -0.308
  581   HD11  LEU  71          HD11      LEU  71  -1.226   4.746  -0.551
  582   HD12  LEU  71          HD12      LEU  71   0.293   3.791  -0.671
  583   HD13  LEU  71          HD13      LEU  71  -0.479   4.460  -2.160
  584   HD21  LEU  71          HD21      LEU  71  -3.381   3.824  -1.351
  585   HD22  LEU  71          HD22      LEU  71  -2.731   3.444  -2.987
  586   HD23  LEU  71          HD23      LEU  71  -3.518   2.156  -1.998
  587    H    ARG  72           HN       ARG  72  -1.719  -0.391  -4.836
  588    HA   ARG  72           HA       ARG  72   0.579  -1.204  -5.936
  589    HB2  ARG  72           HB1      ARG  72   0.870  -2.174  -3.507
  590    HB3  ARG  72           HB2      ARG  72  -0.143  -3.530  -4.055
  591    HG2  ARG  72           HG1      ARG  72   2.560  -2.529  -5.187
  592    HG3  ARG  72           HG2      ARG  72   2.342  -3.992  -4.190
  593    HD2  ARG  72           HD1      ARG  72   1.363  -3.606  -7.107
  594    HD3  ARG  72           HD2      ARG  72   2.824  -4.494  -6.505
  595    HE   ARG  72           HE       ARG  72  -0.033  -5.286  -5.804
  596   HH11  ARG  72          HH11      ARG  72   2.194  -7.412  -8.244
  597   HH12  ARG  72          HH12      ARG  72   2.704  -5.844  -7.827
  598   HH21  ARG  72          HH21      ARG  72   0.436  -8.381  -7.136
  599   HH22  ARG  72          HH22      ARG  72  -0.499  -7.491  -5.982
  600    H1   MET   1           HT1      MET   1  14.645 -17.848 -24.674
  601    H2   MET   1           HT2      MET   1  13.738 -17.911 -23.242
  602    H3   MET   1           HT3      MET   1  14.548 -19.292 -23.826
  603    HA   MET   1           HA       MET   1  16.646 -18.471 -23.380
  604    HB2  MET   1           HB1      MET   1  17.113 -16.208 -22.479
  605    HB3  MET   1           HB2      MET   1  16.252 -16.082 -24.041
  606    HG2  MET   1           HG1      MET   1  14.086 -15.666 -22.760
  607    HG3  MET   1           HG2      MET   1  15.000 -15.749 -21.230
  608    HE1  MET   1           HE1      MET   1  13.916 -12.124 -21.402
  609    HE2  MET   1           HE2      MET   1  13.052 -13.580 -21.998
  610    HE3  MET   1           HE3      MET   1  14.001 -13.650 -20.477
  611    H    GLN   2           HN       GLN   2  17.659 -19.097 -21.428
  612    HA   GLN   2           HA       GLN   2  15.764 -20.236 -19.690
  613    HB2  GLN   2           HB1      GLN   2  17.765 -21.301 -20.708
  614    HB3  GLN   2           HB2      GLN   2  18.814 -20.351 -19.599
  615    HG2  GLN   2           HG1      GLN   2  17.771 -21.458 -17.606
  616    HG3  GLN   2           HG2      GLN   2  16.575 -22.296 -18.661
  617   HE21  GLN   2          HE21      GLN   2  19.232 -24.450 -20.059
  618   HE22  GLN   2          HE22      GLN   2  18.011 -23.365 -20.696
  619    H    ILE   3           HN       ILE   3  14.999 -19.557 -17.771
  620    HA   ILE   3           HA       ILE   3  16.747 -17.851 -16.097
  621    HB   ILE   3           HB       ILE   3  14.847 -16.776 -15.080
  622   HG12  ILE   3          HG11      ILE   3  13.058 -18.136 -17.188
  623   HG13  ILE   3          HG12      ILE   3  13.162 -18.669 -15.484
  624   HG21  ILE   3          HG21      ILE   3  14.318 -15.272 -16.979
  625   HG22  ILE   3          HG22      ILE   3  16.034 -15.803 -17.063
  626   HG23  ILE   3          HG23      ILE   3  14.815 -16.533 -18.162
  627   HD11  ILE   3           HD1      ILE   3  11.207 -17.195 -15.721
  628   HD12  ILE   3           HD2      ILE   3  12.445 -16.379 -14.699
  629   HD13  ILE   3           HD3      ILE   3  12.219 -15.879 -16.415
  630    H    PHE   4           HN       PHE   4  16.395 -18.052 -13.782
  631    HA   PHE   4           HA       PHE   4  15.674 -20.842 -13.066
  632    HB2  PHE   4           HB1      PHE   4  17.637 -18.917 -11.665
  633    HB3  PHE   4           HB2      PHE   4  17.346 -20.646 -11.239
  634    HD1  PHE   4           HD1      PHE   4  17.533 -22.235 -13.528
  635    HD2  PHE   4           HD2      PHE   4  19.591 -18.530 -12.797
  636    HE1  PHE   4           HE1      PHE   4  19.272 -22.866 -15.179
  637    HE2  PHE   4           HE2      PHE   4  21.339 -19.181 -14.419
  638    HZ   PHE   4           HZ       PHE   4  21.168 -21.346 -15.627
  639    H    VAL   5           HN       VAL   5  13.444 -20.553 -12.481
  640    HA   VAL   5           HA       VAL   5  12.880 -18.396 -10.571
  641    HB   VAL   5           HB       VAL   5  11.033 -20.547 -11.666
  642   HG11  VAL   5          HG11      VAL   5   9.265 -18.989 -10.716
  643   HG12  VAL   5          HG12      VAL   5  10.299 -19.682  -9.428
  644   HG13  VAL   5          HG13      VAL   5  10.560 -17.983  -9.976
  645   HG21  VAL   5          HG21      VAL   5  10.107 -18.607 -13.009
  646   HG22  VAL   5          HG22      VAL   5  11.495 -17.595 -12.459
  647   HG23  VAL   5          HG23      VAL   5  11.783 -19.049 -13.485
  648    H    LYS   6           HN       LYS   6  13.832 -18.808  -8.580
  649    HA   LYS   6           HA       LYS   6  13.767 -21.563  -7.586
  650    HB2  LYS   6           HB1      LYS   6  14.938 -18.950  -6.487
  651    HB3  LYS   6           HB2      LYS   6  14.890 -20.473  -5.557
  652    HG2  LYS   6           HG1      LYS   6  16.052 -21.511  -7.755
  653    HG3  LYS   6           HG2      LYS   6  16.461 -19.815  -8.106
  654    HD2  LYS   6           HD1      LYS   6  18.317 -20.969  -6.933
  655    HD3  LYS   6           HD2      LYS   6  17.687 -19.608  -5.952
  656    HE2  LYS   6           HE1      LYS   6  18.264 -21.788  -4.667
  657    HE3  LYS   6           HE2      LYS   6  16.623 -21.100  -4.350
  658    HZ1  LYS   6           HZ1      LYS   6  16.696 -23.579  -4.807
  659    HZ2  LYS   6           HZ2      LYS   6  15.630 -22.683  -5.720
  660    HZ3  LYS   6           HZ3      LYS   6  17.052 -23.200  -6.429
  661    H    THR   7           HN       THR   7  12.794 -22.140  -5.508
  662    HA   THR   7           HA       THR   7  11.020 -20.022  -4.434
  663    HB   THR   7           HB       THR   7  10.002 -21.565  -2.914
  664    HG1  THR   7           HG1      THR   7  10.702 -23.502  -2.619
  665   HG21  THR   7          HG21      THR   7   8.719 -22.956  -4.547
  666   HG22  THR   7          HG22      THR   7   8.982 -21.291  -5.178
  667   HG23  THR   7          HG23      THR   7   9.970 -22.660  -5.811
  668    H    LEU   8           HN       LEU   8  11.377 -19.514  -2.139
  669    HA   LEU   8           HA       LEU   8  14.070 -19.560  -1.297
  670    HB2  LEU   8           HB1      LEU   8  11.519 -19.285   0.409
  671    HB3  LEU   8           HB2      LEU   8  13.178 -18.808   0.906
  672    HG   LEU   8           HG       LEU   8  11.555 -17.531  -1.388
  673   HD11  LEU   8          HD11      LEU   8  11.371 -15.585   0.142
  674   HD12  LEU   8          HD12      LEU   8  10.638 -17.045   0.904
  675   HD13  LEU   8          HD13      LEU   8  12.268 -16.469   1.424
  676   HD21  LEU   8          HD21      LEU   8  13.340 -15.762  -1.339
  677   HD22  LEU   8          HD22      LEU   8  14.286 -16.745  -0.168
  678   HD23  LEU   8          HD23      LEU   8  14.003 -17.351  -1.845
  679    H    THR   9           HN       THR   9  11.375 -21.778  -0.779
  680    HA   THR   9           HA       THR   9  12.712 -23.550   1.019
  681    HB   THR   9           HB       THR   9  10.739 -25.072   0.453
  682    HG1  THR   9           HG1      THR   9   9.070 -23.993  -0.633
  683   HG21  THR   9          HG21      THR   9   9.121 -23.615   1.670
  684   HG22  THR   9          HG22      THR   9  10.762 -23.447   2.383
  685   HG23  THR   9          HG23      THR   9  10.113 -22.155   1.311
  686    H    GLY  10           HN       GLY  10  14.595 -23.332  -0.805
  687    HA2  GLY  10           HA2      GLY  10  16.097 -24.831  -1.619
  688    HA3  GLY  10           HA1      GLY  10  14.861 -26.122  -1.504
  689    H    LYS  11           HN       LYS  11  13.002 -25.365  -3.286
  690    HA   LYS  11           HA       LYS  11  13.988 -26.653  -5.510
  691    HB2  LYS  11           HB1      LYS  11  11.600 -26.542  -4.675
  692    HB3  LYS  11           HB2      LYS  11  11.500 -24.876  -5.313
  693    HG2  LYS  11           HG1      LYS  11  11.927 -25.791  -7.655
  694    HG3  LYS  11           HG2      LYS  11  11.803 -27.453  -7.005
  695    HD2  LYS  11           HD1      LYS  11   9.666 -25.219  -6.751
  696    HD3  LYS  11           HD2      LYS  11   9.698 -26.383  -8.105
  697    HE2  LYS  11           HE1      LYS  11   9.353 -27.252  -5.148
  698    HE3  LYS  11           HE2      LYS  11   7.993 -26.889  -6.289
  699    HZ1  LYS  11           HZ1      LYS  11   8.463 -29.236  -6.322
  700    HZ2  LYS  11           HZ2      LYS  11   8.839 -28.529  -7.804
  701    HZ3  LYS  11           HZ3      LYS  11  10.089 -28.962  -6.763
  702    H    THR  12           HN       THR  12  14.605 -26.149  -7.656
  703    HA   THR  12           HA       THR  12  14.579 -23.299  -8.447
  704    HB   THR  12           HB       THR  12  16.576 -25.405  -9.421
  705    HG1  THR  12           HG1      THR  12  18.070 -24.088  -8.471
  706   HG21  THR  12          HG21      THR  12  17.612 -23.361 -10.557
  707   HG22  THR  12          HG22      THR  12  15.975 -23.702 -11.176
  708   HG23  THR  12          HG23      THR  12  16.220 -22.364  -9.996
  709    H    ILE  13           HN       ILE  13  12.980 -23.022  -9.963
  710    HA   ILE  13           HA       ILE  13  12.265 -25.296 -11.662
  711    HB   ILE  13           HB       ILE  13  10.917 -22.572 -11.504
  712   HG12  ILE  13          HG11      ILE  13  10.158 -25.048  -9.863
  713   HG13  ILE  13          HG12      ILE  13  10.958 -23.583  -9.192
  714   HG21  ILE  13          HG21      ILE  13   9.024 -23.848 -12.522
  715   HG22  ILE  13          HG22      ILE  13  10.497 -24.099 -13.509
  716   HG23  ILE  13          HG23      ILE  13   9.945 -25.387 -12.374
  717   HD11  ILE  13           HD1      ILE  13   8.540 -23.421  -8.761
  718   HD12  ILE  13           HD2      ILE  13   9.047 -22.143  -9.925
  719   HD13  ILE  13           HD3      ILE  13   8.174 -23.603 -10.512
  720    H    THR  14           HN       THR  14  13.961 -25.327 -13.195
  721    HA   THR  14           HA       THR  14  14.888 -22.877 -14.391
  722    HB   THR  14           HB       THR  14  15.411 -25.753 -15.264
  723    HG1  THR  14           HG1      THR  14  17.389 -25.285 -14.169
  724   HG21  THR  14          HG21      THR  14  17.491 -24.640 -16.267
  725   HG22  THR  14          HG22      THR  14  15.982 -24.045 -17.024
  726   HG23  THR  14          HG23      THR  14  16.828 -23.034 -15.798
  727    H    LEU  15           HN       LEU  15  13.806 -21.778 -15.958
  728    HA   LEU  15           HA       LEU  15  11.993 -23.336 -17.731
  729    HB2  LEU  15           HB1      LEU  15  11.642 -20.514 -16.579
  730    HB3  LEU  15           HB2      LEU  15  10.546 -21.268 -17.788
  731    HG   LEU  15           HG       LEU  15  11.020 -22.304 -14.930
  732   HD11  LEU  15          HD11      LEU  15   8.764 -21.401 -14.457
  733   HD12  LEU  15          HD12      LEU  15   9.865 -20.082 -14.998
  734   HD13  LEU  15          HD13      LEU  15   8.632 -20.754 -16.132
  735   HD21  LEU  15          HD21      LEU  15   8.949 -23.687 -15.393
  736   HD22  LEU  15          HD22      LEU  15   8.982 -23.149 -17.107
  737   HD23  LEU  15          HD23      LEU  15  10.329 -24.156 -16.447
  738    H    GLU  16           HN       GLU  16  12.125 -23.005 -19.899
  739    HA   GLU  16           HA       GLU  16  13.817 -20.864 -20.952
  740    HB2  GLU  16           HB1      GLU  16  12.598 -23.390 -21.996
  741    HB3  GLU  16           HB2      GLU  16  12.490 -22.020 -23.132
  742    HG2  GLU  16           HG1      GLU  16  15.164 -22.955 -21.877
  743    HG3  GLU  16           HG2      GLU  16  14.539 -23.429 -23.502
  744    H    VAL  17           HN       VAL  17  12.903 -18.883 -20.743
  745    HA   VAL  17           HA       VAL  17  10.000 -18.608 -21.232
  746    HB   VAL  17           HB       VAL  17  10.155 -16.467 -20.019
  747   HG11  VAL  17          HG11      VAL  17  10.270 -17.504 -17.788
  748   HG12  VAL  17          HG12      VAL  17   9.439 -18.610 -18.938
  749   HG13  VAL  17          HG13      VAL  17  11.148 -18.934 -18.449
  750   HG21  VAL  17          HG21      VAL  17  12.197 -15.984 -18.671
  751   HG22  VAL  17          HG22      VAL  17  13.034 -17.409 -19.347
  752   HG23  VAL  17          HG23      VAL  17  12.621 -16.009 -20.414
  753    H    GLU  18           HN       GLU  18   9.290 -16.536 -22.125
  754    HA   GLU  18           HA       GLU  18  10.708 -16.045 -24.626
  755    HB2  GLU  18           HB1      GLU  18   7.989 -15.215 -23.467
  756    HB3  GLU  18           HB2      GLU  18   8.506 -14.884 -25.159
  757    HG2  GLU  18           HG1      GLU  18   8.327 -17.205 -25.789
  758    HG3  GLU  18           HG2      GLU  18   8.192 -17.750 -24.073
  759    HA   PRO  19           HA       PRO  19  11.332 -11.726 -23.193
  760    HB2  PRO  19           HB2      PRO  19  11.399 -10.293 -25.567
  761    HB3  PRO  19           HB1      PRO  19  12.720 -11.450 -25.138
  762    HG2  PRO  19           HG2      PRO  19  10.266 -12.004 -26.916
  763    HG3  PRO  19           HG1      PRO  19  12.009 -12.292 -27.319
  764    HD2  PRO  19           HD2      PRO  19  10.339 -14.271 -26.299
  765    HD3  PRO  19           HD1      PRO  19  12.106 -14.202 -25.843
  766    H    SER  20           HN       SER  20   8.579 -12.892 -25.025
  767    HA   SER  20           HA       SER  20   6.922 -10.592 -24.609
  768    HB2  SER  20           HB1      SER  20   5.214 -12.518 -25.587
  769    HB3  SER  20           HB2      SER  20   6.306 -11.534 -26.611
  770    HG   SER  20           HG1      SER  20   6.480 -14.260 -25.958
  771    H    ASP  21           HN       ASP  21   7.745 -13.352 -22.699
  772    HA   ASP  21           HA       ASP  21   5.369 -14.015 -21.512
  773    HB2  ASP  21           HB1      ASP  21   8.318 -14.144 -20.807
  774    HB3  ASP  21           HB2      ASP  21   7.210 -14.257 -19.400
  775    H    THR  22           HN       THR  22   3.853 -12.860 -20.446
  776    HA   THR  22           HA       THR  22   4.632 -10.755 -18.583
  777    HB   THR  22           HB       THR  22   2.223 -10.643 -17.969
  778    HG1  THR  22           HG1      THR  22   0.793 -11.793 -19.244
  779   HG21  THR  22          HG21      THR  22   1.472  -9.656 -20.140
  780   HG22  THR  22          HG22      THR  22   3.185  -9.218 -19.806
  781   HG23  THR  22          HG23      THR  22   2.803 -10.502 -21.013
  782    H    ILE  23           HN       ILE  23   3.569 -11.064 -16.215
  783    HA   ILE  23           HA       ILE  23   5.073 -13.299 -15.343
  784    HB   ILE  23           HB       ILE  23   3.314 -11.500 -13.662
  785   HG12  ILE  23          HG11      ILE  23   4.789 -10.051 -14.921
  786   HG13  ILE  23          HG12      ILE  23   5.462 -10.243 -13.285
  787   HG21  ILE  23          HG21      ILE  23   5.026 -12.179 -11.897
  788   HG22  ILE  23          HG22      ILE  23   4.064 -13.576 -12.488
  789   HG23  ILE  23          HG23      ILE  23   5.752 -13.343 -13.065
  790   HD11  ILE  23           HD1      ILE  23   7.301 -10.334 -14.955
  791   HD12  ILE  23           HD2      ILE  23   7.135 -11.964 -14.215
  792   HD13  ILE  23           HD3      ILE  23   6.496 -11.635 -15.869
  793    H    GLU  24           HN       GLU  24   1.454 -12.804 -15.246
  794    HA   GLU  24           HA       GLU  24   0.890 -15.313 -14.327
  795    HB2  GLU  24           HB1      GLU  24  -0.626 -13.503 -16.240
  796    HB3  GLU  24           HB2      GLU  24  -1.308 -15.050 -15.625
  797    HG2  GLU  24           HG1      GLU  24  -2.137 -13.127 -14.288
  798    HG3  GLU  24           HG2      GLU  24  -1.158 -14.238 -13.260
  799    H    ASN  25           HN       ASN  25   2.085 -14.555 -17.563
  800    HA   ASN  25           HA       ASN  25   1.341 -17.086 -18.698
  801    HB2  ASN  25           HB1      ASN  25   1.914 -14.809 -19.897
  802    HB3  ASN  25           HB2      ASN  25   3.634 -15.282 -19.679
  803   HD21  ASN  25          HD21      ASN  25   3.375 -16.976 -22.768
  804   HD22  ASN  25          HD22      ASN  25   4.387 -16.240 -21.540
  805    H    VAL  26           HN       VAL  26   4.344 -15.761 -17.191
  806    HA   VAL  26           HA       VAL  26   5.777 -18.192 -17.159
