NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage program type subtype
396457 1shi 275 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   ALA A   1       4.066  -0.569   6.171  1.00  0.00      A       
ATOM      2  CA  ALA A   1       5.000  -1.464   6.989  1.00  0.00      A       
ATOM      3  CB  ALA A   1       6.311  -1.664   6.226  1.00  0.00      A       
ATOM      4  HT1 ALA A   1       3.348  -2.641   7.459  1.00  0.00      A       
ATOM      5  HT2 ALA A   1       4.418  -3.359   6.352  1.00  0.00      A       
ATOM      6  HT3 ALA A   1       4.829  -3.279   7.995  1.00  0.00      A       
ATOM      7  HA  ALA A   1       5.204  -0.995   7.940  1.00  0.00      A       
ATOM      8  HB1 ALA A   1       6.235  -2.545   5.605  1.00  0.00      A       
ATOM      9  HB2 ALA A   1       6.502  -0.801   5.606  1.00  0.00      A       
ATOM     10  HB3 ALA A   1       7.121  -1.789   6.930  1.00  0.00      A       
ATOM     11  N   ALA A   1       4.350  -2.785   7.216  1.00  0.00      A       
ATOM     12  O   ALA A   1       4.116  -0.548   4.957  1.00  0.00      A       
ATOM     13  C   ALA A   2       3.039   1.790   4.974  1.00  0.00      A       
ATOM     14  CA  ALA A   2       2.277   1.062   6.084  1.00  0.00      A       
ATOM     15  CB  ALA A   2       1.678   2.088   7.049  1.00  0.00      A       
ATOM     16  HN  ALA A   2       3.188   0.139   7.805  1.00  0.00      A       
ATOM     17  HA  ALA A   2       1.485   0.471   5.649  1.00  0.00      A       
ATOM     18  HB1 ALA A   2       2.184   2.025   8.001  1.00  0.00      A       
ATOM     19  HB2 ALA A   2       1.801   3.080   6.641  1.00  0.00      A       
ATOM     20  HB3 ALA A   2       0.627   1.882   7.185  1.00  0.00      A       
ATOM     21  N   ALA A   2       3.213   0.170   6.825  1.00  0.00      A       
ATOM     22  O   ALA A   2       4.126   2.293   5.181  1.00  0.00      A       
ATOM     23  C   CYS A   3       2.149   3.304   1.834  1.00  0.00      A       
ATOM     24  CA  CYS A   3       3.174   2.542   2.676  1.00  0.00      A       
ATOM     25  CB  CYS A   3       3.884   1.508   1.800  1.00  0.00      A       
ATOM     26  HN  CYS A   3       1.603   1.435   3.650  1.00  0.00      A       
ATOM     27  HA  CYS A   3       3.899   3.235   3.075  1.00  0.00      A       
ATOM     28  HB2 CYS A   3       4.516   2.014   1.086  1.00  0.00      A       
ATOM     29  HB1 CYS A   3       4.489   0.864   2.422  1.00  0.00      A       
ATOM     30  N   CYS A   3       2.479   1.848   3.797  1.00  0.00      A       
ATOM     31  O   CYS A   3       2.451   3.789   0.761  1.00  0.00      A       
ATOM     32  SG  CYS A   3       2.652   0.512   0.919  1.00  0.00      A       
ATOM     33  C   LYS A   4      -0.280   3.475   0.167  1.00  0.00      A       
ATOM     34  CA  LYS A   4      -0.102   4.144   1.531  1.00  0.00      A       
ATOM     35  CB  LYS A   4       0.335   5.597   1.334  1.00  0.00      A       
ATOM     36  CD  LYS A   4      -0.751   7.841   1.154  1.00  0.00      A       
ATOM     37  CE  LYS A   4      -1.056   7.540  -0.315  1.00  0.00      A       
ATOM     38  CG  LYS A   4      -0.710   6.532   1.946  1.00  0.00      A       