  807    HB   VAL  26           HB       VAL  26   5.918 -15.862 -15.191
  808   HG11  VAL  26          HG11      VAL  26   8.263 -16.752 -14.782
  809   HG12  VAL  26          HG12      VAL  26   7.010 -17.914 -14.231
  810   HG13  VAL  26          HG13      VAL  26   7.880 -18.196 -15.788
  811   HG21  VAL  26          HG21      VAL  26   7.878 -15.185 -16.630
  812   HG22  VAL  26          HG22      VAL  26   7.507 -16.531 -17.772
  813   HG23  VAL  26          HG23      VAL  26   6.348 -15.175 -17.566
  814    H    LYS  27           HN       LYS  27   3.515 -16.819 -14.690
  815    HA   LYS  27           HA       LYS  27   3.595 -18.954 -12.898
  816    HB2  LYS  27           HB1      LYS  27   1.203 -17.190 -13.637
  817    HB3  LYS  27           HB2      LYS  27   1.258 -18.295 -12.233
  818    HG2  LYS  27           HG1      LYS  27   3.148 -17.055 -11.241
  819    HG3  LYS  27           HG2      LYS  27   3.115 -15.857 -12.571
  820    HD2  LYS  27           HD1      LYS  27   0.759 -15.216 -11.981
  821    HD3  LYS  27           HD2      LYS  27   0.725 -16.541 -10.775
  822    HE2  LYS  27           HE1      LYS  27   1.141 -14.841  -9.338
  823    HE3  LYS  27           HE2      LYS  27   2.854 -15.214  -9.747
  824    HZ1  LYS  27           HZ1      LYS  27   1.342 -13.170 -11.302
  825    H    ALA  28           HN       ALA  28   1.590 -18.689 -15.897
  826    HA   ALA  28           HA       ALA  28   0.236 -21.130 -15.554
  827    HB1  ALA  28           HB1      ALA  28  -0.442 -19.324 -17.162
  828    HB2  ALA  28           HB2      ALA  28   1.030 -19.653 -18.138
  829    HB3  ALA  28           HB3      ALA  28  -0.249 -20.913 -17.996
  830    H    LYS  29           HN       LYS  29   3.406 -20.434 -17.096
  831    HA   LYS  29           HA       LYS  29   3.932 -23.139 -17.827
  832    HB2  LYS  29           HB1      LYS  29   5.730 -20.704 -17.367
  833    HB3  LYS  29           HB2      LYS  29   6.327 -22.267 -18.035
  834    HG2  LYS  29           HG1      LYS  29   4.959 -22.081 -20.016
  835    HG3  LYS  29           HG2      LYS  29   3.976 -20.751 -19.325
  836    HD2  LYS  29           HD1      LYS  29   5.922 -19.217 -19.340
  837    HD3  LYS  29           HD2      LYS  29   6.949 -20.498 -20.087
  838    HE2  LYS  29           HE1      LYS  29   5.478 -20.520 -22.116
  839    HE3  LYS  29           HE2      LYS  29   4.341 -19.352 -21.327
  840    HZ1  LYS  29           HZ1      LYS  29   5.903 -18.264 -22.887
  841    HZ2  LYS  29           HZ2      LYS  29   6.052 -17.689 -21.308
  842    HZ3  LYS  29           HZ3      LYS  29   7.205 -18.710 -21.906
  843    H    ILE  30           HN       ILE  30   4.514 -21.337 -14.790
  844    HA   ILE  30           HA       ILE  30   5.823 -23.537 -13.492
  845    HB   ILE  30           HB       ILE  30   4.397 -21.077 -12.424
  846   HG12  ILE  30          HG11      ILE  30   7.397 -21.783 -12.507
  847   HG13  ILE  30          HG12      ILE  30   6.577 -20.854 -13.800
  848   HG21  ILE  30          HG21      ILE  30   5.537 -21.638 -10.223
  849   HG22  ILE  30          HG22      ILE  30   4.283 -22.831 -10.659
  850   HG23  ILE  30          HG23      ILE  30   6.022 -23.238 -10.903
  851   HD11  ILE  30           HD1      ILE  30   7.670 -19.276 -12.266
  852   HD12  ILE  30           HD2      ILE  30   5.881 -19.101 -12.131
  853   HD13  ILE  30           HD3      ILE  30   6.796 -19.967 -10.851
  854    H    GLN  31           HN       GLN  31   2.377 -22.615 -13.836
  855    HA   GLN  31           HA       GLN  31   1.311 -24.627 -12.204
  856    HB2  GLN  31           HB1      GLN  31   0.043 -22.660 -13.144
  857    HB3  GLN  31           HB2      GLN  31   0.099 -23.451 -14.751
  858    HG2  GLN  31           HG1      GLN  31  -1.147 -25.488 -13.650
  859    HG3  GLN  31           HG2      GLN  31  -1.351 -24.452 -12.199
  860   HE21  GLN  31          HE21      GLN  31  -3.373 -23.548 -15.697
  861   HE22  GLN  31          HE22      GLN  31  -1.851 -24.414 -15.778
  862    H    ASP  32           HN       ASP  32   2.002 -24.720 -15.740
  863    HA   ASP  32           HA       ASP  32   1.420 -27.381 -16.294
  864    HB2  ASP  32           HB1      ASP  32   1.904 -25.565 -17.954
  865    HB3  ASP  32           HB2      ASP  32   3.571 -25.398 -17.309
  866    H    LYS  33           HN       LYS  33   4.673 -26.054 -15.631
  867    HA   LYS  33           HA       LYS  33   5.879 -28.508 -15.384
  868    HB2  LYS  33           HB1      LYS  33   6.998 -26.425 -16.001
  869    HB3  LYS  33           HB2      LYS  33   6.627 -25.718 -14.407
  870    HG2  LYS  33           HG1      LYS  33   8.933 -26.157 -14.480
  871    HG3  LYS  33           HG2      LYS  33   8.238 -27.288 -13.301
  872    HD2  LYS  33           HD1      LYS  33   9.021 -27.980 -16.219
  873    HD3  LYS  33           HD2      LYS  33  10.125 -28.125 -14.814
  874    HE2  LYS  33           HE1      LYS  33   7.630 -29.833 -15.403
  875    HE3  LYS  33           HE2      LYS  33   9.356 -30.342 -15.290
  876    HZ1  LYS  33           HZ1      LYS  33   7.384 -29.797 -13.238
  877    HZ2  LYS  33           HZ2      LYS  33   8.671 -30.886 -13.183
  878    HZ3  LYS  33           HZ3      LYS  33   8.881 -29.239 -12.801
  879    H    GLU  34           HN       GLU  34   4.921 -26.409 -12.531
  880    HA   GLU  34           HA       GLU  34   5.704 -28.714 -10.813
  881    HB2  GLU  34           HB1      GLU  34   5.704 -25.727 -10.187
  882    HB3  GLU  34           HB2      GLU  34   6.110 -27.037  -9.023
  883    HG2  GLU  34           HG1      GLU  34   7.708 -26.325 -11.573
  884    HG3  GLU  34           HG2      GLU  34   8.143 -25.933  -9.885
  885    H    GLY  35           HN       GLY  35   2.864 -27.318 -11.956
  886    HA2  GLY  35           HA2      GLY  35   0.786 -27.895 -11.335
  887    HA3  GLY  35           HA1      GLY  35   1.441 -28.696  -9.879
  888    H    ILE  36           HN       ILE  36   2.080 -25.283 -10.334
  889    HA   ILE  36           HA       ILE  36   0.394 -24.799  -7.969
  890    HB   ILE  36           HB       ILE  36   2.515 -22.949  -9.071
  891   HG12  ILE  36          HG11      ILE  36   2.797 -25.167  -6.944
  892   HG13  ILE  36          HG12      ILE  36   3.531 -25.192  -8.577
  893   HG21  ILE  36          HG21      ILE  36   2.370 -22.048  -6.716
  894   HG22  ILE  36          HG22      ILE  36   0.763 -21.975  -7.494
  895   HG23  ILE  36          HG23      ILE  36   1.127 -23.282  -6.304
  896   HD11  ILE  36           HD1      ILE  36   5.250 -24.499  -6.997
  897   HD12  ILE  36           HD2      ILE  36   4.828 -23.091  -8.041
  898   HD13  ILE  36           HD3      ILE  36   4.217 -23.178  -6.345
  899    HA   PRO  37           HA       PRO  37  -2.166 -22.548 -10.930
  900    HB2  PRO  37           HB2      PRO  37  -3.663 -21.887  -8.306
  901    HB3  PRO  37           HB1      PRO  37  -4.402 -22.267  -9.921
  902    HG2  PRO  37           HG1      PRO  37  -4.264 -24.224  -8.057
  903    HG3  PRO  37           HG2      PRO  37  -3.688 -24.607  -9.740
  904    HD2  PRO  37           HD2      PRO  37  -1.997 -23.836  -7.288
  905    HD3  PRO  37           HD1      PRO  37  -1.747 -25.186  -8.490
  906    HA   PRO  38           HA       PRO  38  -0.745 -18.586 -11.037
  907    HB2  PRO  38           HB2      PRO  38  -3.554 -17.417 -11.448
  908    HB3  PRO  38           HB1      PRO  38  -2.032 -17.022 -12.351
  909    HG2  PRO  38           HG1      PRO  38  -3.774 -18.828 -13.417
  910    HG3  PRO  38           HG2      PRO  38  -2.007 -19.234 -13.381
  911    HD2  PRO  38           HD2      PRO  38  -4.203 -20.219 -11.474
  912    HD3  PRO  38           HD1      PRO  38  -2.820 -21.113 -12.250
  913    H    ASP  39           HN       ASP  39  -3.710 -17.210  -9.317
  914    HA   ASP  39           HA       ASP  39  -1.904 -15.431  -8.062
  915    HB2  ASP  39           HB1      ASP  39  -4.398 -15.051  -8.844
  916    HB3  ASP  39           HB2      ASP  39  -4.835 -15.703  -7.214
  917    H    GLN  40           HN       GLN  40  -1.931 -18.488  -7.289
  918    HA   GLN  40           HA       GLN  40  -1.725 -18.150  -4.375
  919    HB2  GLN  40           HB1      GLN  40  -1.060 -20.487  -6.269
  920    HB3  GLN  40           HB2      GLN  40  -0.789 -20.503  -4.487
  921    HG2  GLN  40           HG1      GLN  40  -3.284 -20.170  -4.115
  922    HG3  GLN  40           HG2      GLN  40  -3.540 -20.187  -5.893
  923   HE21  GLN  40          HE21      GLN  40  -2.312 -23.766  -4.239
  924   HE22  GLN  40          HE22      GLN  40  -1.530 -22.287  -3.705
  925    H    GLN  41           HN       GLN  41   0.166 -17.799  -7.301
  926    HA   GLN  41           HA       GLN  41   2.735 -18.092  -5.961
  927    HB2  GLN  41           HB1      GLN  41   1.868 -17.436  -8.838
  928    HB3  GLN  41           HB2      GLN  41   3.573 -17.628  -8.338
  929    HG2  GLN  41           HG1      GLN  41   3.111 -20.047  -7.737
  930    HG3  GLN  41           HG2      GLN  41   1.394 -19.829  -8.253
  931   HE21  GLN  41          HE21      GLN  41   2.276 -20.674 -11.563
  932   HE22  GLN  41          HE22      GLN  41   1.189 -20.884 -10.229
  933    H    ARG  42           HN       ARG  42   4.132 -16.386  -5.490
  934    HA   ARG  42           HA       ARG  42   3.537 -13.788  -6.772
  935    HB2  ARG  42           HB1      ARG  42   4.475 -14.246  -3.886
  936    HB3  ARG  42           HB2      ARG  42   4.372 -12.640  -4.675
  937    HG2  ARG  42           HG1      ARG  42   2.039 -14.546  -4.060
  938    HG3  ARG  42           HG2      ARG  42   2.470 -13.077  -3.124
  939    HD2  ARG  42           HD1      ARG  42   1.815 -11.597  -5.004
  940    HD3  ARG  42           HD2      ARG  42   1.564 -13.025  -6.094
  941    HE   ARG  42           HE       ARG  42   0.111 -13.462  -3.627
  942   HH11  ARG  42          HH11      ARG  42  -1.847 -12.507  -6.899
  943   HH12  ARG  42          HH12      ARG  42  -0.209 -11.944  -6.779
  944   HH21  ARG  42          HH21      ARG  42  -2.829 -13.525  -5.213
  945   HH22  ARG  42          HH22      ARG  42  -1.843 -14.122  -3.943
  946    H    LEU  43           HN       LEU  43   5.125 -13.431  -8.198
  947    HA   LEU  43           HA       LEU  43   7.777 -14.518  -7.718
  948    HB2  LEU  43           HB1      LEU  43   6.515 -12.923  -9.997
  949    HB3  LEU  43           HB2      LEU  43   8.282 -13.222  -9.935
  950    HG   LEU  43           HG       LEU  43   7.260 -14.764 -11.446
  951   HD11  LEU  43          HD11      LEU  43   8.142 -16.895 -10.609
  952   HD12  LEU  43          HD12      LEU  43   9.233 -15.549 -10.106
  953   HD13  LEU  43          HD13      LEU  43   8.110 -16.309  -8.912
  954   HD21  LEU  43          HD21      LEU  43   5.651 -16.518 -10.842
  955   HD22  LEU  43          HD22      LEU  43   5.550 -15.917  -9.154
  956   HD23  LEU  43          HD23      LEU  43   4.954 -14.892 -10.512
  957    H    ILE  44           HN       ILE  44   9.449 -13.588  -6.800
  958    HA   ILE  44           HA       ILE  44   9.619 -10.667  -6.515
  959    HB   ILE  44           HB       ILE  44  11.158 -12.959  -5.213
  960   HG12  ILE  44          HG11      ILE  44   8.759 -12.746  -4.435
  961   HG13  ILE  44          HG12      ILE  44  10.016 -12.608  -3.176
  962   HG21  ILE  44          HG21      ILE  44  12.056 -11.124  -3.659
  963   HG22  ILE  44          HG22      ILE  44  12.671 -11.022  -5.336
  964   HG23  ILE  44          HG23      ILE  44  11.370  -9.901  -4.787
  965   HD11  ILE  44           HD1      ILE  44   8.068 -10.898  -3.029
  966   HD12  ILE  44           HD2      ILE  44   9.730 -10.204  -2.965
  967   HD13  ILE  44           HD3      ILE  44   8.778 -10.115  -4.483
  968    H    PHE  45           HN       PHE  45  11.128  -9.561  -7.724
  969    HA   PHE  45           HA       PHE  45  13.434 -11.107  -8.765
  970    HB2  PHE  45           HB1      PHE  45  12.008 -10.150 -10.643
  971    HB3  PHE  45           HB2      PHE  45  12.270  -8.511  -9.947
  972    HD1  PHE  45           HD1      PHE  45  14.945 -11.231 -10.266
  973    HD2  PHE  45           HD2      PHE  45  13.282  -7.581 -11.852
  974    HE1  PHE  45           HE1      PHE  45  16.851 -11.018 -11.793
  975    HE2  PHE  45           HE2      PHE  45  15.208  -7.387 -13.383
  976    HZ   PHE  45           HZ       PHE  45  16.986  -9.108 -13.371
  977    H    ALA  46           HN       ALA  46  15.298 -10.589  -7.768
  978    HA   ALA  46           HA       ALA  46  16.658  -9.791  -6.253
  979    HB1  ALA  46           HB1      ALA  46  16.952  -7.951  -7.855
  980    HB2  ALA  46           HB2      ALA  46  15.605  -7.038  -7.107
  981    HB3  ALA  46           HB3      ALA  46  17.121  -7.343  -6.170
  982    H    GLY  47           HN       GLY  47  14.399  -7.212  -5.455
  983    HA2  GLY  47           HA2      GLY  47  13.412  -8.698  -3.109
  984    HA3  GLY  47           HA1      GLY  47  14.191  -7.096  -2.856
  985    H    LYS  48           HN       LYS  48  12.451  -7.365  -5.847
  986    HA   LYS  48           HA       LYS  48  10.226  -5.834  -4.615
  987    HB2  LYS  48           HB1      LYS  48  11.610  -4.630  -6.391
  988    HB3  LYS  48           HB2      LYS  48  11.131  -5.914  -7.544
  989    HG2  LYS  48           HG1      LYS  48   8.656  -5.277  -6.926
  990    HG3  LYS  48           HG2      LYS  48   9.334  -3.824  -6.141
  991    HD2  LYS  48           HD1      LYS  48  10.252  -3.055  -8.297
  992    HD3  LYS  48           HD2      LYS  48   9.823  -4.597  -9.106
  993    HE2  LYS  48           HE1      LYS  48   7.739  -2.661  -7.862
  994    HE3  LYS  48           HE2      LYS  48   8.223  -2.641  -9.604
  995    HZ1  LYS  48           HZ1      LYS  48   6.179  -3.883  -9.069
  996    HZ2  LYS  48           HZ2      LYS  48   7.287  -4.763  -9.923
  997    HZ3  LYS  48           HZ3      LYS  48   7.059  -5.065  -8.252
  998    H    GLN  49           HN       GLN  49   8.171  -6.765  -4.677
  999    HA   GLN  49           HA       GLN  49   7.824  -9.211  -6.204
 1000    HB2  GLN  49           HB1      GLN  49   6.867  -8.567  -3.845
 1001    HB3  GLN  49           HB2      GLN  49   5.523  -7.841  -4.768
 1002    HG2  GLN  49           HG1      GLN  49   6.490 -10.770  -5.266
 1003    HG3  GLN  49           HG2      GLN  49   5.446 -10.363  -3.872
 1004   HE21  GLN  49          HE21      GLN  49   3.690 -10.726  -7.490
 1005   HE22  GLN  49          HE22      GLN  49   5.388 -11.085  -7.281
 1006    H    LEU  50           HN       LEU  50   6.585  -9.473  -8.034
 1007    HA   LEU  50           HA       LEU  50   6.636  -7.125  -9.692
 1008    HB2  LEU  50           HB1      LEU  50   6.317 -10.108 -10.097
 1009    HB3  LEU  50           HB2      LEU  50   5.943  -8.982 -11.434
 1010    HG   LEU  50           HG       LEU  50   8.173  -8.076 -11.490
 1011   HD11  LEU  50          HD11      LEU  50  10.068  -8.984 -10.174
 1012   HD12  LEU  50          HD12      LEU  50   8.916  -8.110  -9.120
 1013   HD13  LEU  50          HD13      LEU  50   8.932  -9.915  -9.137
 1014   HD21  LEU  50          HD21      LEU  50   9.445 -10.128 -12.162
 1015   HD22  LEU  50          HD22      LEU  50   8.213 -11.160 -11.341
 1016   HD23  LEU  50          HD23      LEU  50   7.751 -10.139 -12.751
 1017    H    GLU  51           HN       GLU  51   5.013  -6.307 -11.049
 1018    HA   GLU  51           HA       GLU  51   2.252  -6.693 -10.253
 1019    HB2  GLU  51           HB1      GLU  51   3.501  -5.127 -12.595
 1020    HB3  GLU  51           HB2      GLU  51   1.781  -5.095 -12.110
 1021    HG2  GLU  51           HG1      GLU  51   2.754  -3.014 -11.430
 1022    HG3  GLU  51           HG2      GLU  51   2.439  -3.956  -9.935
 1023    H    ASP  52           HN       ASP  52   0.725  -7.223 -12.136
 1024    HA   ASP  52           HA       ASP  52   1.379  -9.778 -13.071
 1025    HB2  ASP  52           HB1      ASP  52  -1.059  -9.542 -13.874
 1026    HB3  ASP  52           HB2      ASP  52  -0.752  -9.325 -12.127
 1027    H    GLY  53           HN       GLY  53  -0.343  -7.561 -15.194
 1028    HA2  GLY  53           HA2      GLY  53   0.754  -8.787 -17.497
 1029    HA3  GLY  53           HA1      GLY  53  -0.326  -7.355 -17.429
 1030    H    ARG  54           HN       ARG  54   2.948  -7.730 -16.241
 1031    HA   ARG  54           HA       ARG  54   3.991  -5.790 -18.230
 1032    HB2  ARG  54           HB1      ARG  54   4.882  -6.391 -15.349
 1033    HB3  ARG  54           HB2      ARG  54   5.842  -5.418 -16.514
 1034    HG2  ARG  54           HG1      ARG  54   3.916  -3.780 -16.689
 1035    HG3  ARG  54           HG2      ARG  54   3.024  -4.733 -15.455
 1036    HD2  ARG  54           HD1      ARG  54   4.078  -2.797 -14.348
 1037    HD3  ARG  54           HD2      ARG  54   4.953  -4.300 -13.814
 1038    HE   ARG  54           HE       ARG  54   6.189  -3.200 -16.244
 1039   HH11  ARG  54          HH11      ARG  54   7.458  -1.722 -12.767
 1040   HH12  ARG  54          HH12      ARG  54   6.144  -2.869 -12.690
 1041   HH21  ARG  54          HH21      ARG  54   8.771  -1.664 -14.690
 1042   HH22  ARG  54          HH22      ARG  54   8.063  -2.142 -16.164
 1043    H    THR  55           HN       THR  55   6.094  -6.441 -19.166
 1044    HA   THR  55           HA       THR  55   6.166  -9.351 -19.292
 1045    HB   THR  55           HB       THR  55   7.637  -9.088 -21.261
 1046    HG1  THR  55           HG1      THR  55   8.177  -7.111 -21.939
 1047   HG21  THR  55          HG21      THR  55   5.880  -8.145 -22.743
 1048   HG22  THR  55          HG22      THR  55   5.149  -9.217 -21.495
 1049   HG23  THR  55          HG23      THR  55   5.032  -7.422 -21.329
 1050    H    LEU  56           HN       LEU  56   8.189 -10.573 -19.371
 1051    HA   LEU  56           HA       LEU  56  10.143  -9.880 -17.473
 1052    HB2  LEU  56           HB1      LEU  56  10.417 -11.695 -19.941
 1053    HB3  LEU  56           HB2      LEU  56  11.557 -11.652 -18.558
 1054    HG   LEU  56           HG       LEU  56   8.618 -12.564 -18.506
 1055   HD11  LEU  56          HD11      LEU  56   9.645 -14.787 -18.016
 1056   HD12  LEU  56          HD12      LEU  56  10.280 -14.121 -19.563
 1057   HD13  LEU  56          HD13      LEU  56  11.290 -14.049 -18.074
 1058   HD21  LEU  56          HD21      LEU  56   9.037 -13.253 -16.138
 1059   HD22  LEU  56          HD22      LEU  56  10.645 -12.444 -16.181
 1060   HD23  LEU  56          HD23      LEU  56   9.133 -11.470 -16.322
 1061    H    SER  57           HN       SER  57   9.920  -8.935 -20.868
 1062    HA   SER  57           HA       SER  57  12.543  -7.832 -21.045
 1063    HB2  SER  57           HB1      SER  57  11.460  -6.468 -23.006
 1064    HB3  SER  57           HB2      SER  57  11.669  -8.245 -23.155
 1065    HG   SER  57           HG1      SER  57   9.601  -8.524 -23.208
 1066    H    ASP  58           HN       ASP  58   9.370  -6.290 -20.174
 1067    HA   ASP  58           HA       ASP  58  10.256  -3.715 -19.685
 1068    HB2  ASP  58           HB1      ASP  58   7.897  -4.546 -19.855
 1069    HB3  ASP  58           HB2      ASP  58   8.118  -5.503 -18.356
 1070    H    TYR  59           HN       TYR  59  10.094  -6.439 -17.310
 1071    HA   TYR  59           HA       TYR  59  11.438  -4.954 -15.279
 1072    HB2  TYR  59           HB1      TYR  59  11.059  -7.986 -15.691
 1073    HB3  TYR  59           HB2      TYR  59  11.696  -7.262 -14.163
 1074    HD1  TYR  59           HD1      TYR  59  10.177  -5.171 -13.311
 1075    HD2  TYR  59           HD2      TYR  59   8.829  -8.549 -15.595
 1076    HE1  TYR  59           HE1      TYR  59   7.875  -4.903 -12.381
 1077    HE2  TYR  59           HE2      TYR  59   6.543  -8.246 -14.703
 1078    HH   TYR  59           HH       TYR  59   5.269  -7.202 -13.191
 1079    H    ASN  60           HN       ASN  60  12.867  -6.158 -18.076
 1080    HA   ASN  60           HA       ASN  60  14.822  -6.876 -18.721
 1081    HB2  ASN  60           HB1      ASN  60  15.456  -4.613 -17.863
 1082    HB3  ASN  60           HB2      ASN  60  15.984  -5.373 -16.320
 1083   HD21  ASN  60          HD21      ASN  60  19.167  -6.043 -17.682
 1084   HD22  ASN  60          HD22      ASN  60  18.158  -5.785 -16.278
 1085    H    ILE  61           HN       ILE  61  13.438  -8.817 -17.453
 1086    HA   ILE  61           HA       ILE  61  15.376 -10.418 -15.913
 1087    HB   ILE  61           HB       ILE  61  12.473 -10.895 -16.692
 1088   HG12  ILE  61          HG11      ILE  61  13.729 -10.452 -13.915
 1089   HG13  ILE  61          HG12      ILE  61  13.044  -9.122 -14.883
 1090   HG21  ILE  61          HG21      ILE  61  12.625 -12.926 -15.204
 1091   HG22  ILE  61          HG22      ILE  61  13.785 -13.080 -16.555
 1092   HG23  ILE  61          HG23      ILE  61  14.366 -12.594 -14.918
 1093   HD11  ILE  61           HD1      ILE  61  11.380  -9.906 -13.234
 1094   HD12  ILE  61           HD2      ILE  61  10.795 -10.244 -14.903
 1095   HD13  ILE  61           HD3      ILE  61  11.449 -11.582 -13.892
 1096    H    GLN  62           HN       GLN  62  16.931 -10.630 -17.528
 1097    HA   GLN  62           HA       GLN  62  16.145 -11.992 -20.014
 1098    HB2  GLN  62           HB1      GLN  62  18.859 -10.814 -19.216
 1099    HB3  GLN  62           HB2      GLN  62  18.410 -11.495 -20.824
 1100    HG2  GLN  62           HG1      GLN  62  16.563  -9.699 -20.976
 1101    HG3  GLN  62           HG2      GLN  62  17.299  -8.923 -19.527
 1102   HE21  GLN  62          HE21      GLN  62  19.335  -7.143 -21.821
 1103   HE22  GLN  62          HE22      GLN  62  18.152  -7.057 -20.531
 1104    H    LYS  63           HN       LYS  63  18.680 -13.325 -20.478
 1105    HA   LYS  63           HA       LYS  63  18.035 -15.769 -19.224
 1106    HB2  LYS  63           HB1      LYS  63  19.924 -16.713 -20.441
 1107    HB3  LYS  63           HB2      LYS  63  18.969 -15.628 -21.512
 1108    HG2  LYS  63           HG1      LYS  63  20.718 -13.794 -21.122
 1109    HG3  LYS  63           HG2      LYS  63  21.609 -14.951 -20.088
 1110    HD2  LYS  63           HD1      LYS  63  21.498 -16.563 -22.202
 1111    HD3  LYS  63           HD2      LYS  63  21.123 -15.066 -23.120
 1112    HE2  LYS  63           HE1      LYS  63  23.528 -15.489 -23.282
 1113    HE3  LYS  63           HE2      LYS  63  23.333 -14.062 -22.178
 1114    HZ1  LYS  63           HZ1      LYS  63  24.845 -16.078 -21.418
 1115    HZ2  LYS  63           HZ2      LYS  63  23.765 -15.429 -20.294
 1116    HZ3  LYS  63           HZ3      LYS  63  23.347 -16.773 -20.984
 1117    H    GLU  64           HN       GLU  64  19.251 -17.123 -17.885
 1118    HA   GLU  64           HA       GLU  64  20.233 -17.690 -16.055
 1119    HB2  GLU  64           HB1      GLU  64  22.269 -15.469 -16.498
 1120    HB3  GLU  64           HB2      GLU  64  22.363 -16.744 -15.248
 1121    HG2  GLU  64           HG1      GLU  64  23.693 -17.745 -16.812
 1122    HG3  GLU  64           HG2      GLU  64  22.120 -18.443 -17.342
 1123    H    SER  65           HN       SER  65  18.413 -15.008 -16.126
 1124    HA   SER  65           HA       SER  65  18.842 -13.833 -13.639
 1125    HB2  SER  65           HB1      SER  65  16.158 -14.119 -15.102
 1126    HB3  SER  65           HB2      SER  65  16.460 -13.032 -13.691
 1127    HG   SER  65           HG1      SER  65  17.417 -12.880 -16.328
 1128    H    THR  66           HN       THR  66  18.573 -14.467 -11.600
 1129    HA   THR  66           HA       THR  66  16.911 -16.812 -11.019
 1130    HB   THR  66           HB       THR  66  18.706 -15.202  -9.167
 1131    HG1  THR  66           HG1      THR  66  19.652 -16.628 -10.793
 1132   HG21  THR  66          HG21      THR  66  18.307 -17.205  -7.632
 1133   HG22  THR  66          HG22      THR  66  16.806 -16.248  -7.875
 1134   HG23  THR  66          HG23      THR  66  17.040 -17.792  -8.771
 1135    H    LEU  67           HN       LEU  67  14.808 -16.544 -10.678
 1136    HA   LEU  67           HA       LEU  67  13.868 -14.072  -9.327
 1137    HB2  LEU  67           HB1      LEU  67  12.171 -16.234 -10.700
 1138    HB3  LEU  67           HB2      LEU  67  11.592 -14.688  -9.992
 1139    HG   LEU  67           HG       LEU  67  13.320 -15.067 -12.509
 1140   HD11  LEU  67          HD11      LEU  67  11.349 -14.055 -13.658
 1141   HD12  LEU  67          HD12      LEU  67  10.861 -15.540 -12.765
 1142   HD13  LEU  67          HD13      LEU  67  10.477 -13.916 -12.087
 1143   HD21  LEU  67          HD21      LEU  67  13.129 -12.571 -12.787
 1144   HD22  LEU  67          HD22      LEU  67  12.412 -12.449 -11.139
 1145   HD23  LEU  67          HD23      LEU  67  14.112 -13.023 -11.363
 1146    H    HIS  68           HN       HIS  68  12.350 -14.383  -7.518
 1147    HA   HIS  68           HA       HIS  68  12.614 -17.071  -6.258
 1148    HB2  HIS  68           HB1      HIS  68  12.627 -14.358  -4.866
 1149    HB3  HIS  68           HB2      HIS  68  12.455 -15.943  -4.028
 1150    HD2  HIS  68           HD2      HIS  68  15.253 -13.667  -5.542
 1151    HE1  HIS  68           HE1      HIS  68  16.950 -17.317  -4.199
 1152    HE2  HIS  68           HE2      HIS  68  17.438 -14.944  -5.014
 1153    H    LEU  69           HN       LEU  69  10.770 -18.094  -6.300
 1154    HA   LEU  69           HA       LEU  69   8.211 -16.704  -6.365
 1155    HB2  LEU  69           HB1      LEU  69   8.633 -18.524  -7.972
 1156    HB3  LEU  69           HB2      LEU  69   9.165 -19.608  -6.656
 1157    HG   LEU  69           HG       LEU  69   6.832 -19.634  -5.723
 1158   HD11  LEU  69          HD11      LEU  69   4.962 -18.759  -7.041
 1159   HD12  LEU  69          HD12      LEU  69   6.045 -17.395  -6.617
 1160   HD13  LEU  69          HD13      LEU  69   6.073 -18.082  -8.287
 1161   HD21  LEU  69          HD21      LEU  69   5.840 -21.032  -7.538
 1162   HD22  LEU  69          HD22      LEU  69   7.053 -20.399  -8.704
 1163   HD23  LEU  69          HD23      LEU  69   7.593 -21.404  -7.310
 1164    H    VAL  70           HN       VAL  70   7.021 -16.359  -4.581
 1165    HA   VAL  70           HA       VAL  70   7.218 -18.335  -2.394
 1166    HB   VAL  70           HB       VAL  70   6.682 -16.686  -0.725
 1167   HG11  VAL  70          HG11      VAL  70   8.821 -15.413  -0.758
 1168   HG12  VAL  70          HG12      VAL  70   9.102 -17.091  -1.350
 1169   HG13  VAL  70          HG13      VAL  70   9.025 -15.714  -2.510
 1170   HG21  VAL  70          HG21      VAL  70   6.603 -14.241  -1.290
 1171   HG22  VAL  70          HG22      VAL  70   6.727 -14.623  -3.043
 1172   HG23  VAL  70          HG23      VAL  70   5.273 -15.125  -2.094
 1173    H    LEU  71           HN       LEU  71   4.984 -18.278  -1.099
 1174    HA   LEU  71           HA       LEU  71   2.856 -18.090  -3.130
 1175    HB2  LEU  71           HB1      LEU  71   3.124 -20.201  -0.923
 1176    HB3  LEU  71           HB2      LEU  71   1.804 -20.080  -2.137
 1177    HG   LEU  71           HG       LEU  71   4.761 -20.702  -2.751
 1178   HD11  LEU  71          HD11      LEU  71   3.933 -23.008  -3.235
 1179   HD12  LEU  71          HD12      LEU  71   3.601 -22.547  -1.521
 1180   HD13  LEU  71          HD13      LEU  71   2.270 -22.527  -2.738
 1181   HD21  LEU  71          HD21      LEU  71   3.905 -21.322  -5.039
 1182   HD22  LEU  71          HD22      LEU  71   2.278 -20.676  -4.593
 1183   HD23  LEU  71          HD23      LEU  71   3.698 -19.576  -4.686
 1184    H    ARG  72           HN       ARG  72   1.260 -16.695  -2.595
 1185    HA   ARG  72           HA       ARG  72  -0.062 -16.812  -0.219
 1186    HB2  ARG  72           HB1      ARG  72   1.580 -15.694   1.045
 1187    HB3  ARG  72           HB2      ARG  72   1.988 -14.594  -0.306
 1188    HG2  ARG  72           HG1      ARG  72   0.830 -13.582   1.757
 1189    HG3  ARG  72           HG2      ARG  72   0.275 -13.121   0.117
 1190    HD2  ARG  72           HD1      ARG  72  -1.586 -13.322   1.781
 1191    HD3  ARG  72           HD2      ARG  72  -1.825 -14.330   0.335
 1192    HE   ARG  72           HE       ARG  72  -0.967 -15.321   3.096
 1193   HH11  ARG  72          HH11      ARG  72  -2.958 -17.632   0.536
 1194   HH12  ARG  72          HH12      ARG  72  -2.256 -16.222  -0.102
 1195   HH21  ARG  72          HH21      ARG  72  -2.718 -18.155   2.767
 1196   HH22  ARG  72          HH22      ARG  72  -1.811 -17.053   3.787
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1 -24.863   7.082   4.308
    2    H2   MET   1           HT2      MET   1 -23.499   6.405   3.552
    3    H3   MET   1           HT3      MET   1 -23.456   7.973   4.146
    4    HA   MET   1           HA       MET   1 -23.512   7.339   6.379
    5    HB2  MET   1           HB1      MET   1 -23.615   4.976   7.137
    6    HB3  MET   1           HB2      MET   1 -25.063   5.352   6.153
    7    HG2  MET   1           HG1      MET   1 -23.905   4.247   4.146
    8    HG3  MET   1           HG2      MET   1 -22.547   3.813   5.217
    9    HE1  MET   1           HE1      MET   1 -24.070   0.451   4.343
   10    HE2  MET   1           HE2      MET   1 -23.927   1.932   3.345
   11    HE3  MET   1           HE3      MET   1 -22.608   1.488   4.474
   12    H    GLN   2           HN       GLN   2 -21.386   6.722   7.631
   13    HA   GLN   2           HA       GLN   2 -19.396   7.214   5.605
   14    HB2  GLN   2           HB1      GLN   2 -19.620   8.743   7.415
   15    HB3  GLN   2           HB2      GLN   2 -19.507   7.421   8.607
   16    HG2  GLN   2           HG1      GLN   2 -17.094   7.053   8.061
   17    HG3  GLN   2           HG2      GLN   2 -17.189   8.260   6.720
   18   HE21  GLN   2          HE21      GLN   2 -17.666   9.775  10.550
   19   HE22  GLN   2          HE22      GLN   2 -18.408   8.242  10.152
   20    H    ILE   3           HN       ILE   3 -17.597   6.015   5.144
   21    HA   ILE   3           HA       ILE   3 -16.943   3.846   7.035
   22    HB   ILE   3           HB       ILE   3 -15.870   2.485   5.299
   23   HG12  ILE   3          HG11      ILE   3 -17.396   4.278   3.309
   24   HG13  ILE   3          HG12      ILE   3 -15.623   4.355   3.579
   25   HG21  ILE   3          HG21      ILE   3 -18.002   1.450   4.539
   26   HG22  ILE   3          HG22      ILE   3 -18.185   2.042   6.230
   27   HG23  ILE   3          HG23      ILE   3 -18.892   2.975   4.880
   28   HD11  ILE   3           HD1      ILE   3 -16.130   2.978   1.571
   29   HD12  ILE   3           HD2      ILE   3 -15.384   1.965   2.861
   30   HD13  ILE   3           HD3      ILE   3 -17.159   1.875   2.544
   31    H    PHE   4           HN       PHE   4 -14.777   3.483   7.420
   32    HA   PHE   4           HA       PHE   4 -13.036   5.815   6.849
   33    HB2  PHE   4           HB1      PHE   4 -13.024   3.759   9.171
   34    HB3  PHE   4           HB2      PHE   4 -11.805   5.074   8.942
   35    HD1  PHE   4           HD1      PHE   4 -12.321   7.347   9.509
   36    HD2  PHE   4           HD2      PHE   4 -15.346   4.304   9.810
   37    HE1  PHE   4           HE1      PHE   4 -13.709   8.856  10.907
   38    HE2  PHE   4           HE2      PHE   4 -16.739   5.836  11.180
   39    HZ   PHE   4           HZ       PHE   4 -15.904   8.077  11.758
   40    H    VAL   5           HN       VAL   5 -12.111   4.985   4.851
   41    HA   VAL   5           HA       VAL   5 -10.955   2.300   4.960
   42    HB   VAL   5           HB       VAL   5 -10.752   4.389   2.768
   43   HG11  VAL   5          HG11      VAL   5 -10.205   2.388   1.371
   44   HG12  VAL   5          HG12      VAL   5  -8.999   2.622   2.674
   45   HG13  VAL   5          HG13      VAL   5 -10.249   1.331   2.830
   46   HG21  VAL   5          HG21      VAL   5 -12.586   2.992   1.681
   47   HG22  VAL   5          HG22      VAL   5 -12.819   2.150   3.257
   48   HG23  VAL   5          HG23      VAL   5 -13.136   3.917   3.116
   49    H    LYS   6           HN       LYS   6  -8.959   1.973   5.911
   50    HA   LYS   6           HA       LYS   6  -7.277   4.366   6.262
   51    HB2  LYS   6           HB1      LYS   6  -7.367   1.685   7.683
   52    HB3  LYS   6           HB2      LYS   6  -6.160   2.979   8.026
   53    HG2  LYS   6           HG1      LYS   6  -7.957   4.604   8.542
   54    HG3  LYS   6           HG2      LYS   6  -9.216   3.407   8.092
   55    HD2  LYS   6           HD1      LYS   6  -8.460   1.924   9.953
   56    HD3  LYS   6           HD2      LYS   6  -7.324   3.200  10.513
   57    HE2  LYS   6           HE1      LYS   6  -9.103   4.747  11.062
   58    HE3  LYS   6           HE2      LYS   6 -10.302   3.867  10.034
   59    HZ1  LYS   6           HZ1      LYS   6 -10.442   3.588  12.534
   60    HZ2  LYS   6           HZ2      LYS   6 -10.581   2.224  11.551
   61    HZ3  LYS   6           HZ3      LYS   6  -9.117   2.530  12.382
   62    H    THR   7           HN       THR   7  -5.903   4.792   4.661
   63    HA   THR   7           HA       THR   7  -4.590   2.676   3.236