ATOM     39  HN  LYS A   4       0.714   3.015   3.175  1.00  0.00      A       
ATOM     40  HA  LYS A   4      -1.038   4.119   2.070  1.00  0.00      A       
ATOM     41  HB2 LYS A   4       1.288   5.755   1.818  1.00  0.00      A       
ATOM     42  HB1 LYS A   4       0.428   5.805   0.279  1.00  0.00      A       
ATOM     43  HD2 LYS A   4      -1.520   8.482   1.559  1.00  0.00      A       
ATOM     44  HD1 LYS A   4       0.206   8.336   1.226  1.00  0.00      A       
ATOM     45  HE2 LYS A   4      -1.275   6.489  -0.429  1.00  0.00      A       
ATOM     46  HE1 LYS A   4      -1.909   8.122  -0.632  1.00  0.00      A       
ATOM     47  HG2 LYS A   4      -1.680   6.059   1.911  1.00  0.00      A       
ATOM     48  HG1 LYS A   4      -0.448   6.743   2.972  1.00  0.00      A       
ATOM     49  HZ1 LYS A   4       0.616   8.710  -0.731  1.00  0.00      A       
ATOM     50  HZ2 LYS A   4       0.776   7.086  -1.194  1.00  0.00      A       
ATOM     51  HZ3 LYS A   4      -0.191   8.138  -2.112  1.00  0.00      A       
ATOM     52  N   LYS A   4       0.939   3.414   2.309  1.00  0.00      A       
ATOM     53  NZ  LYS A   4       0.125   7.895  -1.151  1.00  0.00      A       
ATOM     54  O   LYS A   4       0.464   2.588  -0.202  1.00  0.00      A       
ATOM     55  C   CYS A   5      -0.494   3.875  -2.931  1.00  0.00      A       
ATOM     56  CA  CYS A   5      -1.483   3.279  -1.926  1.00  0.00      A       
ATOM     57  CB  CYS A   5      -2.913   3.564  -2.387  1.00  0.00      A       
ATOM     58  HN  CYS A   5      -1.849   4.610  -0.271  1.00  0.00      A       
ATOM     59  HA  CYS A   5      -1.331   2.212  -1.862  1.00  0.00      A       
ATOM     60  HB2 CYS A   5      -3.610   3.157  -1.669  1.00  0.00      A       
ATOM     61  HB1 CYS A   5      -3.060   4.631  -2.466  1.00  0.00      A       
ATOM     62  N   CYS A   5      -1.260   3.893  -0.586  1.00  0.00      A       
ATOM     63  O   CYS A   5       0.031   4.953  -2.734  1.00  0.00      A       
ATOM     64  SG  CYS A   5      -3.192   2.794  -4.006  1.00  0.00      A       
ATOM     65  C   ASP A   6       0.280   5.111  -5.453  1.00  0.00      A       
ATOM     66  CA  ASP A   6       0.717   3.710  -5.022  1.00  0.00      A       
ATOM     67  CB  ASP A   6       0.731   2.783  -6.239  1.00  0.00      A       
ATOM     68  CG  ASP A   6       2.066   2.923  -6.974  1.00  0.00      A       
ATOM     69  HN  ASP A   6      -0.671   2.315  -4.146  1.00  0.00      A       
ATOM     70  HA  ASP A   6       1.708   3.758  -4.594  1.00  0.00      A       
ATOM     71  HB2 ASP A   6       0.605   1.760  -5.913  1.00  0.00      A       
ATOM     72  HB1 ASP A   6      -0.074   3.051  -6.905  1.00  0.00      A       
ATOM     73  N   ASP A   6      -0.237   3.182  -4.006  1.00  0.00      A       
ATOM     74  O   ASP A   6       1.079   5.913  -5.895  1.00  0.00      A       
ATOM     75  OD1 ASP A   6       3.084   2.992  -6.305  1.00  0.00      A       
ATOM     76  OD2 ASP A   6       2.047   2.960  -8.193  1.00  0.00      A       
ATOM     77  C   ASP A   7      -2.875   6.990  -5.171  1.00  0.00      A       