   64    HB   THR   7           HB       THR   7  -4.065   5.668   3.177
   65    HG1  THR   7           HG1      THR   7  -5.501   5.720   1.601
   66   HG21  THR   7          HG21      THR   7  -3.133   5.087   0.879
   67   HG22  THR   7          HG22      THR   7  -2.184   4.283   2.175
   68   HG23  THR   7          HG23      THR   7  -3.400   3.340   1.227
   69    H    LEU   8           HN       LEU   8  -3.256   1.534   4.375
   70    HA   LEU   8           HA       LEU   8  -1.648   0.888   5.771
   71    HB2  LEU   8           HB1      LEU   8  -0.184   2.576   3.682
   72    HB3  LEU   8           HB2      LEU   8   0.559   1.240   4.630
   73    HG   LEU   8           HG       LEU   8  -1.785   0.988   2.643
   74   HD11  LEU   8          HD11      LEU   8  -0.111  -0.307   1.281
   75   HD12  LEU   8          HD12      LEU   8   0.295   1.437   1.492
   76   HD13  LEU   8          HD13      LEU   8   1.175   0.182   2.445
   77   HD21  LEU   8          HD21      LEU   8  -1.276  -1.545   2.940
   78   HD22  LEU   8          HD22      LEU   8  -0.402  -1.097   4.447
   79   HD23  LEU   8          HD23      LEU   8  -2.155  -0.739   4.281
   80    H    THR   9           HN       THR   9  -0.026   4.067   5.240
   81    HA   THR   9           HA       THR   9   1.053   3.843   7.900
   82    HB   THR   9           HB       THR   9   2.254   5.997   7.260
   83    HG1  THR   9           HG1      THR   9   2.194   6.510   5.118
   84   HG21  THR   9          HG21      THR   9   3.761   4.795   5.669
   85   HG22  THR   9          HG22      THR   9   3.259   3.706   7.013
   86   HG23  THR   9          HG23      THR   9   2.504   3.538   5.384
   87    H    GLY  10           HN       GLY  10  -1.879   5.031   6.877
   88    HA2  GLY  10           HA2      GLY  10  -3.055   5.608   8.997
   89    HA3  GLY  10           HA1      GLY  10  -1.920   6.989   9.147
   90    H    LYS  11           HN       LYS  11  -2.554   6.813   5.943
   91    HA   LYS  11           HA       LYS  11  -4.154   9.169   6.045
   92    HB2  LYS  11           HB1      LYS  11  -2.437   8.886   4.349
   93    HB3  LYS  11           HB2      LYS  11  -3.203   7.392   3.759
   94    HG2  LYS  11           HG1      LYS  11  -3.561   9.203   2.196
   95    HG3  LYS  11           HG2      LYS  11  -5.138   8.681   2.842
   96    HD2  LYS  11           HD1      LYS  11  -5.539  10.712   3.914
   97    HD3  LYS  11           HD2      LYS  11  -3.808  10.960   4.327
   98    HE2  LYS  11           HE1      LYS  11  -4.583  12.711   2.744
   99    HE3  LYS  11           HE2      LYS  11  -3.266  11.691   2.036
  100    HZ1  LYS  11           HZ1      LYS  11  -5.055  12.020   0.404
  101    HZ2  LYS  11           HZ2      LYS  11  -5.042  10.401   0.871
  102    HZ3  LYS  11           HZ3      LYS  11  -6.201  11.321   1.423
  103    H    THR  12           HN       THR  12  -6.119   8.939   6.928
  104    HA   THR  12           HA       THR  12  -7.752   6.625   6.270
  105    HB   THR  12           HB       THR  12  -8.272   8.867   8.264
  106    HG1  THR  12           HG1      THR  12  -6.488   7.429   8.705
  107   HG21  THR  12          HG21      THR  12  -9.920   7.155   9.188
  108   HG22  THR  12          HG22      THR  12 -10.413   7.747   7.566
  109   HG23  THR  12          HG23      THR  12  -9.639   6.126   7.732
  110    H    ILE  13           HN       ILE  13  -8.973   6.613   4.534
  111    HA   ILE  13           HA       ILE  13  -9.993   9.051   3.400
  112    HB   ILE  13           HB       ILE  13 -10.789   6.322   2.391
  113   HG12  ILE  13          HG11      ILE  13  -8.075   7.572   1.727
  114   HG13  ILE  13          HG12      ILE  13  -8.256   6.201   2.856
  115   HG21  ILE  13          HG21      ILE  13 -10.753   7.587   0.246
  116   HG22  ILE  13          HG22      ILE  13 -11.734   8.478   1.455
  117   HG23  ILE  13          HG23      ILE  13 -10.052   9.019   1.068
  118   HD11  ILE  13           HD1      ILE  13  -7.686   5.392   0.584
  119   HD12  ILE  13           HD2      ILE  13  -9.273   4.764   1.141
  120   HD13  ILE  13           HD3      ILE  13  -9.209   6.091  -0.063
  121    H    THR  14           HN       THR  14 -11.573   9.825   4.908
  122    HA   THR  14           HA       THR  14 -13.818   8.190   5.625
  123    HB   THR  14           HB       THR  14 -14.956  10.347   6.240
  124    HG1  THR  14           HG1      THR  14 -13.561  12.082   6.409
  125   HG21  THR  14          HG21      THR  14 -13.464  10.685   8.199
  126   HG22  THR  14          HG22      THR  14 -13.611   8.945   7.813
  127   HG23  THR  14          HG23      THR  14 -12.106   9.836   7.361
  128    H    LEU  15           HN       LEU  15 -15.325   7.413   4.246
  129    HA   LEU  15           HA       LEU  15 -16.021   9.093   1.880
  130    HB2  LEU  15           HB1      LEU  15 -16.141   6.052   2.219
  131    HB3  LEU  15           HB2      LEU  15 -16.605   6.951   0.741
  132    HG   LEU  15           HG       LEU  15 -13.763   6.894   1.935
  133   HD11  LEU  15          HD11      LEU  15 -13.230   5.220   0.264
  134   HD12  LEU  15          HD12      LEU  15 -14.637   4.629   1.205
  135   HD13  LEU  15          HD13      LEU  15 -14.885   5.304  -0.453
  136   HD21  LEU  15          HD21      LEU  15 -13.129   7.697  -0.395
  137   HD22  LEU  15          HD22      LEU  15 -14.864   7.843  -0.803
  138   HD23  LEU  15          HD23      LEU  15 -14.156   8.891   0.476
  139    H    GLU  16           HN       GLU  16 -18.184   9.544   1.537
  140    HA   GLU  16           HA       GLU  16 -20.168   8.378   3.343
  141    HB2  GLU  16           HB1      GLU  16 -19.971  10.812   1.680
  142    HB3  GLU  16           HB2      GLU  16 -21.434   9.887   1.243
  143    HG2  GLU  16           HG1      GLU  16 -20.756  10.824   4.114
  144    HG3  GLU  16           HG2      GLU  16 -21.946  11.577   2.985
  145    H    VAL  17           HN       VAL  17 -20.836   6.358   2.831
  146    HA   VAL  17           HA       VAL  17 -20.996   5.636  -0.030
  147    HB   VAL  17           HB       VAL  17 -20.887   3.289   0.599
  148   HG11  VAL  17          HG11      VAL  17 -18.439   3.312   0.946
  149   HG12  VAL  17          HG12      VAL  17 -18.928   4.613  -0.197
  150   HG13  VAL  17          HG13      VAL  17 -18.497   5.030   1.505
  151   HG21  VAL  17          HG21      VAL  17 -20.093   2.623   2.847
  152   HG22  VAL  17          HG22      VAL  17 -20.091   4.329   3.407
  153   HG23  VAL  17          HG23      VAL  17 -21.651   3.507   3.012
  154    H    GLU  18           HN       GLU  18 -22.649   4.394  -0.762
  155    HA   GLU  18           HA       GLU  18 -25.164   5.449   0.111
  156    HB2  GLU  18           HB1      GLU  18 -24.424   3.408  -2.062
  157    HB3  GLU  18           HB2      GLU  18 -25.971   4.310  -1.995
  158    HG2  GLU  18           HG1      GLU  18 -24.916   6.373  -2.685
  159    HG3  GLU  18           HG2      GLU  18 -23.260   5.738  -2.359
  160    HA   PRO  19           HA       PRO  19 -26.598   1.403   1.742
  161    HB2  PRO  19           HB2      PRO  19 -29.327   1.437   1.233
  162    HB3  PRO  19           HB1      PRO  19 -28.589   2.553   2.448
  163    HG2  PRO  19           HG2      PRO  19 -29.215   3.169  -0.504
  164    HG3  PRO  19           HG1      PRO  19 -29.730   4.118   0.951
  165    HD2  PRO  19           HD2      PRO  19 -27.477   4.760  -0.523
  166    HD3  PRO  19           HD1      PRO  19 -27.476   4.945   1.292
  167    H    SER  20           HN       SER  20 -26.799   2.410  -1.577
  168    HA   SER  20           HA       SER  20 -27.378  -0.223  -2.635
  169    HB2  SER  20           HB1      SER  20 -27.016   1.308  -4.855
  170    HB3  SER  20           HB2      SER  20 -28.519   1.391  -3.884
  171    HG   SER  20           HG1      SER  20 -26.432   3.308  -4.062
  172    H    ASP  21           HN       ASP  21 -24.597   1.158  -1.423
  173    HA   ASP  21           HA       ASP  21 -23.096   1.442  -3.682
  174    HB2  ASP  21           HB1      ASP  21 -22.854   2.113  -0.983
  175    HB3  ASP  21           HB2      ASP  21 -21.505   0.965  -1.177
  176    H    THR  22           HN       THR  22 -21.119   0.634  -4.359
  177    HA   THR  22           HA       THR  22 -20.758  -2.261  -4.082
  178    HB   THR  22           HB       THR  22 -20.475  -2.631  -6.487
  179    HG1  THR  22           HG1      THR  22 -20.184  -0.953  -7.583
  180   HG21  THR  22          HG21      THR  22 -22.857  -2.524  -7.109
  181   HG22  THR  22          HG22      THR  22 -22.742  -2.971  -5.361
  182   HG23  THR  22          HG23      THR  22 -23.193  -1.296  -5.840
  183    H    ILE  23           HN       ILE  23 -18.619  -2.969  -5.161
  184    HA   ILE  23           HA       ILE  23 -16.820  -1.352  -3.592
  185    HB   ILE  23           HB       ILE  23 -16.651  -4.056  -4.888
  186   HG12  ILE  23          HG11      ILE  23 -18.134  -3.635  -2.860
  187   HG13  ILE  23          HG12      ILE  23 -16.920  -4.906  -2.704
  188   HG21  ILE  23          HG21      ILE  23 -14.470  -4.361  -3.612
  189   HG22  ILE  23          HG22      ILE  23 -14.342  -3.210  -4.977
  190   HG23  ILE  23          HG23      ILE  23 -14.439  -2.581  -3.290
  191   HD11  ILE  23           HD1      ILE  23 -17.142  -3.437  -0.648
  192   HD12  ILE  23           HD2      ILE  23 -15.463  -3.442  -1.304
  193   HD13  ILE  23           HD3      ILE  23 -16.547  -2.031  -1.591
  194    H    GLU  24           HN       GLU  24 -17.139  -1.879  -7.119
  195    HA   GLU  24           HA       GLU  24 -14.690  -0.455  -7.625
  196    HB2  GLU  24           HB1      GLU  24 -15.144  -0.658  -9.934
  197    HB3  GLU  24           HB2      GLU  24 -15.517  -2.231  -9.163
  198    HG2  GLU  24           HG1      GLU  24 -17.616  -0.136 -10.100
  199    HG3  GLU  24           HG2      GLU  24 -17.154  -1.653 -10.946
  200    H    ASN  25           HN       ASN  25 -18.135   0.280  -7.382
  201    HA   ASN  25           HA       ASN  25 -18.030   3.051  -7.892
  202    HB2  ASN  25           HB1      ASN  25 -20.103   1.638  -7.652
  203    HB3  ASN  25           HB2      ASN  25 -19.810   1.540  -5.884
  204   HD21  ASN  25          HD21      ASN  25 -22.357   4.071  -6.078
  205   HD22  ASN  25          HD22      ASN  25 -22.181   2.376  -6.365
  206    H    VAL  26           HN       VAL  26 -17.680   1.444  -4.613
  207    HA   VAL  26           HA       VAL  26 -16.684   3.721  -3.342
  208    HB   VAL  26           HB       VAL  26 -16.292   0.775  -2.790
  209   HG11  VAL  26          HG11      VAL  26 -15.431   1.501  -0.507
  210   HG12  VAL  26          HG12      VAL  26 -14.259   1.874  -1.817
  211   HG13  VAL  26          HG13      VAL  26 -15.284   3.188  -1.121
  212   HG21  VAL  26          HG21      VAL  26 -17.819   1.508  -0.833
  213   HG22  VAL  26          HG22      VAL  26 -17.910   3.135  -1.582
  214   HG23  VAL  26          HG23      VAL  26 -18.569   1.716  -2.455
  215    H    LYS  27           HN       LYS  27 -14.722   1.347  -5.257
  216    HA   LYS  27           HA       LYS  27 -12.300   2.715  -4.837
  217    HB2  LYS  27           HB1      LYS  27 -13.215   1.144  -7.300
  218    HB3  LYS  27           HB2      LYS  27 -11.563   1.810  -7.084
  219    HG2  LYS  27           HG1      LYS  27 -11.326   0.471  -4.942
  220    HG3  LYS  27           HG2      LYS  27 -12.871  -0.341  -5.323
  221    HD2  LYS  27           HD1      LYS  27 -11.913  -1.052  -7.565
  222    HD3  LYS  27           HD2      LYS  27 -10.352  -0.290  -7.091
  223    HE2  LYS  27           HE1      LYS  27 -10.211  -1.909  -5.118
  224    HE3  LYS  27           HE2      LYS  27 -11.742  -2.680  -5.713
  225    HZ1  LYS  27           HZ1      LYS  27 -10.029  -3.924  -6.674
  226    HZ2  LYS  27           HZ2      LYS  27 -10.575  -2.960  -7.886
  227    HZ3  LYS  27           HZ3      LYS  27  -9.113  -2.535  -7.150
  228    H    ALA  28           HN       ALA  28 -14.879   3.469  -7.263
  229    HA   ALA  28           HA       ALA  28 -13.502   5.642  -8.416
  230    HB1  ALA  28           HB1      ALA  28 -15.511   4.525  -9.419
  231    HB2  ALA  28           HB2      ALA  28 -16.530   5.215  -8.112
  232    HB3  ALA  28           HB3      ALA  28 -15.720   6.314  -9.285
  233    H    LYS  29           HN       LYS  29 -15.704   5.553  -5.569
  234    HA   LYS  29           HA       LYS  29 -15.523   8.297  -4.933
  235    HB2  LYS  29           HB1      LYS  29 -15.974   5.876  -3.097
  236    HB3  LYS  29           HB2      LYS  29 -16.248   7.590  -2.635
  237    HG2  LYS  29           HG1      LYS  29 -18.009   7.810  -4.383
  238    HG3  LYS  29           HG2      LYS  29 -17.806   6.089  -4.841
  239    HD2  LYS  29           HD1      LYS  29 -18.477   5.377  -2.509
  240    HD3  LYS  29           HD2      LYS  29 -18.570   7.101  -2.032
  241    HE2  LYS  29           HE1      LYS  29 -20.822   6.516  -2.324
  242    HE3  LYS  29           HE2      LYS  29 -20.423   7.376  -3.862
  243    HZ1  LYS  29           HZ1      LYS  29 -21.679   5.384  -4.294
  244    HZ2  LYS  29           HZ2      LYS  29 -20.126   5.090  -4.873
  245    HZ3  LYS  29           HZ3      LYS  29 -20.660   4.425  -3.392
  246    H    ILE  30           HN       ILE  30 -13.147   5.747  -4.364
  247    HA   ILE  30           HA       ILE  30 -11.476   7.490  -2.715
  248    HB   ILE  30           HB       ILE  30 -11.096   4.724  -3.922
  249   HG12  ILE  30          HG11      ILE  30 -11.327   5.711  -1.014
  250   HG13  ILE  30          HG12      ILE  30 -12.681   5.036  -1.974
  251   HG21  ILE  30          HG21      ILE  30  -8.940   4.644  -2.557
  252   HG22  ILE  30          HG22      ILE  30  -8.847   5.819  -3.898
  253   HG23  ILE  30          HG23      ILE  30  -9.125   6.403  -2.218
  254   HD11  ILE  30           HD1      ILE  30 -11.769   3.288  -0.487
  255   HD12  ILE  30           HD2      ILE  30 -11.469   2.855  -2.208
  256   HD13  ILE  30           HD3      ILE  30 -10.124   3.485  -1.189
  257    H    GLN  31           HN       GLN  31 -11.623   6.439  -6.122
  258    HA   GLN  31           HA       GLN  31  -9.218   7.605  -6.976
  259    HB2  GLN  31           HB1      GLN  31 -10.626   5.835  -8.142
  260    HB3  GLN  31           HB2      GLN  31 -11.775   7.143  -8.584
  261    HG2  GLN  31           HG1      GLN  31  -9.790   8.292  -9.841
  262    HG3  GLN  31           HG2      GLN  31  -8.801   6.844  -9.454
  263   HE21  GLN  31          HE21      GLN  31 -11.924   6.530 -12.153
  264   HE22  GLN  31          HE22      GLN  31 -12.000   7.733 -10.876
  265    H    ASP  32           HN       ASP  32 -12.325   9.073  -6.356
  266    HA   ASP  32           HA       ASP  32 -11.827  11.699  -7.281
  267    HB2  ASP  32           HB1      ASP  32 -14.047  10.745  -6.633
  268    HB3  ASP  32           HB2      ASP  32 -13.430  10.357  -4.996
  269    H    LYS  33           HN       LYS  33 -12.230  11.792  -3.985
  270    HA   LYS  33           HA       LYS  33 -10.537  13.283  -2.913
  271    HB2  LYS  33           HB1      LYS  33 -12.334  11.986  -1.882
  272    HB3  LYS  33           HB2      LYS  33 -11.316  10.520  -1.833
  273    HG2  LYS  33           HG1      LYS  33  -9.895  11.437  -0.090
  274    HG3  LYS  33           HG2      LYS  33 -10.500  13.109  -0.380
  275    HD2  LYS  33           HD1      LYS  33 -12.765  12.490   0.349
  276    HD3  LYS  33           HD2      LYS  33 -12.276  10.779   0.602
  277    HE2  LYS  33           HE1      LYS  33 -10.843  11.352   2.505
  278    HE3  LYS  33           HE2      LYS  33 -10.980  13.127   2.157
  279    HZ1  LYS  33           HZ1      LYS  33 -12.523  12.244   3.965
  280    HZ2  LYS  33           HZ2      LYS  33 -13.293  13.051   2.674
  281    HZ3  LYS  33           HZ3      LYS  33 -13.314  11.375   2.791
  282    H    GLU  34           HN       GLU  34  -9.237   9.982  -3.560
  283    HA   GLU  34           HA       GLU  34  -6.639  10.877  -2.445
  284    HB2  GLU  34           HB1      GLU  34  -7.713   8.074  -3.004
  285    HB3  GLU  34           HB2      GLU  34  -6.124   8.454  -2.257
  286    HG2  GLU  34           HG1      GLU  34  -8.857   9.201  -0.979
  287    HG3  GLU  34           HG2      GLU  34  -7.933   7.693  -0.667
  288    H    GLY  35           HN       GLY  35  -8.210  10.161  -5.461
  289    HA2  GLY  35           HA2      GLY  35  -7.411  10.182  -7.556
  290    HA3  GLY  35           HA1      GLY  35  -5.796  10.576  -6.901
  291    H    ILE  36           HN       ILE  36  -7.105   7.590  -5.801
  292    HA   ILE  36           HA       ILE  36  -4.861   6.314  -7.113
  293    HB   ILE  36           HB       ILE  36  -6.755   5.111  -5.083
  294   HG12  ILE  36          HG11      ILE  36  -4.021   6.414  -4.538
  295   HG13  ILE  36          HG12      ILE  36  -5.556   7.294  -4.319
  296   HG21  ILE  36          HG21      ILE  36  -4.800   3.550  -4.699
  297   HG22  ILE  36          HG22      ILE  36  -5.310   3.460  -6.413
  298   HG23  ILE  36          HG23      ILE  36  -3.850   4.412  -5.959
  299   HD11  ILE  36           HD1      ILE  36  -4.816   6.358  -2.160
  300   HD12  ILE  36           HD2      ILE  36  -6.375   5.625  -2.672
  301   HD13  ILE  36           HD3      ILE  36  -4.847   4.690  -2.838
  302    HA   PRO  37           HA       PRO  37  -7.855   4.455  -9.946
  303    HB2  PRO  37           HB2      PRO  37  -6.137   3.086 -11.714
  304    HB3  PRO  37           HB1      PRO  37  -6.359   4.878 -11.696
  305    HG2  PRO  37           HG2      PRO  37  -4.190   3.252 -10.255
  306    HG3  PRO  37           HG1      PRO  37  -3.954   4.656 -11.373
  307    HD2  PRO  37           HD2      PRO  37  -4.002   4.997  -8.646
  308    HD3  PRO  37           HD1      PRO  37  -4.853   6.205  -9.718
  309    HA   PRO  38           HA       PRO  38  -8.975   0.840  -8.314
  310    HB2  PRO  38           HB2      PRO  38  -9.431  -0.532 -11.040
  311    HB3  PRO  38           HB1      PRO  38 -10.587  -0.448  -9.657
  312    HG2  PRO  38           HG1      PRO  38 -10.883   1.301 -11.708
  313    HG3  PRO  38           HG2      PRO  38 -10.915   1.960 -10.020
  314    HD2  PRO  38           HD2      PRO  38  -8.553   1.942 -11.991
  315    HD3  PRO  38           HD1      PRO  38  -9.195   3.290 -10.954
  316    H    ASP  39           HN       ASP  39  -6.502  -0.243 -10.661
  317    HA   ASP  39           HA       ASP  39  -6.212  -2.823  -9.452
  318    HB2  ASP  39           HB1      ASP  39  -5.491  -2.331 -11.829
  319    HB3  ASP  39           HB2      ASP  39  -4.242  -1.195 -11.199
  320    H    GLN  40           HN       GLN  40  -4.701   0.345  -9.070
  321    HA   GLN  40           HA       GLN  40  -2.719  -0.435  -7.222
  322    HB2  GLN  40           HB1      GLN  40  -3.943   2.225  -8.091
  323    HB3  GLN  40           HB2      GLN  40  -2.686   2.163  -6.813
  324    HG2  GLN  40           HG1      GLN  40  -1.779   2.703  -9.129
  325    HG3  GLN  40           HG2      GLN  40  -0.997   1.306  -8.318
  326   HE21  GLN  40          HE21      GLN  40  -1.913  -1.028 -10.783
  327   HE22  GLN  40          HE22      GLN  40  -0.989  -0.649  -9.371
  328    H    GLN  41           HN       GLN  41  -6.090   0.378  -6.839
  329    HA   GLN  41           HA       GLN  41  -5.919   0.407  -3.946
  330    HB2  GLN  41           HB1      GLN  41  -8.293   0.254  -5.889
  331    HB3  GLN  41           HB2      GLN  41  -8.443   0.360  -4.099
  332    HG2  GLN  41           HG1      GLN  41  -7.211   2.600  -4.170
  333    HG3  GLN  41           HG2      GLN  41  -7.249   2.513  -5.975
  334   HE21  GLN  41          HE21      GLN  41 -10.465   3.989  -5.913
  335   HE22  GLN  41          HE22      GLN  41  -8.848   4.033  -6.548
  336    H    ARG  42           HN       ARG  42  -5.229  -1.607  -3.066
  337    HA   ARG  42           HA       ARG  42  -7.111  -3.847  -3.616
  338    HB2  ARG  42           HB1      ARG  42  -4.409  -3.944  -2.201
  339    HB3  ARG  42           HB2      ARG  42  -5.453  -5.343  -2.628
  340    HG2  ARG  42           HG1      ARG  42  -3.954  -3.442  -4.563
  341    HG3  ARG  42           HG2      ARG  42  -3.463  -5.094  -4.071
  342    HD2  ARG  42           HD1      ARG  42  -5.675  -5.932  -5.223
  343    HD3  ARG  42           HD2      ARG  42  -5.801  -4.240  -5.905
  344    HE   ARG  42           HE       ARG  42  -3.099  -5.190  -6.229
  345   HH11  ARG  42          HH11      ARG  42  -5.329  -5.180  -9.377
  346   HH12  ARG  42          HH12      ARG  42  -6.202  -5.177  -7.870
  347   HH21  ARG  42          HH21      ARG  42  -3.414  -5.166  -9.545
  348   HH22  ARG  42          HH22      ARG  42  -2.265  -5.197  -8.265
  349    H    LEU  43           HN       LEU  43  -8.851  -3.491  -2.236
  350    HA   LEU  43           HA       LEU  43  -8.403  -2.395   0.402
  351    HB2  LEU  43           HB1      LEU  43 -10.842  -3.422  -1.116
  352    HB3  LEU  43           HB2      LEU  43 -10.952  -2.816   0.571
  353    HG   LEU  43           HG       LEU  43  -9.782  -1.062  -1.647
  354   HD11  LEU  43          HD11      LEU  43 -12.052  -0.115  -2.016
  355   HD12  LEU  43          HD12      LEU  43 -12.008  -1.854  -2.476
  356   HD13  LEU  43          HD13      LEU  43 -12.772  -1.351  -0.922
  357   HD21  LEU  43          HD21      LEU  43 -10.624   0.749  -0.146
  358   HD22  LEU  43          HD22      LEU  43 -11.300  -0.472   0.990
  359   HD23  LEU  43          HD23      LEU  43  -9.518  -0.347   0.761
  360    H    ILE  44           HN       ILE  44  -8.852  -3.423   2.412
  361    HA   ILE  44           HA       ILE  44  -9.324  -6.351   2.352
  362    HB   ILE  44           HB       ILE  44  -7.423  -4.886   4.235
  363   HG12  ILE  44          HG11      ILE  44  -6.881  -6.925   1.990
  364   HG13  ILE  44          HG12      ILE  44  -6.463  -5.182   1.957
  365   HG21  ILE  44          HG21      ILE  44  -6.959  -7.192   5.150
  366   HG22  ILE  44          HG22      ILE  44  -8.672  -6.768   5.380
  367   HG23  ILE  44          HG23      ILE  44  -8.196  -7.886   4.046
  368   HD11  ILE  44           HD1      ILE  44  -4.440  -6.463   2.480
  369   HD12  ILE  44           HD2      ILE  44  -4.919  -5.529   3.943
  370   HD13  ILE  44           HD3      ILE  44  -5.240  -7.302   3.849
  371    H    PHE  45           HN       PHE  45 -10.981  -7.044   3.634
  372    HA   PHE  45           HA       PHE  45 -11.667  -5.550   5.987
  373    HB2  PHE  45           HB1      PHE  45 -12.949  -4.197   4.324
  374    HB3  PHE  45           HB2      PHE  45 -13.758  -5.686   3.721
  375    HD1  PHE  45           HD1      PHE  45 -13.166  -3.732   6.898
  376    HD2  PHE  45           HD2      PHE  45 -15.759  -6.385   4.742
  377    HE1  PHE  45           HE1      PHE  45 -14.850  -3.544   8.702
  378    HE2  PHE  45           HE2      PHE  45 -17.419  -6.245   6.562
  379    HZ   PHE  45           HZ       PHE  45 -16.998  -4.797   8.526
  380    H    ALA  46           HN       ALA  46 -12.381  -6.820   7.523
  381    HA   ALA  46           HA       ALA  46 -12.689  -8.754   8.623
  382    HB1  ALA  46           HB1      ALA  46 -14.800  -7.482   8.544
  383    HB2  ALA  46           HB2      ALA  46 -15.299  -8.380   7.075
  384    HB3  ALA  46           HB3      ALA  46 -15.122  -9.250   8.646
  385    H    GLY  47           HN       GLY  47 -11.147 -10.256   7.825
  386    HA2  GLY  47           HA2      GLY  47 -10.652 -12.395   7.307
  387    HA3  GLY  47           HA1      GLY  47 -12.333 -12.659   6.740
  388    H    LYS  48           HN       LYS  48 -11.943 -10.232   4.886
  389    HA   LYS  48           HA       LYS  48 -10.854 -11.923   2.725
  390    HB2  LYS  48           HB1      LYS  48 -13.043  -9.775   2.758
  391    HB3  LYS  48           HB2      LYS  48 -12.568 -10.739   1.322
  392    HG2  LYS  48           HG1      LYS  48 -13.387 -12.783   2.263
  393    HG3  LYS  48           HG2      LYS  48 -13.638 -12.101   3.895
  394    HD2  LYS  48           HD1      LYS  48 -15.122 -10.751   1.608
  395    HD3  LYS  48           HD2      LYS  48 -15.606 -12.417   2.016
  396    HE2  LYS  48           HE1      LYS  48 -17.059 -10.856   3.215
  397    HE3  LYS  48           HE2      LYS  48 -16.074 -11.808   4.386
  398    HZ1  LYS  48           HZ1      LYS  48 -16.347  -9.218   4.575
  399    HZ2  LYS  48           HZ2      LYS  48 -14.880 -10.005   4.989
  400    HZ3  LYS  48           HZ3      LYS  48 -15.021  -9.213   3.505
  401    H    GLN  49           HN       GLN  49  -9.358 -11.110   1.307
  402    HA   GLN  49           HA       GLN  49  -8.811  -8.221   1.256
  403    HB2  GLN  49           HB1      GLN  49  -6.893  -9.897   0.859
  404    HB3  GLN  49           HB2      GLN  49  -7.799 -10.457  -0.583
  405    HG2  GLN  49           HG1      GLN  49  -7.709  -7.815  -1.270
  406    HG3  GLN  49           HG2      GLN  49  -6.371  -7.763  -0.082
  407   HE21  GLN  49          HE21      GLN  49  -5.949  -9.588  -3.741
  408   HE22  GLN  49          HE22      GLN  49  -7.464  -8.904  -3.216
  409    H    LEU  50           HN       LEU  50  -9.781  -6.925  -0.404
  410    HA   LEU  50           HA       LEU  50 -12.130  -8.250  -1.537
  411    HB2  LEU  50           HB1      LEU  50 -11.521  -5.276  -1.514
  412    HB3  LEU  50           HB2      LEU  50 -13.098  -6.081  -1.718
  413    HG   LEU  50           HG       LEU  50 -11.406  -5.799   0.835
  414   HD11  LEU  50          HD11      LEU  50 -13.349  -4.544   1.694
  415   HD12  LEU  50          HD12      LEU  50 -12.865  -3.849   0.105
  416   HD13  LEU  50          HD13      LEU  50 -14.294  -4.918   0.209
  417   HD21  LEU  50          HD21      LEU  50 -13.217  -7.013   2.085
  418   HD22  LEU  50          HD22      LEU  50 -13.967  -7.486   0.518
  419   HD23  LEU  50          HD23      LEU  50 -12.338  -8.089   0.953
  420    H    GLU  51           HN       GLU  51 -12.902  -7.715  -3.645
  421    HA   GLU  51           HA       GLU  51 -10.779  -7.802  -5.643
  422    HB2  GLU  51           HB1      GLU  51 -13.796  -8.388  -5.787
  423    HB3  GLU  51           HB2      GLU  51 -12.593  -8.813  -7.058
  424    HG2  GLU  51           HG1      GLU  51 -12.055 -10.788  -6.037
  425    HG3  GLU  51           HG2      GLU  51 -11.883 -10.035  -4.416
  426    H    ASP  52           HN       ASP  52 -13.424  -7.106  -7.314
  427    HA   ASP  52           HA       ASP  52 -13.315  -4.174  -7.166
  428    HB2  ASP  52           HB1      ASP  52 -12.865  -5.976  -9.634
  429    HB3  ASP  52           HB2      ASP  52 -13.543  -4.301  -9.800
  430    H    GLY  53           HN       GLY  53 -15.163  -6.517  -9.232
  431    HA2  GLY  53           HA2      GLY  53 -17.512  -4.909  -8.706
  432    HA3  GLY  53           HA1      GLY  53 -17.362  -6.326  -9.783
  433    H    ARG  54           HN       ARG  54 -17.667  -5.395  -6.380
  434    HA   ARG  54           HA       ARG  54 -19.666  -7.536  -6.034
  435    HB2  ARG  54           HB1      ARG  54 -17.457  -6.832  -3.999
  436    HB3  ARG  54           HB2      ARG  54 -18.848  -7.912  -3.648
  437    HG2  ARG  54           HG1      ARG  54 -16.567  -8.499  -5.644
  438    HG3  ARG  54           HG2      ARG  54 -16.788  -9.116  -3.979
  439    HD2  ARG  54           HD1      ARG  54 -19.128 -10.055  -4.925
  440    HD3  ARG  54           HD2      ARG  54 -18.315  -9.871  -6.530
  441    HE   ARG  54           HE       ARG  54 -16.326 -11.145  -5.501
  442   HH11  ARG  54          HH11      ARG  54 -18.576 -11.762  -2.439
  443   HH12  ARG  54          HH12      ARG  54 -19.338 -11.554  -3.736
  444   HH21  ARG  54          HH21      ARG  54 -16.392 -12.756  -2.592
  445   HH22  ARG  54          HH22      ARG  54 -15.424 -11.898  -3.776
  446    H    THR  55           HN       THR  55 -20.975  -7.026  -3.847
  447    HA   THR  55           HA       THR  55 -21.467  -4.136  -3.847
  448    HB   THR  55           HB       THR  55 -23.442  -4.434  -2.599
  449    HG1  THR  55           HG1      THR  55 -24.013  -6.323  -1.704
  450   HG21  THR  55          HG21      THR  55 -24.754  -5.853  -4.153
  451   HG22  THR  55          HG22      THR  55 -23.524  -4.935  -5.092
  452   HG23  THR  55          HG23      THR  55 -23.265  -6.680  -4.730
  453    H    LEU  56           HN       LEU  56 -21.782  -3.014  -1.617
  454    HA   LEU  56           HA       LEU  56 -19.700  -3.767   0.211
  455    HB2  LEU  56           HB1      LEU  56 -21.827  -1.646   0.091
  456    HB3  LEU  56           HB2      LEU  56 -21.262  -2.110   1.728
  457    HG   LEU  56           HG       LEU  56 -18.893  -1.752   1.043
  458   HD11  LEU  56          HD11      LEU  56 -18.301  -0.527  -0.990
  459   HD12  LEU  56          HD12      LEU  56 -19.154  -2.022  -1.466
  460   HD13  LEU  56          HD13      LEU  56 -20.011  -0.450  -1.519
  461   HD21  LEU  56          HD21      LEU  56 -19.000   0.744   1.114
  462   HD22  LEU  56          HD22      LEU  56 -20.751   0.691   0.712
  463   HD23  LEU  56          HD23      LEU  56 -20.178  -0.002   2.261
  464    H    SER  57           HN       SER  57 -23.151  -4.553   0.037
  465    HA   SER  57           HA       SER  57 -23.380  -5.659   2.617
  466    HB2  SER  57           HB1      SER  57 -25.439  -6.833   1.725
  467    HB3  SER  57           HB2      SER  57 -25.403  -5.043   1.538
  468    HG   SER  57           HG1      SER  57 -26.098  -6.191  -0.353
  469    H    ASP  58           HN       ASP  58 -22.444  -7.254  -0.466
  470    HA   ASP  58           HA       ASP  58 -22.213  -9.871   0.143
  471    HB2  ASP  58           HB1      ASP  58 -21.709  -8.541  -1.988
  472    HB3  ASP  58           HB2      ASP  58 -20.168  -7.994  -1.259
  473    H    TYR  59           HN       TYR  59 -19.668  -7.459   0.749
  474    HA   TYR  59           HA       TYR  59 -18.104  -9.304   2.266
  475    HB2  TYR  59           HB1      TYR  59 -17.897  -6.285   1.721
  476    HB3  TYR  59           HB2      TYR  59 -16.587  -7.220   2.539
  477    HD1  TYR  59           HD1      TYR  59 -16.982  -9.819   0.575
  478    HD2  TYR  59           HD2      TYR  59 -16.530  -5.573   0.001
  479    HE1  TYR  59           HE1      TYR  59 -15.678 -10.229  -1.462
  480    HE2  TYR  59           HE2      TYR  59 -15.245  -6.022  -2.072
  481    HH   TYR  59           HH       TYR  59 -14.470  -9.318  -3.163
  482    H    ASN  60           HN       ASN  60 -20.745  -7.612   3.233
  483    HA   ASN  60           HA       ASN  60 -21.696  -6.906   5.021
  484    HB2  ASN  60           HB1      ASN  60 -20.880  -9.154   5.900
  485    HB3  ASN  60           HB2      ASN  60 -19.587  -8.253   6.779
  486   HD21  ASN  60          HD21      ASN  60 -22.328  -8.763   9.170
  487   HD22  ASN  60          HD22      ASN  60 -21.098  -9.700   8.356
  488    H    ILE  61           HN       ILE  61 -20.262  -4.996   3.771
  489    HA   ILE  61           HA       ILE  61 -18.892  -3.434   5.849
  490    HB   ILE  61           HB       ILE  61 -19.314  -2.942   2.886
  491   HG12  ILE  61          HG11      ILE  61 -16.740  -3.569   4.454
  492   HG13  ILE  61          HG12      ILE  61 -17.704  -4.817   3.602
  493   HG21  ILE  61          HG21      ILE  61 -17.683  -1.007   3.273
  494   HG22  ILE  61          HG22      ILE  61 -19.228  -0.760   4.134
  495   HG23  ILE  61          HG23      ILE  61 -17.779  -1.319   5.044
  496   HD11  ILE  61           HD1      ILE  61 -15.825  -4.115   2.161
  497   HD12  ILE  61           HD2      ILE  61 -17.393  -3.610   1.428
  498   HD13  ILE  61           HD3      ILE  61 -16.346  -2.394   2.247
  499    H    GLN  62           HN       GLN  62 -19.888  -1.884   6.956
  500    HA   GLN  62           HA       GLN  62 -22.642  -1.110   6.153
  501    HB2  GLN  62           HB1      GLN  62 -21.601  -1.556   9.008
  502    HB3  GLN  62           HB2      GLN  62 -23.333  -1.406   8.461
  503    HG2  GLN  62           HG1      GLN  62 -23.229  -3.688   7.479
  504    HG3  GLN  62           HG2      GLN  62 -21.489  -3.830   7.924
  505   HE21  GLN  62          HE21      GLN  62 -23.185  -5.480  10.685
  506   HE22  GLN  62          HE22      GLN  62 -22.788  -5.755   8.999
  507    H    LYS  63           HN       LYS  63 -23.286   0.701   8.066
  508    HA   LYS  63           HA       LYS  63 -21.660   2.921   7.852
  509    HB2  LYS  63           HB1      LYS  63 -22.953   4.040   9.328
  510    HB3  LYS  63           HB2      LYS  63 -24.123   2.828   8.749
  511    HG2  LYS  63           HG1      LYS  63 -22.538   2.578  11.439
  512    HG3  LYS  63           HG2      LYS  63 -23.964   3.589  11.240
  513    HD2  LYS  63           HD1      LYS  63 -24.623   1.568  12.328
  514    HD3  LYS  63           HD2      LYS  63 -25.427   1.727  10.740
  515    HE2  LYS  63           HE1      LYS  63 -24.813  -0.636  11.275
  516    HE3  LYS  63           HE2      LYS  63 -24.029  -0.038   9.773