ATOM     78  CA  ASP A   7      -1.470   6.763  -5.733  1.00  0.00      A       
ATOM     79  CB  ASP A   7      -1.510   6.855  -7.260  1.00  0.00      A       
ATOM     80  CG  ASP A   7      -2.273   5.655  -7.824  1.00  0.00      A       
ATOM     81  HN  ASP A   7      -1.613   4.753  -4.971  1.00  0.00      A       
ATOM     82  HA  ASP A   7      -0.801   7.517  -5.345  1.00  0.00      A       
ATOM     83  HB2 ASP A   7      -2.007   7.768  -7.552  1.00  0.00      A       
ATOM     84  HB1 ASP A   7      -0.502   6.852  -7.647  1.00  0.00      A       
ATOM     85  N   ASP A   7      -0.984   5.413  -5.329  1.00  0.00      A       
ATOM     86  O   ASP A   7      -3.846   7.029  -5.901  1.00  0.00      A       
ATOM     87  OD1 ASP A   7      -2.812   4.896  -7.035  1.00  0.00      A       
ATOM     88  OD2 ASP A   7      -2.306   5.515  -9.036  1.00  0.00      A       
ATOM     89  C   GLU A   8      -4.652   8.862  -3.276  1.00  0.00      A       
ATOM     90  CA  GLU A   8      -4.335   7.365  -3.275  1.00  0.00      A       
ATOM     91  CB  GLU A   8      -4.340   6.844  -1.836  1.00  0.00      A       
ATOM     92  CD  GLU A   8      -6.482   5.926  -0.934  1.00  0.00      A       
ATOM     93  CG  GLU A   8      -5.227   5.601  -1.746  1.00  0.00      A       
ATOM     94  HN  GLU A   8      -2.197   7.105  -3.309  1.00  0.00      A       
ATOM     95  HA  GLU A   8      -5.082   6.838  -3.850  1.00  0.00      A       
ATOM     96  HB2 GLU A   8      -3.332   6.591  -1.541  1.00  0.00      A       
ATOM     97  HB1 GLU A   8      -4.727   7.608  -1.178  1.00  0.00      A       
ATOM     98  HG2 GLU A   8      -5.511   5.289  -2.740  1.00  0.00      A       
ATOM     99  HG1 GLU A   8      -4.683   4.805  -1.260  1.00  0.00      A       
ATOM    100  N   GLU A   8      -2.992   7.140  -3.880  1.00  0.00      A       
ATOM    101  O   GLU A   8      -5.758   9.273  -2.985  1.00  0.00      A       
ATOM    102  OE1 GLU A   8      -6.975   7.035  -1.061  1.00  0.00      A       
ATOM    103  OE2 GLU A   8      -6.929   5.061  -0.199  1.00  0.00      A       
ATOM    104  C   GLY A   9      -2.599  11.895  -3.637  1.00  0.00      A       
ATOM    105  CA  GLY A   9      -3.937  11.151  -3.622  1.00  0.00      A       
ATOM    106  HN  GLY A   9      -2.805   9.331  -3.834  1.00  0.00      A       
ATOM    107  HA2 GLY A   9      -4.505  11.408  -4.505  1.00  0.00      A       
ATOM    108  HA1 GLY A   9      -4.493  11.435  -2.741  1.00  0.00      A       
ATOM    109  N   GLY A   9      -3.690   9.682  -3.602  1.00  0.00      A       
ATOM    110  O   GLY A   9      -1.551  11.281  -3.664  1.00  0.00      A       
ATOM    111  C   PRO A  10      -0.873  14.184  -2.225  1.00  0.00      A       
ATOM    112  CA  PRO A  10      -1.475  14.076  -3.631  1.00  0.00      A       
ATOM    113  CB  PRO A  10      -2.052  15.411  -4.091  1.00  0.00      A       
ATOM    114  CD  PRO A  10      -3.975  13.937  -3.587  1.00  0.00      A       
ATOM    115  CG  PRO A  10      -3.544  15.402  -3.747  1.00  0.00      A       
ATOM    116  HA  PRO A  10      -0.745  13.721  -4.339  1.00  0.00      A       
ATOM    117  HB2 PRO A  10      -1.557  16.223  -3.575  1.00  0.00      A       