  517    HZ1  LYS  63           HZ1      LYS  63 -22.579  -1.348  11.177
  518    HZ2  LYS  63           HZ2      LYS  63 -21.960   0.237  10.977
  519    HZ3  LYS  63           HZ3      LYS  63 -22.689  -0.210  12.440
  520    H    GLU  64           HN       GLU  64 -20.173   3.976   9.086
  521    HA   GLU  64           HA       GLU  64 -18.313   4.213  10.016
  522    HB2  GLU  64           HB1      GLU  64 -19.482   2.986  12.528
  523    HB3  GLU  64           HB2      GLU  64 -18.279   4.311  12.360
  524    HG2  GLU  64           HG1      GLU  64 -21.307   4.402  11.810
  525    HG3  GLU  64           HG2      GLU  64 -20.330   5.456  12.888
  526    H    SER  65           HN       SER  65 -18.222   1.942   8.473
  527    HA   SER  65           HA       SER  65 -16.803  -0.125   9.916
  528    HB2  SER  65           HB1      SER  65 -17.028   0.209   6.868
  529    HB3  SER  65           HB2      SER  65 -16.400  -1.239   7.737
  530    HG   SER  65           HG1      SER  65 -19.029  -0.185   7.656
  531    H    THR  66           HN       THR  66 -14.631  -0.422  10.159
  532    HA   THR  66           HA       THR  66 -12.782   1.425   8.775
  533    HB   THR  66           HB       THR  66 -12.277  -0.716  10.887
  534    HG1  THR  66           HG1      THR  66 -13.050   1.380  11.476
  535   HG21  THR  66          HG21      THR  66  -9.861   0.164  10.778
  536   HG22  THR  66          HG22      THR  66 -10.338  -0.776   9.341
  537   HG23  THR  66          HG23      THR  66 -10.303   1.011   9.233
  538    H    LEU  67           HN       LEU  67 -12.261   0.906   6.726
  539    HA   LEU  67           HA       LEU  67 -11.764  -1.959   6.119
  540    HB2  LEU  67           HB1      LEU  67 -11.711   0.253   4.018
  541    HB3  LEU  67           HB2      LEU  67 -11.853  -1.516   3.796
  542    HG   LEU  67           HG       LEU  67 -13.987   0.505   4.700
  543   HD11  LEU  67          HD11      LEU  67 -15.135  -0.288   2.615
  544   HD12  LEU  67          HD12      LEU  67 -13.487   0.333   2.232
  545   HD13  LEU  67          HD13      LEU  67 -13.791  -1.440   2.295
  546   HD21  LEU  67          HD21      LEU  67 -15.631  -1.328   4.799
  547   HD22  LEU  67          HD22      LEU  67 -14.358  -2.546   4.480
  548   HD23  LEU  67          HD23      LEU  67 -14.356  -1.613   6.027
  549    H    HIS  68           HN       HIS  68  -9.615  -2.306   4.928
  550    HA   HIS  68           HA       HIS  68  -7.697  -0.090   5.509
  551    HB2  HIS  68           HB1      HIS  68  -6.998  -3.044   5.175
  552    HB3  HIS  68           HB2      HIS  68  -5.889  -1.693   5.611
  553    HD2  HIS  68           HD2      HIS  68  -7.693  -4.484   7.338
  554    HE1  HIS  68           HE1      HIS  68  -7.123  -1.420  10.219
  555    HE2  HIS  68           HE2      HIS  68  -7.672  -3.889   9.857
  556    H    LEU  69           HN       LEU  69  -6.351   0.571   3.778
  557    HA   LEU  69           HA       LEU  69  -6.902  -0.744   1.173
  558    HB2  LEU  69           HB1      LEU  69  -7.730   1.634   1.300
  559    HB3  LEU  69           HB2      LEU  69  -6.071   2.166   1.680
  560    HG   LEU  69           HG       LEU  69  -5.331   1.205  -0.580
  561   HD11  LEU  69          HD11      LEU  69  -7.139   0.799  -2.270
  562   HD12  LEU  69          HD12      LEU  69  -7.212  -0.429  -0.958
  563   HD13  LEU  69          HD13      LEU  69  -8.384   0.948  -0.998
  564   HD21  LEU  69          HD21      LEU  69  -6.333   3.061  -1.926
  565   HD22  LEU  69          HD22      LEU  69  -7.558   3.340  -0.636
  566   HD23  LEU  69          HD23      LEU  69  -5.813   3.628  -0.297
  567    H    VAL  70           HN       VAL  70  -5.228  -1.831   0.305
  568    HA   VAL  70           HA       VAL  70  -2.500  -1.076   1.122
  569    HB   VAL  70           HB       VAL  70  -3.420  -3.617  -0.291
  570   HG11  VAL  70          HG11      VAL  70  -1.107  -4.396   0.438
  571   HG12  VAL  70          HG12      VAL  70  -1.009  -3.026  -0.722
  572   HG13  VAL  70          HG13      VAL  70  -0.750  -2.746   1.042
  573   HG21  VAL  70          HG21      VAL  70  -2.978  -4.702   1.960
  574   HG22  VAL  70          HG22      VAL  70  -2.832  -3.067   2.697
  575   HG23  VAL  70          HG23      VAL  70  -4.396  -3.597   1.978
  576    H    LEU  71           HN       LEU  71  -1.224  -0.058  -0.340
  577    HA   LEU  71           HA       LEU  71  -2.340   0.516  -2.952
  578    HB2  LEU  71           HB1      LEU  71   0.239   1.476  -1.616
  579    HB3  LEU  71           HB2      LEU  71  -0.470   2.130  -3.136
  580    HG   LEU  71           HG       LEU  71  -1.690   2.303  -0.308
  581   HD11  LEU  71          HD11      LEU  71  -1.226   4.746  -0.551
  582   HD12  LEU  71          HD12      LEU  71   0.293   3.791  -0.671
  583   HD13  LEU  71          HD13      LEU  71  -0.479   4.460  -2.160
  584   HD21  LEU  71          HD21      LEU  71  -3.381   3.824  -1.351
  585   HD22  LEU  71          HD22      LEU  71  -2.731   3.444  -2.987
  586   HD23  LEU  71          HD23      LEU  71  -3.518   2.156  -1.998
  587    H    ARG  72           HN       ARG  72  -1.719  -0.391  -4.836
  588    HA   ARG  72           HA       ARG  72  -0.032  -2.672  -4.824
  589    HB2  ARG  72           HB1      ARG  72  -2.079  -1.887  -6.281
  590    HB3  ARG  72           HB2      ARG  72  -0.877  -1.110  -7.338
  591    HG2  ARG  72           HG1      ARG  72  -1.148  -4.093  -6.549
  592    HG3  ARG  72           HG2      ARG  72  -1.604  -3.402  -8.129
  593    HD2  ARG  72           HD1      ARG  72   1.281  -3.727  -7.041
  594    HD3  ARG  72           HD2      ARG  72   0.394  -4.760  -8.236
  595    HE   ARG  72           HE       ARG  72   1.058  -1.826  -8.716
  596   HH11  ARG  72          HH11      ARG  72   2.881  -4.729 -10.633
  597   HH12  ARG  72          HH12      ARG  72   1.940  -5.114  -9.271
  598   HH21  ARG  72          HH21      ARG  72   2.802  -2.620 -11.527
  599   HH22  ARG  72          HH22      ARG  72   1.922  -1.347 -10.750
  600    H1   MET   1           HT1      MET   1  25.775 -11.647 -14.482
  601    H2   MET   1           HT2      MET   1  24.091 -11.744 -14.661
  602    H3   MET   1           HT3      MET   1  25.134 -12.247 -15.911
  603    HA   MET   1           HA       MET   1  25.901 -14.089 -14.773
  604    HB2  MET   1           HB1      MET   1  25.257 -14.682 -12.451
  605    HB3  MET   1           HB2      MET   1  26.037 -13.073 -12.481
  606    HG2  MET   1           HG1      MET   1  23.723 -12.001 -12.382
  607    HG3  MET   1           HG2      MET   1  22.997 -13.630 -12.303
  608    HE1  MET   1           HE1      MET   1  22.247 -12.170  -8.888
  609    HE2  MET   1           HE2      MET   1  22.354 -11.324 -10.468
  610    HE3  MET   1           HE3      MET   1  21.654 -12.974 -10.370
  611    H    GLN   2           HN       GLN   2  24.926 -16.112 -15.207
  612    HA   GLN   2           HA       GLN   2  22.510 -15.729 -16.597
  613    HB2  GLN   2           HB1      GLN   2  24.564 -16.904 -17.359
  614    HB3  GLN   2           HB2      GLN   2  24.180 -18.261 -16.243
  615    HG2  GLN   2           HG1      GLN   2  22.038 -18.710 -17.467
  616    HG3  GLN   2           HG2      GLN   2  22.285 -17.250 -18.493
  617   HE21  GLN   2          HE21      GLN   2  25.105 -18.882 -20.237
  618   HE22  GLN   2          HE22      GLN   2  24.850 -17.386 -19.360
  619    H    ILE   3           HN       ILE   3  20.453 -16.121 -16.014
  620    HA   ILE   3           HA       ILE   3  19.947 -18.267 -14.037
  621    HB   ILE   3           HB       ILE   3  17.952 -17.171 -13.250
  622   HG12  ILE   3          HG11      ILE   3  18.763 -14.698 -14.898
  623   HG13  ILE   3          HG12      ILE   3  17.467 -15.831 -15.384
  624   HG21  ILE   3          HG21      ILE   3  19.092 -15.454 -11.872
  625   HG22  ILE   3          HG22      ILE   3  20.178 -16.863 -12.137
  626   HG23  ILE   3          HG23      ILE   3  20.440 -15.345 -13.060
  627   HD11  ILE   3           HD1      ILE   3  16.438 -13.918 -14.230
  628   HD12  ILE   3           HD2      ILE   3  16.244 -15.396 -13.219
  629   HD13  ILE   3           HD3      ILE   3  17.482 -14.162 -12.784
  630    H    PHE   4           HN       PHE   4  17.867 -19.337 -14.255
  631    HA   PHE   4           HA       PHE   4  17.081 -19.538 -17.112
  632    HB2  PHE   4           HB1      PHE   4  16.905 -21.672 -14.889
  633    HB3  PHE   4           HB2      PHE   4  16.521 -21.912 -16.636
  634    HD1  PHE   4           HD1      PHE   4  18.623 -20.961 -18.211
  635    HD2  PHE   4           HD2      PHE   4  18.915 -22.549 -14.225
  636    HE1  PHE   4           HE1      PHE   4  21.012 -21.503 -18.593
  637    HE2  PHE   4           HE2      PHE   4  21.286 -23.118 -14.625
  638    HZ   PHE   4           HZ       PHE   4  22.342 -22.575 -16.808
  639    H    VAL   5           HN       VAL   5  15.312 -18.033 -17.158
  640    HA   VAL   5           HA       VAL   5  13.264 -18.386 -15.084
  641    HB   VAL   5           HB       VAL   5  13.272 -16.552 -17.509
  642   HG11  VAL   5          HG11      VAL   5  11.371 -15.460 -16.225
  643   HG12  VAL   5          HG12      VAL   5  10.956 -17.127 -16.733
  644   HG13  VAL   5          HG13      VAL   5  11.424 -16.797 -15.023
  645   HG21  VAL   5          HG21      VAL   5  13.698 -14.774 -15.753
  646   HG22  VAL   5          HG22      VAL   5  13.961 -16.076 -14.533
  647   HG23  VAL   5          HG23      VAL   5  15.074 -15.914 -15.940
  648    H    LYS   6           HN       LYS   6  12.205 -20.352 -15.317
  649    HA   LYS   6           HA       LYS   6  11.564 -21.238 -18.035
  650    HB2  LYS   6           HB1      LYS   6  11.132 -22.466 -15.258
  651    HB3  LYS   6           HB2      LYS   6  10.458 -23.163 -16.756
  652    HG2  LYS   6           HG1      LYS   6  12.998 -22.980 -17.636
  653    HG3  LYS   6           HG2      LYS   6  13.390 -22.883 -15.904
  654    HD2  LYS   6           HD1      LYS   6  13.572 -25.209 -16.743
  655    HD3  LYS   6           HD2      LYS   6  12.308 -25.082 -15.480
  656    HE2  LYS   6           HE1      LYS   6  11.748 -26.576 -17.527
  657    HE3  LYS   6           HE2      LYS   6  10.503 -25.340 -17.093
  658    HZ1  LYS   6           HZ1      LYS   6  11.106 -25.468 -19.539
  659    HZ2  LYS   6           HZ2      LYS   6  11.180 -23.963 -18.829
  660    HZ3  LYS   6           HZ3      LYS   6  12.609 -24.774 -19.134
  661    H    THR   7           HN       THR   7   9.352 -21.720 -18.723
  662    HA   THR   7           HA       THR   7   7.303 -20.621 -16.885
  663    HB   THR   7           HB       THR   7   5.595 -20.877 -18.543
  664    HG1  THR   7           HG1      THR   7   5.899 -21.870 -20.345
  665   HG21  THR   7          HG21      THR   7   6.308 -19.088 -20.138
  666   HG22  THR   7          HG22      THR   7   6.849 -18.716 -18.461
  667   HG23  THR   7          HG23      THR   7   8.033 -19.335 -19.672
  668    H    LEU   8           HN       LEU   8   5.588 -22.158 -16.295
  669    HA   LEU   8           HA       LEU   8   6.434 -24.824 -15.916
  670    HB2  LEU   8           HB1      LEU   8   3.565 -23.705 -16.009
  671    HB3  LEU   8           HB2      LEU   8   4.066 -25.266 -15.277
  672    HG   LEU   8           HG       LEU   8   4.925 -22.468 -14.296
  673   HD11  LEU   8          HD11      LEU   8   3.419 -22.937 -12.379
  674   HD12  LEU   8          HD12      LEU   8   2.488 -22.977 -13.923
  675   HD13  LEU   8          HD13      LEU   8   2.946 -24.516 -13.098
  676   HD21  LEU   8          HD21      LEU   8   5.765 -23.703 -12.276
  677   HD22  LEU   8          HD22      LEU   8   5.419 -25.270 -13.085
  678   HD23  LEU   8          HD23      LEU   8   6.677 -24.160 -13.752
  679    H    THR   9           HN       THR   9   4.644 -23.239 -18.512
  680    HA   THR   9           HA       THR   9   4.067 -25.587 -20.032
  681    HB   THR   9           HB       THR   9   3.523 -23.871 -21.846
  682    HG1  THR   9           HG1      THR   9   3.381 -21.756 -21.051
  683   HG21  THR   9          HG21      THR   9   1.496 -23.068 -20.636
  684   HG22  THR   9          HG22      THR   9   1.833 -24.781 -20.208
  685   HG23  THR   9          HG23      THR   9   2.244 -23.469 -19.047
  686    H    GLY  10           HN       GLY  10   6.616 -26.034 -19.556
  687    HA2  GLY  10           HA2      GLY  10   8.250 -26.980 -20.820
  688    HA3  GLY  10           HA1      GLY  10   7.550 -26.220 -22.282
  689    H    LYS  11           HN       LYS  11   7.895 -23.594 -21.845
  690    HA   LYS  11           HA       LYS  11  10.375 -23.287 -23.000
  691    HB2  LYS  11           HB1      LYS  11   8.323 -21.821 -23.243
  692    HB3  LYS  11           HB2      LYS  11   8.663 -21.152 -21.621
  693    HG2  LYS  11           HG1      LYS  11  10.894 -20.276 -22.495
  694    HG3  LYS  11           HG2      LYS  11  10.416 -20.770 -24.146
  695    HD2  LYS  11           HD1      LYS  11   8.823 -18.891 -22.261
  696    HD3  LYS  11           HD2      LYS  11  10.038 -18.295 -23.427
  697    HE2  LYS  11           HE1      LYS  11   7.486 -19.829 -24.295
  698    HE3  LYS  11           HE2      LYS  11   7.620 -18.027 -24.161
  699    HZ1  LYS  11           HZ1      LYS  11   8.092 -18.701 -26.409
  700    HZ2  LYS  11           HZ2      LYS  11   9.466 -18.060 -25.675
  701    HZ3  LYS  11           HZ3      LYS  11   9.357 -19.725 -25.896
  702    H    THR  12           HN       THR  12  12.445 -22.486 -22.440
  703    HA   THR  12           HA       THR  12  12.862 -21.632 -19.638
  704    HB   THR  12           HB       THR  12  14.955 -22.968 -21.429
  705    HG1  THR  12           HG1      THR  12  14.927 -24.544 -19.885
  706   HG21  THR  12          HG21      THR  12  16.320 -22.879 -19.268
  707   HG22  THR  12          HG22      THR  12  15.922 -21.247 -19.864
  708   HG23  THR  12          HG23      THR  12  14.993 -21.943 -18.487
  709    H    ILE  13           HN       ILE  13  13.172 -19.432 -19.632
  710    HA   ILE  13           HA       ILE  13  14.329 -18.183 -22.013
  711    HB   ILE  13           HB       ILE  13  13.226 -16.821 -19.525
  712   HG12  ILE  13          HG11      ILE  13  11.638 -17.480 -22.063
  713   HG13  ILE  13          HG12      ILE  13  11.433 -18.316 -20.484
  714   HG21  ILE  13          HG21      ILE  13  13.080 -14.878 -21.090
  715   HG22  ILE  13          HG22      ILE  13  14.745 -15.535 -21.127
  716   HG23  ILE  13          HG23      ILE  13  13.599 -15.912 -22.468
  717   HD11  ILE  13           HD1      ILE  13   9.692 -16.588 -20.687
  718   HD12  ILE  13           HD2      ILE  13  10.837 -16.159 -19.363
  719   HD13  ILE  13           HD3      ILE  13  10.932 -15.312 -20.948
  720    H    THR  14           HN       THR  14  16.552 -18.679 -21.807
  721    HA   THR  14           HA       THR  14  17.873 -18.414 -19.262
  722    HB   THR  14           HB       THR  14  19.104 -18.720 -22.037
  723    HG1  THR  14           HG1      THR  14  19.296 -20.884 -21.256
  724   HG21  THR  14          HG21      THR  14  21.023 -19.677 -20.634
  725   HG22  THR  14          HG22      THR  14  20.741 -17.944 -20.288
  726   HG23  THR  14          HG23      THR  14  20.141 -19.196 -19.142
  727    H    LEU  15           HN       LEU  15  18.458 -16.494 -18.364
  728    HA   LEU  15           HA       LEU  15  18.996 -14.220 -20.207
  729    HB2  LEU  15           HB1      LEU  15  17.638 -14.220 -17.455
  730    HB3  LEU  15           HB2      LEU  15  18.063 -12.742 -18.386
  731    HG   LEU  15           HG       LEU  15  16.071 -14.903 -19.295
  732   HD11  LEU  15          HD11      LEU  15  14.331 -13.231 -18.740
  733   HD12  LEU  15          HD12      LEU  15  15.301 -13.634 -17.276
  734   HD13  LEU  15          HD13      LEU  15  15.579 -12.077 -18.145
  735   HD21  LEU  15          HD21      LEU  15  15.376 -13.149 -20.985
  736   HD22  LEU  15          HD22      LEU  15  16.758 -12.120 -20.473
  737   HD23  LEU  15          HD23      LEU  15  17.060 -13.722 -21.253
  738    H    GLU  16           HN       GLU  16  20.821 -13.038 -19.892
  739    HA   GLU  16           HA       GLU  16  22.484 -13.515 -17.533
  740    HB2  GLU  16           HB1      GLU  16  22.836 -12.268 -20.231
  741    HB3  GLU  16           HB2      GLU  16  23.601 -11.347 -18.911
  742    HG2  GLU  16           HG1      GLU  16  24.166 -14.352 -19.408
  743    HG3  GLU  16           HG2      GLU  16  25.177 -12.978 -19.995