ATOM    118  HB1 PRO A  10      -1.926  15.520  -5.157  1.00  0.00      A       
ATOM    119  HD2 PRO A  10      -4.479  13.791  -2.640  1.00  0.00      A       
ATOM    120  HD1 PRO A  10      -4.600  13.629  -4.409  1.00  0.00      A       
ATOM    121  HG2 PRO A  10      -3.710  15.940  -2.824  1.00  0.00      A       
ATOM    122  HG1 PRO A  10      -4.108  15.859  -4.546  1.00  0.00      A       
ATOM    123  N   PRO A  10      -2.678  13.201  -3.619  1.00  0.00      A       
ATOM    124  O   PRO A  10      -0.041  13.389  -1.835  1.00  0.00      A       
ATOM    125  C   ASP A  11       0.778  15.105  -0.111  1.00  0.00      A       
ATOM    126  CA  ASP A  11      -0.737  15.316  -0.085  1.00  0.00      A       
ATOM    127  CB  ASP A  11      -1.379  14.280   0.841  1.00  0.00      A       
ATOM    128  CG  ASP A  11      -2.902  14.355   0.714  1.00  0.00      A       
ATOM    129  HN  ASP A  11      -1.959  15.791  -1.794  1.00  0.00      A       
ATOM    130  HA  ASP A  11      -0.956  16.309   0.280  1.00  0.00      A       
ATOM    131  HB2 ASP A  11      -1.042  13.292   0.563  1.00  0.00      A       
ATOM    132  HB1 ASP A  11      -1.095  14.484   1.862  1.00  0.00      A       
ATOM    133  N   ASP A  11      -1.287  15.161  -1.462  1.00  0.00      A       
ATOM    134  O   ASP A  11       1.421  15.283  -1.127  1.00  0.00      A       
ATOM    135  OD1 ASP A  11      -3.394  15.405   0.335  1.00  0.00      A       
ATOM    136  OD2 ASP A  11      -3.550  13.361   0.998  1.00  0.00      A       
ATOM    137  C   ILE A  12       3.265  14.270   2.483  1.00  0.00      A       
ATOM    138  CA  ILE A  12       2.824  14.503   1.037  1.00  0.00      A       
ATOM    139  CB  ILE A  12       3.543  15.732   0.474  1.00  0.00      A       
ATOM    140  CD1 ILE A  12       5.840  15.818  -0.507  1.00  0.00      A       
ATOM    141  CG1 ILE A  12       5.038  15.634   0.783  1.00  0.00      A       
ATOM    142  CG2 ILE A  12       2.972  16.998   1.117  1.00  0.00      A       
ATOM    143  HN  ILE A  12       0.814  14.588   1.805  1.00  0.00      A       
ATOM    144  HA  ILE A  12       3.073  13.637   0.441  1.00  0.00      A       
ATOM    145  HB  ILE A  12       3.396  15.775  -0.596  1.00  0.00      A       
ATOM    146 HD11 ILE A  12       5.207  16.258  -1.264  1.00  0.00      A       
ATOM    147 HD12 ILE A  12       6.681  16.468  -0.319  1.00  0.00      A       
ATOM    148 HD13 ILE A  12       6.196  14.857  -0.849  1.00  0.00      A       
ATOM    149 HG12 ILE A  12       5.311  16.405   1.490  1.00  0.00      A       
ATOM    150 HG11 ILE A  12       5.257  14.665   1.205  1.00  0.00      A       
ATOM    151 HG21 ILE A  12       1.924  16.852   1.331  1.00  0.00      A       
ATOM    152 HG22 ILE A  12       3.502  17.206   2.035  1.00  0.00      A       
ATOM    153 HG23 ILE A  12       3.088  17.830   0.438  1.00  0.00      A       
ATOM    154  N   ILE A  12       1.352  14.727   0.997  1.00  0.00      A       
ATOM    155  O   ILE A  12       3.926  13.298   2.792  1.00  0.00      A       
ATOM    156  C   ARG A  13       2.217  14.182   5.533  1.00  0.00      A       