  744    H    VAL  17           HN       VAL  17  21.643 -12.633 -15.713
  745    HA   VAL  17           HA       VAL  17  20.370  -9.970 -15.892
  746    HB   VAL  17           HB       VAL  17  19.304 -10.505 -13.734
  747   HG11  VAL  17          HG11      VAL  17  17.621 -12.016 -14.708
  748   HG12  VAL  17          HG12      VAL  17  18.173 -10.833 -15.946
  749   HG13  VAL  17          HG13      VAL  17  18.770 -12.537 -15.997
  750   HG21  VAL  17          HG21      VAL  17  19.325 -12.864 -12.925
  751   HG22  VAL  17          HG22      VAL  17  20.463 -13.343 -14.215
  752   HG23  VAL  17          HG23      VAL  17  20.995 -12.210 -12.911
  753    H    GLU  18           HN       GLU  18  20.542  -8.607 -13.965
  754    HA   GLU  18           HA       GLU  18  23.359  -8.252 -13.301
  755    HB2  GLU  18           HB1      GLU  18  20.800  -6.609 -12.878
  756    HB3  GLU  18           HB2      GLU  18  22.455  -6.012 -12.498
  757    HG2  GLU  18           HG1      GLU  18  23.044  -5.815 -14.827
  758    HG3  GLU  18           HG2      GLU  18  21.604  -6.763 -15.362
  759    HA   PRO  19           HA       PRO  19  22.214  -9.002  -8.916
  760    HB2  PRO  19           HB2      PRO  19  24.087  -7.502  -7.525
  761    HB3  PRO  19           HB1      PRO  19  24.575  -8.971  -8.460
  762    HG2  PRO  19           HG2      PRO  19  24.677  -6.041  -9.409
  763    HG3  PRO  19           HG1      PRO  19  26.019  -7.257  -9.433
  764    HD2  PRO  19           HD2      PRO  19  24.384  -6.757 -11.629
  765    HD3  PRO  19           HD1      PRO  19  25.011  -8.437 -11.283
  766    H    SER  20           HN       SER  20  22.235  -5.882 -10.516
  767    HA   SER  20           HA       SER  20  20.778  -4.474  -8.491
  768    HB2  SER  20           HB1      SER  20  20.752  -2.790 -10.669
  769    HB3  SER  20           HB2      SER  20  22.138  -2.954  -9.545
  770    HG   SER  20           HG1      SER  20  21.909  -3.833 -12.203
  771    H    ASP  21           HN       ASP  21  19.890  -6.604 -11.064
  772    HA   ASP  21           HA       ASP  21  17.617  -5.454 -12.064
  773    HB2  ASP  21           HB1      ASP  21  18.727  -8.258 -11.731
  774    HB3  ASP  21           HB2      ASP  21  16.954  -8.185 -11.991
  775    H    THR  22           HN       THR  22  15.794  -4.686 -11.139
  776    HA   THR  22           HA       THR  22  14.552  -6.103  -8.912
  777    HB   THR  22           HB       THR  22  12.671  -4.494  -9.161
  778    HG1  THR  22           HG1      THR  22  12.989  -2.761 -10.534
  779   HG21  THR  22          HG21      THR  22  13.947  -2.510  -8.332
  780   HG22  THR  22          HG22      THR  22  14.615  -4.027  -7.632
  781   HG23  THR  22          HG23      THR  22  15.483  -3.198  -8.978
  782    H    ILE  23           HN       ILE  23  12.032  -6.644  -9.345
  783    HA   ILE  23           HA       ILE  23  12.343  -8.658 -11.311
  784    HB   ILE  23           HB       ILE  23   9.830  -7.962  -9.777
  785   HG12  ILE  23          HG11      ILE  23  11.590  -8.238  -8.139
  786   HG13  ILE  23          HG12      ILE  23  10.647  -9.746  -8.201
  787   HG21  ILE  23          HG21      ILE  23   9.410 -10.448 -10.161
  788   HG22  ILE  23          HG22      ILE  23   9.452  -9.518 -11.697
  789   HG23  ILE  23          HG23      ILE  23  10.868 -10.520 -11.217
  790   HD11  ILE  23           HD1      ILE  23  13.068 -10.285  -8.035
  791   HD12  ILE  23           HD2      ILE  23  12.492 -10.794  -9.660
  792   HD13  ILE  23           HD3      ILE  23  13.457  -9.284  -9.457
  793    H    GLU  24           HN       GLU  24  10.167  -5.723 -11.373
  794    HA   GLU  24           HA       GLU  24   9.284  -6.130 -13.925
  795    HB2  GLU  24           HB1      GLU  24   9.851  -3.566 -12.396
  796    HB3  GLU  24           HB2      GLU  24   9.076  -3.574 -14.020
  797    HG2  GLU  24           HG1      GLU  24   7.365  -3.415 -12.227
  798    HG3  GLU  24           HG2      GLU  24   7.164  -4.944 -13.160
  799    H    ASN  25           HN       ASN  25  12.556  -5.138 -13.041
  800    HA   ASN  25           HA       ASN  25  13.254  -4.223 -15.673
  801    HB2  ASN  25           HB1      ASN  25  14.389  -3.695 -13.353
  802    HB3  ASN  25           HB2      ASN  25  15.225  -5.272 -13.554
  803   HD21  ASN  25          HD21      ASN  25  17.735  -3.517 -15.314
  804   HD22  ASN  25          HD22      ASN  25  17.250  -4.941 -14.414
  805    H    VAL  26           HN       VAL  26  13.628  -7.338 -13.882
  806    HA   VAL  26           HA       VAL  26  14.601  -8.838 -16.065
  807    HB   VAL  26           HB       VAL  26  12.894  -9.771 -13.713
  808   HG11  VAL  26          HG11      VAL  26  13.960 -12.019 -14.227
  809   HG12  VAL  26          HG12      VAL  26  12.885 -11.477 -15.559
  810   HG13  VAL  26          HG13      VAL  26  14.676 -11.325 -15.728
  811   HG21  VAL  26          HG21      VAL  26  15.136 -10.438 -12.765
  812   HG22  VAL  26          HG22      VAL  26  15.961  -9.663 -14.169
  813   HG23  VAL  26          HG23      VAL  26  15.031  -8.663 -13.003
  814    H    LYS  27           HN       LYS  27  11.189  -8.244 -15.018
  815    HA   LYS  27           HA       LYS  27   9.928  -9.622 -17.089
  816    HB2  LYS  27           HB1      LYS  27   9.039  -7.029 -15.722
  817    HB3  LYS  27           HB2      LYS  27   8.004  -8.027 -16.784
  818    HG2  LYS  27           HG1      LYS  27   8.173  -9.958 -15.256
  819    HG3  LYS  27           HG2      LYS  27   9.153  -9.008 -14.097
  820    HD2  LYS  27           HD1      LYS  27   7.280  -7.358 -13.815
  821    HD3  LYS  27           HD2      LYS  27   6.374  -8.199 -15.111
  822    HE2  LYS  27           HE1      LYS  27   5.306  -9.132 -13.347
  823    HE3  LYS  27           HE2      LYS  27   6.643 -10.331 -13.460
  824    HZ1  LYS  27           HZ1      LYS  27   6.902  -7.945 -11.694
  825    H    ALA  28           HN       ALA  28  11.223  -6.245 -17.177
  826    HA   ALA  28           HA       ALA  28  10.357  -5.674 -19.791
  827    HB1  ALA  28           HB1      ALA  28  11.151  -3.963 -18.134
  828    HB2  ALA  28           HB2      ALA  28  12.813  -4.635 -18.248
  829    HB3  ALA  28           HB3      ALA  28  12.064  -3.852 -19.687
  830    H    LYS  29           HN       LYS  29  13.370  -7.258 -18.642
  831    HA   LYS  29           HA       LYS  29  14.473  -7.625 -21.246
  832    HB2  LYS  29           HB1      LYS  29  14.935  -9.016 -18.558
  833    HB3  LYS  29           HB2      LYS  29  15.940  -9.324 -20.021
  834    HG2  LYS  29           HG1      LYS  29  16.770  -7.057 -20.075
  835    HG3  LYS  29           HG2      LYS  29  15.544  -6.482 -18.901
  836    HD2  LYS  29           HD1      LYS  29  16.547  -7.841 -17.088
  837    HD3  LYS  29           HD2      LYS  29  17.840  -8.413 -18.208
  838    HE2  LYS  29           HE1      LYS  29  18.667  -6.064 -18.484
  839    HE3  LYS  29           HE2      LYS  29  17.286  -5.441 -17.493
  840    HZ1  LYS  29           HZ1      LYS  29  19.369  -5.664 -16.201
  841    HZ2  LYS  29           HZ2      LYS  29  18.117  -6.613 -15.588
  842    HZ3  LYS  29           HZ3      LYS  29  19.340  -7.338 -16.429
  843    H    ILE  30           HN       ILE  30  12.181  -9.596 -19.331
  844    HA   ILE  30           HA       ILE  30  12.030 -11.693 -21.286
  845    HB   ILE  30           HB       ILE  30  10.157 -10.825 -19.057
  846   HG12  ILE  30          HG11      ILE  30  11.985 -13.296 -19.298
  847   HG13  ILE  30          HG12      ILE  30  12.508 -11.768 -18.524
  848   HG21  ILE  30          HG21      ILE  30   9.046 -13.084 -19.405
  849   HG22  ILE  30          HG22      ILE  30   8.779 -11.980 -20.781
  850   HG23  ILE  30          HG23      ILE  30  10.000 -13.299 -20.922
  851   HD11  ILE  30           HD1      ILE  30  11.754 -13.320 -16.775
  852   HD12  ILE  30           HD2      ILE  30  10.612 -11.929 -16.873
  853   HD13  ILE  30           HD3      ILE  30  10.150 -13.518 -17.571
  854    H    GLN  31           HN       GLN  31  10.280  -8.588 -20.906
  855    HA   GLN  31           HA       GLN  31   8.490  -8.932 -23.033
  856    HB2  GLN  31           HB1      GLN  31   8.389  -7.105 -21.298
  857    HB3  GLN  31           HB2      GLN  31   9.797  -6.334 -22.094
  858    HG2  GLN  31           HG1      GLN  31   8.341  -6.231 -24.281
  859    HG3  GLN  31           HG2      GLN  31   6.958  -6.760 -23.266
  860   HE21  GLN  31          HE21      GLN  31   8.604  -2.998 -22.735
  861   HE22  GLN  31          HE22      GLN  31   9.602  -4.297 -23.358
  862    H    ASP  32           HN       ASP  32  11.786  -7.473 -23.072
  863    HA   ASP  32           HA       ASP  32  12.110  -7.041 -25.798
  864    HB2  ASP  32           HB1      ASP  32  13.608  -6.237 -23.955
  865    HB3  ASP  32           HB2      ASP  32  14.015  -7.932 -23.525
  866    H    LYS  33           HN       LYS  33  13.317  -9.872 -23.980
  867    HA   LYS  33           HA       LYS  33  13.987 -11.316 -26.218
  868    HB2  LYS  33           HB1      LYS  33  14.972 -11.589 -23.997
  869    HB3  LYS  33           HB2      LYS  33  13.402 -12.109 -23.332
  870    HG2  LYS  33           HG1      LYS  33  14.806 -13.989 -23.414
  871    HG3  LYS  33           HG2      LYS  33  13.531 -14.255 -24.621
  872    HD2  LYS  33           HD1      LYS  33  16.418 -13.306 -25.228
  873    HD3  LYS  33           HD2      LYS  33  15.907 -15.023 -25.182
  874    HE2  LYS  33           HE1      LYS  33  15.099 -12.897 -27.259
  875    HE3  LYS  33           HE2      LYS  33  16.028 -14.425 -27.497
  876    HZ1  LYS  33           HZ1      LYS  33  13.184 -13.936 -27.229
  877    HZ2  LYS  33           HZ2      LYS  33  13.953 -15.153 -28.108
  878    HZ3  LYS  33           HZ3      LYS  33  13.636 -15.322 -26.443
  879    H    GLU  34           HN       GLU  34  10.947 -11.899 -24.248
  880    HA   GLU  34           HA       GLU  34  10.160 -13.825 -26.380
  881    HB2  GLU  34           HB1      GLU  34   9.421 -13.785 -23.420
  882    HB3  GLU  34           HB2      GLU  34   8.798 -14.956 -24.635
  883    HG2  GLU  34           HG1      GLU  34  11.741 -14.689 -23.725
  884    HG3  GLU  34           HG2      GLU  34  10.577 -15.957 -23.246
  885    H    GLY  35           HN       GLY  35   9.375 -10.688 -25.451
  886    HA2  GLY  35           HA2      GLY  35   7.728  -9.442 -26.330
  887    HA3  GLY  35           HA1      GLY  35   6.969 -10.914 -26.999
  888    H    ILE  36           HN       ILE  36   7.446 -10.713 -23.536
  889    HA   ILE  36           HA       ILE  36   4.514 -10.643 -23.281
  890    HB   ILE  36           HB       ILE  36   6.482 -11.478 -21.145
  891   HG12  ILE  36          HG11      ILE  36   5.069 -13.222 -23.262
  892   HG13  ILE  36          HG12      ILE  36   6.826 -12.882 -23.199
  893   HG21  ILE  36          HG21      ILE  36   4.403 -12.592 -20.242
  894   HG22  ILE  36          HG22      ILE  36   4.120 -10.837 -20.427
  895   HG23  ILE  36          HG23      ILE  36   3.452 -11.988 -21.645
  896   HD11  ILE  36           HD1      ILE  36   6.458 -15.085 -22.228
  897   HD12  ILE  36           HD2      ILE  36   6.966 -13.958 -20.917
  898   HD13  ILE  36           HD3      ILE  36   5.236 -14.448 -21.071
  899    HA   PRO  37           HA       PRO  37   5.311  -6.576 -21.491
  900    HB2  PRO  37           HB2      PRO  37   2.260  -6.783 -21.028
  901    HB3  PRO  37           HB1      PRO  37   3.191  -5.310 -21.540
  902    HG2  PRO  37           HG1      PRO  37   1.892  -6.752 -23.426
  903    HG3  PRO  37           HG2      PRO  37   3.627  -6.304 -23.741
  904    HD2  PRO  37           HD2      PRO  37   2.523  -8.973 -22.684
  905    HD3  PRO  37           HD1      PRO  37   3.751  -8.666 -23.998
  906    HA   PRO  38           HA       PRO  38   5.907  -7.133 -17.361
  907    HB2  PRO  38           HB2      PRO  38   4.557  -4.472 -16.640
  908    HB3  PRO  38           HB1      PRO  38   6.133  -5.131 -16.031
  909    HG2  PRO  38           HG1      PRO  38   6.151  -3.352 -18.098
  910    HG3  PRO  38           HG2      PRO  38   7.158  -4.855 -18.228
  911    HD2  PRO  38           HD2      PRO  38   4.421  -4.306 -19.509
  912    HD3  PRO  38           HD1      PRO  38   5.911  -5.099 -20.193
  913    H    ASP  39           HN       ASP  39   2.708  -5.541 -16.428
  914    HA   ASP  39           HA       ASP  39   2.573  -7.483 -14.376
  915    HB2  ASP  39           HB1      ASP  39   1.765  -4.968 -14.393
  916    HB3  ASP  39           HB2      ASP  39   0.232  -5.637 -15.080
  917    H    GLN  40           HN       GLN  40   2.156  -8.313 -17.390
  918    HA   GLN  40           HA       GLN  40  -0.139 -10.106 -16.981
  919    HB2  GLN  40           HB1      GLN  40   1.968  -9.868 -19.217
  920    HB3  GLN  40           HB2      GLN  40   0.664 -11.112 -19.166
  921    HG2  GLN  40           HG1      GLN  40  -1.085  -9.265 -19.212
  922    HG3  GLN  40           HG2      GLN  40   0.226  -8.040 -19.294
  923   HE21  GLN  40          HE21      GLN  40  -0.159 -10.459 -22.618
  924   HE22  GLN  40          HE22      GLN  40  -0.263 -11.200 -21.029
  925    H    GLN  41           HN       GLN  41   3.307  -9.908 -16.389
  926    HA   GLN  41           HA       GLN  41   3.693 -12.793 -16.266
  927    HB2  GLN  41           HB1      GLN  41   5.506 -10.353 -15.793
  928    HB3  GLN  41           HB2      GLN  41   6.081 -12.044 -15.715
  929    HG2  GLN  41           HG1      GLN  41   5.510 -12.338 -18.167
  930    HG3  GLN  41           HG2      GLN  41   4.938 -10.625 -18.221
  931   HE21  GLN  41          HE21      GLN  41   8.215  -9.552 -18.970
  932   HE22  GLN  41          HE22      GLN  41   6.520  -9.467 -19.324
  933    H    ARG  42           HN       ARG  42   3.973 -13.963 -14.360
  934    HA   ARG  42           HA       ARG  42   4.488 -12.400 -11.902
  935    HB2  ARG  42           HB1      ARG  42   2.692 -14.875 -12.169
  936    HB3  ARG  42           HB2      ARG  42   3.159 -14.125 -10.609
  937    HG2  ARG  42           HG1      ARG  42   1.472 -12.847 -12.840
  938    HG3  ARG  42           HG2      ARG  42   0.840 -13.536 -11.309
  939    HD2  ARG  42           HD1      ARG  42   1.893 -11.731  -9.975
  940    HD3  ARG  42           HD2      ARG  42   2.752 -11.092 -11.440
  941    HE   ARG  42           HE       ARG  42  -0.062 -11.393 -12.057
  942   HH11  ARG  42          HH11      ARG  42   1.431  -7.806 -11.461
  943   HH12  ARG  42          HH12      ARG  42   2.222  -9.123 -10.653
  944   HH21  ARG  42          HH21      ARG  42  -0.431  -8.116 -12.592
  945   HH22  ARG  42          HH22      ARG  42  -0.865  -9.720 -13.012
  946    H    LEU  43           HN       LEU  43   6.532 -12.817 -11.328
  947    HA   LEU  43           HA       LEU  43   7.730 -15.381 -11.990
  948    HB2  LEU  43           HB1      LEU  43   8.757 -12.841 -10.640
  949    HB3  LEU  43           HB2      LEU  43   9.735 -14.344 -10.665
  950    HG   LEU  43           HG       LEU  43  10.507 -12.857 -12.367
  951   HD11  LEU  43          HD11      LEU  43  10.485 -14.335 -14.325
  952   HD12  LEU  43          HD12      LEU  43  10.592 -15.325 -12.822
  953   HD13  LEU  43          HD13      LEU  43   9.033 -15.204 -13.727
  954   HD21  LEU  43          HD21      LEU  43   9.230 -12.138 -14.338
  955   HD22  LEU  43          HD22      LEU  43   7.745 -12.944 -13.734
  956   HD23  LEU  43          HD23      LEU  43   8.441 -11.547 -12.832
  957    H    ILE  44           HN       ILE  44   7.859 -17.135 -10.802
  958    HA   ILE  44           HA       ILE  44   7.502 -17.046  -7.886
  959    HB   ILE  44           HB       ILE  44   7.484 -19.343  -9.896
  960   HG12  ILE  44          HG11      ILE  44   5.466 -17.821 -10.041
  961   HG13  ILE  44          HG12      ILE  44   5.140 -19.541  -9.693
  962   HG21  ILE  44          HG21      ILE  44   6.583 -20.715  -7.923
  963   HG22  ILE  44          HG22      ILE  44   8.299 -20.236  -7.753
  964   HG23  ILE  44          HG23      ILE  44   7.025 -19.350  -6.835
  965   HD11  ILE  44           HD1      ILE  44   3.782 -17.823  -8.300
  966   HD12  ILE  44           HD2      ILE  44   4.623 -19.111  -7.359
  967   HD13  ILE  44           HD3      ILE  44   5.317 -17.458  -7.438
  968    H    PHE  45           HN       PHE  45   9.266 -17.424  -6.580
  969    HA   PHE  45           HA       PHE  45  11.547 -18.897  -7.770
  970    HB2  PHE  45           HB1      PHE  45  12.202 -16.538  -7.070
  971    HB3  PHE  45           HB2      PHE  45  11.657 -16.931  -5.401
  972    HD1  PHE  45           HD1      PHE  45  13.645 -19.273  -7.684
  973    HD2  PHE  45           HD2      PHE  45  13.721 -16.532  -4.356
  974    HE1  PHE  45           HE1      PHE  45  15.964 -19.908  -7.205
  975    HE2  PHE  45           HE2      PHE  45  16.057 -17.184  -3.892
  976    HZ   PHE  45           HZ       PHE  45  17.188 -18.856  -5.320
  977    H    ALA  46           HN       ALA  46  11.752 -20.906  -6.960
  978    HA   ALA  46           HA       ALA  46  11.224 -22.767  -5.941
  979    HB1  ALA  46           HB1      ALA  46  12.565 -21.839  -4.101
  980    HB2  ALA  46           HB2      ALA  46  11.117 -21.059  -3.394
  981    HB3  ALA  46           HB3      ALA  46  11.236 -22.862  -3.450
  982    H    GLY  47           HN       GLY  47   9.091 -21.055  -3.725
  983    HA2  GLY  47           HA2      GLY  47   6.721 -21.802  -5.310
  984    HA3  GLY  47           HA1      GLY  47   6.835 -22.363  -3.604
  985    H    LYS  48           HN       LYS  48   8.315 -19.277  -4.181
  986    HA   LYS  48           HA       LYS  48   5.924 -17.981  -2.989
  987    HB2  LYS  48           HB1      LYS  48   8.075 -17.920  -1.614
  988    HB3  LYS  48           HB2      LYS  48   8.844 -17.043  -2.973
  989    HG2  LYS  48           HG1      LYS  48   6.881 -15.312  -2.713
  990    HG3  LYS  48           HG2      LYS  48   6.514 -16.116  -1.161
  991    HD2  LYS  48           HD1      LYS  48   8.744 -15.519  -0.293
  992    HD3  LYS  48           HD2      LYS  48   9.279 -14.914  -1.895
  993    HE2  LYS  48           HE1      LYS  48   6.928 -13.685  -0.282
  994    HE3  LYS  48           HE2      LYS  48   8.629 -13.074  -0.213
  995    HZ1  LYS  48           HZ1      LYS  48   7.122 -11.895  -1.745
  996    HZ2  LYS  48           HZ2      LYS  48   8.518 -12.418  -2.458
  997    HZ3  LYS  48           HZ3      LYS  48   7.043 -13.233  -2.767
  998    H    GLN  49           HN       GLN  49   4.876 -16.410  -4.224
  999    HA   GLN  49           HA       GLN  49   6.115 -15.579  -6.717
 1000    HB2  GLN  49           HB1      GLN  49   3.590 -16.073  -6.191
 1001    HB3  GLN  49           HB2      GLN  49   3.526 -14.361  -5.693
 1002    HG2  GLN  49           HG1      GLN  49   4.706 -15.247  -8.447
 1003    HG3  GLN  49           HG2      GLN  49   2.940 -15.149  -8.183
 1004   HE21  GLN  49          HE21      GLN  49   4.931 -11.703  -8.864
 1005   HE22  GLN  49          HE22      GLN  49   5.753 -13.243  -8.956
 1006    H    LEU  50           HN       LEU  50   6.928 -13.563  -7.192
 1007    HA   LEU  50           HA       LEU  50   8.138 -12.340  -4.888
 1008    HB2  LEU  50           HB1      LEU  50   8.513 -12.248  -7.891
 1009    HB3  LEU  50           HB2      LEU  50   9.310 -11.028  -6.855
 1010    HG   LEU  50           HG       LEU  50  10.556 -12.677  -5.620
 1011   HD11  LEU  50          HD11      LEU  50  10.625 -15.084  -6.208
 1012   HD12  LEU  50          HD12      LEU  50   9.041 -14.641  -5.505
 1013   HD13  LEU  50          HD13      LEU  50   9.200 -14.886  -7.286
 1014   HD21  LEU  50          HD21      LEU  50  11.985 -13.593  -7.463
 1015   HD22  LEU  50          HD22      LEU  50  10.690 -13.207  -8.659
 1016   HD23  LEU  50          HD23      LEU  50  11.505 -11.888  -7.741
 1017    H    GLU  51           HN       GLU  51   8.263 -10.140  -4.348
 1018    HA   GLU  51           HA       GLU  51   6.070  -8.418  -5.139
 1019    HB2  GLU  51           HB1      GLU  51   8.579  -7.875  -3.435
 1020    HB3  GLU  51           HB2      GLU  51   7.202  -6.758  -3.660
 1021    HG2  GLU  51           HG1      GLU  51   7.041  -7.657  -1.444
 1022    HG3  GLU  51           HG2      GLU  51   5.708  -8.386  -2.402
 1023    H    ASP  52           HN       ASP  52   6.783  -6.173  -5.924
 1024    HA   ASP  52           HA       ASP  52   8.115  -6.507  -8.363
 1025    HB2  ASP  52           HB1      ASP  52   7.367  -4.045  -8.514
 1026    HB3  ASP  52           HB2      ASP  52   6.095  -5.266  -8.226
 1027    H    GLY  53           HN       GLY  53   8.705  -3.602  -6.466
 1028    HA2  GLY  53           HA2      GLY  53  11.308  -3.330  -7.544
 1029    HA3  GLY  53           HA1      GLY  53  10.530  -2.305  -6.293
 1030    H    ARG  54           HN       ARG  54  11.448  -5.683  -6.146
 1031    HA   ARG  54           HA       ARG  54  13.523  -5.125  -4.099
 1032    HB2  ARG  54           HB1      ARG  54  11.716  -7.578  -4.515
 1033    HB3  ARG  54           HB2      ARG  54  13.142  -7.556  -3.423
 1034    HG2  ARG  54           HG1      ARG  54  12.066  -5.681  -2.101
 1035    HG3  ARG  54           HG2      ARG  54  10.621  -5.795  -3.161
 1036    HD2  ARG  54           HD1      ARG  54  10.167  -7.024  -1.071
 1037    HD3  ARG  54           HD2      ARG  54  10.341  -8.237  -2.415
 1038    HE   ARG  54           HE       ARG  54  12.951  -7.695  -1.174
 1039   HH11  ARG  54          HH11      ARG  54  10.714 -10.518   0.531
 1040   HH12  ARG  54          HH12      ARG  54   9.990  -9.653  -0.802
 1041   HH21  ARG  54          HH21      ARG  54  13.031 -10.468   0.760
 1042   HH22  ARG  54          HH22      ARG  54  13.872  -9.115   0.158
 1043    H    THR  55           HN       THR  55  15.536  -6.374  -4.435
 1044    HA   THR  55           HA       THR  55  15.900  -6.749  -7.301
 1045    HB   THR  55           HB       THR  55  18.329  -6.773  -6.846
 1046    HG1  THR  55           HG1      THR  55  19.042  -6.555  -4.820
 1047   HG21  THR  55          HG21      THR  55  18.472  -4.376  -6.204
 1048   HG22  THR  55          HG22      THR  55  17.115  -4.645  -7.357
 1049   HG23  THR  55          HG23      THR  55  16.776  -4.406  -5.598
 1050    H    LEU  56           HN       LEU  56  17.208  -8.501  -8.201
 1051    HA   LEU  56           HA       LEU  56  16.713 -11.077  -7.189
 1052    HB2  LEU  56           HB1      LEU  56  19.028 -10.125  -8.978
 1053    HB3  LEU  56           HB2      LEU  56  18.540 -11.833  -8.740
 1054    HG   LEU  56           HG       LEU  56  16.894  -9.610 -10.090
 1055   HD11  LEU  56          HD11      LEU  56  17.245 -11.018 -12.122
 1056   HD12  LEU  56          HD12      LEU  56  18.824 -10.554 -11.391
 1057   HD13  LEU  56          HD13      LEU  56  18.174 -12.215 -11.142
 1058   HD21  LEU  56          HD21      LEU  56  15.246 -11.399 -10.672
 1059   HD22  LEU  56          HD22      LEU  56  16.134 -12.566  -9.627
 1060   HD23  LEU  56          HD23      LEU  56  15.316 -11.133  -8.898
 1061    H    SER  57           HN       SER  57  19.294  -8.822  -6.339
 1062    HA   SER  57           HA       SER  57  20.848 -10.693  -4.851
 1063    HB2  SER  57           HB1      SER  57  21.734  -8.511  -3.698
 1064    HB3  SER  57           HB2      SER  57  22.111  -8.831  -5.425
 1065    HG   SER  57           HG1      SER  57  20.998  -7.167  -6.017
 1066    H    ASP  58           HN       ASP  58  18.213  -8.423  -3.800
 1067    HA   ASP  58           HA       ASP  58  18.121  -9.076  -1.113
 1068    HB2  ASP  58           HB1      ASP  58  16.982  -7.182  -2.296
 1069    HB3  ASP  58           HB2      ASP  58  15.953  -8.350  -3.187
 1070    H    TYR  59           HN       TYR  59  16.290 -10.671  -3.794
 1071    HA   TYR  59           HA       TYR  59  15.280 -12.724  -2.092
 1072    HB2  TYR  59           HB1      TYR  59  15.631 -12.586  -5.152
 1073    HB3  TYR  59           HB2      TYR  59  14.688 -13.881  -4.317
 1074    HD1  TYR  59           HD1      TYR  59  12.967 -12.864  -2.470
 1075    HD2  TYR  59           HD2      TYR  59  14.327 -10.915  -6.047
 1076    HE1  TYR  59           HE1      TYR  59  10.876 -11.501  -2.543
 1077    HE2  TYR  59           HE2      TYR  59  12.273  -9.539  -6.084
 1078    HH   TYR  59           HH       TYR  59  10.231  -9.238  -5.224
 1079    H    ASN  60           HN       ASN  60  18.474 -12.435  -3.105
 1080    HA   ASN  60           HA       ASN  60  20.170 -13.741  -3.524
 1081    HB2  ASN  60           HB1      ASN  60  19.656 -14.443  -1.179
 1082    HB3  ASN  60           HB2      ASN  60  18.751 -15.857  -1.826
 1083   HD21  ASN  60          HD21      ASN  60  21.728 -17.736  -2.022
 1084   HD22  ASN  60          HD22      ASN  60  19.985 -17.692  -1.901
 1085    H    ILE  61           HN       ILE  61  18.491 -13.609  -5.635
 1086    HA   ILE  61           HA       ILE  61  18.453 -16.272  -6.898
 1087    HB   ILE  61           HB       ILE  61  17.476 -13.543  -7.825
 1088   HG12  ILE  61          HG11      ILE  61  15.883 -16.093  -7.155
 1089   HG13  ILE  61          HG12      ILE  61  16.185 -14.805  -5.959
 1090   HG21  ILE  61          HG21      ILE  61  16.498 -14.790  -9.787
 1091   HG22  ILE  61          HG22      ILE  61  18.276 -14.974  -9.781
 1092   HG23  ILE  61          HG23      ILE  61  17.229 -16.318  -9.188
 1093   HD11  ILE  61           HD1      ILE  61  13.947 -14.512  -6.964
 1094   HD12  ILE  61           HD2      ILE  61  15.007 -13.127  -7.412
 1095   HD13  ILE  61           HD3      ILE  61  14.652 -14.414  -8.619
 1096    H    GLN  62           HN       GLN  62  20.677 -16.631  -6.894
 1097    HA   GLN  62           HA       GLN  62  22.369 -14.751  -8.397
 1098    HB2  GLN  62           HB1      GLN  62  23.170 -17.244  -6.806
 1099    HB3  GLN  62           HB2      GLN  62  24.283 -16.049  -7.572
 1100    HG2  GLN  62           HG1      GLN  62  23.220 -14.230  -6.082
 1101    HG3  GLN  62           HG2      GLN  62  22.394 -15.553  -5.181
 1102   HE21  GLN  62          HE21      GLN  62  25.296 -15.644  -3.145
 1103   HE22  GLN  62          HE22      GLN  62  23.560 -15.417  -3.222
 1104    H    LYS  63           HN       LYS  63  24.292 -16.711  -9.333
 1105    HA   LYS  63           HA       LYS  63  23.083 -17.235 -11.829
 1106    HB2  LYS  63           HB1      LYS  63  25.226 -18.190 -12.491
 1107    HB3  LYS  63           HB2      LYS  63  25.478 -16.659 -11.581
 1108    HG2  LYS  63           HG1      LYS  63  26.014 -18.051  -9.495
 1109    HG3  LYS  63           HG2      LYS  63  25.762 -19.518 -10.487
 1110    HD2  LYS  63           HD1      LYS  63  27.552 -18.431 -12.128
 1111    HD3  LYS  63           HD2      LYS  63  27.977 -17.401 -10.720
 1112    HE2  LYS  63           HE1      LYS  63  29.510 -19.308 -10.773
 1113    HE3  LYS  63           HE2      LYS  63  28.386 -19.594  -9.376
 1114    HZ1  LYS  63           HZ1      LYS  63  28.777 -21.520 -11.126
 1115    HZ2  LYS  63           HZ2      LYS  63  27.194 -21.206 -10.634
 1116    HZ3  LYS  63           HZ3      LYS  63  27.622 -20.653 -12.036
 1117    H    GLU  64           HN       GLU  64  22.781 -19.166 -12.962
 1118    HA   GLU  64           HA       GLU  64  21.884 -21.086 -13.345
 1119    HB2  GLU  64           HB1      GLU  64  23.237 -22.181 -10.845
 1120    HB3  GLU  64           HB2      GLU  64  22.364 -23.144 -12.073
 1121    HG2  GLU  64           HG1      GLU  64  24.476 -23.455 -12.882
 1122    HG3  GLU  64           HG2      GLU  64  24.068 -21.974 -13.819
 1123    H    SER  65           HN       SER  65  20.704 -19.216 -10.974
 1124    HA   SER  65           HA       SER  65  18.822 -20.834  -9.711
 1125    HB2  SER  65           HB1      SER  65  18.514 -17.864 -10.424
 1126    HB3  SER  65           HB2      SER  65  17.449 -18.772  -9.283
 1127    HG   SER  65           HG1      SER  65  20.141 -18.012  -9.026
 1128    H    THR  66           HN       THR  66  17.047 -21.871 -10.348
 1129    HA   THR  66           HA       THR  66  15.803 -21.174 -12.910
 1130    HB   THR  66           HB       THR  66  15.186 -23.472 -11.018
 1131    HG1  THR  66           HG1      THR  66  17.164 -23.494 -12.306
 1132   HG21  THR  66          HG21      THR  66  13.854 -24.298 -13.035
 1133   HG22  THR  66          HG22      THR  66  13.127 -22.818 -12.322
 1134   HG23  THR  66          HG23      THR  66  14.110 -22.699 -13.826
 1135    H    LEU  67           HN       LEU  67  14.308 -19.635 -12.961
 1136    HA   LEU  67           HA       LEU  67  12.479 -19.320 -10.643
 1137    HB2  LEU  67           HB1      LEU  67  12.802 -17.449 -13.059
 1138    HB3  LEU  67           HB2      LEU  67  11.776 -17.182 -11.608
 1139    HG   LEU  67           HG       LEU  67  14.848 -17.185 -11.756
 1140   HD11  LEU  67          HD11      LEU  67  14.591 -14.797 -11.075
 1141   HD12  LEU  67          HD12      LEU  67  13.695 -15.113 -12.603
 1142   HD13  LEU  67          HD13      LEU  67  12.798 -14.976 -11.048
 1143   HD21  LEU  67          HD21      LEU  67  14.779 -16.537  -9.323
 1144   HD22  LEU  67          HD22      LEU  67  13.012 -16.887  -9.288
 1145   HD23  LEU  67          HD23      LEU  67  14.206 -18.209  -9.599
 1146    H    HIS  68           HN       HIS  68  10.157 -19.173 -11.155
 1147    HA   HIS  68           HA       HIS  68   9.479 -20.468 -13.753
 1148    HB2  HIS  68           HB1      HIS  68   8.141 -20.915 -11.049
 1149    HB3  HIS  68           HB2      HIS  68   7.478 -21.469 -12.629
 1150    HD2  HIS  68           HD2      HIS  68  10.137 -22.557  -9.975
 1151    HE1  HIS  68           HE1      HIS  68  10.279 -25.186 -13.302
 1152    HE2  HIS  68           HE2      HIS  68  11.045 -24.796 -10.895
 1153    H    LEU  69           HN       LEU  69   8.542 -19.090 -15.046
 1154    HA   LEU  69           HA       LEU  69   7.034 -16.800 -14.064
 1155    HB2  LEU  69           HB1      LEU  69   8.728 -16.461 -15.821
 1156    HB3  LEU  69           HB2      LEU  69   8.036 -17.792 -16.792
 1157    HG   LEU  69           HG       LEU  69   5.946 -16.445 -17.160
 1158   HD11  LEU  69          HD11      LEU  69   5.895 -14.061 -16.601
 1159   HD12  LEU  69          HD12      LEU  69   6.060 -14.997 -15.081
 1160   HD13  LEU  69          HD13      LEU  69   7.497 -14.153 -15.781
 1161   HD21  LEU  69          HD21      LEU  69   6.974 -14.789 -18.721
 1162   HD22  LEU  69          HD22      LEU  69   8.571 -15.015 -17.926
 1163   HD23  LEU  69          HD23      LEU  69   7.812 -16.386 -18.816
 1164    H    VAL  70           HN       VAL  70   4.870 -16.816 -13.878
 1165    HA   VAL  70           HA       VAL  70   3.341 -18.494 -15.769
 1166    HB   VAL  70           HB       VAL  70   1.544 -18.798 -14.196
 1167   HG11  VAL  70          HG11      VAL  70   2.692 -20.337 -12.613
 1168   HG12  VAL  70          HG12      VAL  70   3.464 -20.449 -14.236
 1169   HG13  VAL  70          HG13      VAL  70   4.266 -19.537 -12.904
 1170   HG21  VAL  70          HG21      VAL  70   1.777 -18.084 -11.801
 1171   HG22  VAL  70          HG22      VAL  70   3.312 -17.229 -12.185
 1172   HG23  VAL  70          HG23      VAL  70   1.746 -16.666 -12.889
 1173    H    LEU  71           HN       LEU  71   1.005 -17.424 -16.035
 1174    HA   LEU  71           HA       LEU  71   1.443 -14.514 -16.204
 1175    HB2  LEU  71           HB1      LEU  71  -0.051 -16.279 -18.217
 1176    HB3  LEU  71           HB2      LEU  71   0.182 -14.500 -18.317
 1177    HG   LEU  71           HG       LEU  71   2.415 -16.620 -18.488
 1178   HD11  LEU  71          HD11      LEU  71   2.515 -15.981 -20.900
 1179   HD12  LEU  71          HD12      LEU  71   0.887 -16.634 -20.471
 1180   HD13  LEU  71          HD13      LEU  71   1.125 -14.857 -20.672
 1181   HD21  LEU  71          HD21      LEU  71   3.849 -14.698 -19.265
 1182   HD22  LEU  71          HD22      LEU  71   2.509 -13.553 -18.869
 1183   HD23  LEU  71          HD23      LEU  71   3.309 -14.499 -17.566
 1184    H    ARG  72           HN       ARG  72  -0.008 -13.345 -15.061
 1185    HA   ARG  72           HA       ARG  72  -2.697 -13.656 -15.343
 1186    HB2  ARG  72           HB1      ARG  72  -2.883 -15.558 -13.969
 1187    HB3  ARG  72           HB2      ARG  72  -1.627 -14.966 -12.841
 1188    HG2  ARG  72           HG1      ARG  72  -4.053 -15.079 -11.987
 1189    HG3  ARG  72           HG2      ARG  72  -3.060 -13.628 -11.640
 1190    HD2  ARG  72           HD1      ARG  72  -5.467 -13.106 -12.099
 1191    HD3  ARG  72           HD2      ARG  72  -4.342 -12.217 -13.152
 1192    HE   ARG  72           HE       ARG  72  -6.040 -14.628 -13.960
 1193   HH11  ARG  72          HH11      ARG  72  -4.901 -11.859 -16.585
 1194   HH12  ARG  72          HH12      ARG  72  -4.086 -11.871 -15.095
 1195   HH21  ARG  72          HH21      ARG  72  -6.552 -13.402 -17.032
 1196   HH22  ARG  72          HH22      ARG  72  -6.954 -14.573 -15.790