ATOM    157  CA  ARG A  13       3.297  14.979   4.799  1.00  0.00      A       
ATOM    158  CB  ARG A  13       3.454  16.352   5.456  1.00  0.00      A       
ATOM    159  CD  ARG A  13       1.937  17.902   6.697  1.00  0.00      A       
ATOM    160  CG  ARG A  13       2.118  17.096   5.409  1.00  0.00      A       
ATOM    161  CZ  ARG A  13       0.101  19.418   7.145  1.00  0.00      A       
ATOM    162  HN  ARG A  13       2.366  15.927   3.106  1.00  0.00      A       
ATOM    163  HA  ARG A  13       4.235  14.445   4.851  1.00  0.00      A       
ATOM    164  HB2 ARG A  13       3.761  16.225   6.485  1.00  0.00      A       
ATOM    165  HB1 ARG A  13       4.201  16.922   4.925  1.00  0.00      A       
ATOM    166  HD2 ARG A  13       1.420  17.299   7.429  1.00  0.00      A       
ATOM    167  HD1 ARG A  13       2.905  18.186   7.083  1.00  0.00      A       
ATOM    168  HE  ARG A  13       1.393  19.713   5.666  1.00  0.00      A       
ATOM    169  HG2 ARG A  13       2.109  17.765   4.561  1.00  0.00      A       
ATOM    170  HG1 ARG A  13       1.312  16.385   5.316  1.00  0.00      A       
ATOM    171 HH11 ARG A  13       0.927  18.749   8.842  1.00  0.00      A       
ATOM    172 HH12 ARG A  13      -0.676  19.388   8.990  1.00  0.00      A       
ATOM    173 HH21 ARG A  13      -0.967  20.154   5.621  1.00  0.00      A       
ATOM    174 HH22 ARG A  13      -1.748  20.184   7.166  1.00  0.00      A       
ATOM    175  N   ARG A  13       2.902  15.152   3.374  1.00  0.00      A       
ATOM    176  NE  ARG A  13       1.139  19.127   6.409  1.00  0.00      A       
ATOM    177  NH1 ARG A  13       0.118  19.165   8.425  1.00  0.00      A       
ATOM    178  NH2 ARG A  13      -0.953  19.961   6.602  1.00  0.00      A       
ATOM    179  O   ARG A  13       2.444  13.645   6.598  1.00  0.00      A       
ATOM    180  C   THR A  14      -0.506  12.197   4.733  1.00  0.00      A       
ATOM    181  CA  THR A  14      -0.053  13.345   5.638  1.00  0.00      A       
ATOM    182  CB  THR A  14      -1.234  14.281   5.904  1.00  0.00      A       
ATOM    183  CG2 THR A  14      -1.801  14.781   4.575  1.00  0.00      A       
ATOM    184  HN  THR A  14       0.878  14.547   4.112  1.00  0.00      A       
ATOM    185  HA  THR A  14       0.307  12.945   6.574  1.00  0.00      A       
ATOM    186  HB  THR A  14      -0.901  15.125   6.488  1.00  0.00      A       
ATOM    187  HG1 THR A  14      -1.924  13.431   7.512  1.00  0.00      A       
ATOM    188 HG21 THR A  14      -1.311  14.270   3.759  1.00  0.00      A       
ATOM    189 HG22 THR A  14      -2.862  14.582   4.539  1.00  0.00      A       
ATOM    190 HG23 THR A  14      -1.631  15.844   4.488  1.00  0.00      A       
ATOM    191  N   THR A  14       1.041  14.104   4.971  1.00  0.00      A       
ATOM    192  O   THR A  14      -0.032  12.041   3.626  1.00  0.00      A       
ATOM    193  OG1 THR A  14      -2.242  13.578   6.618  1.00  0.00      A       
ATOM    194  C   ALA A  15      -2.720   9.296   5.246  1.00  0.00      A       
ATOM    195  CA  ALA A  15      -1.909  10.255   4.368  1.00  0.00      A       
ATOM    196  CB  ALA A  15      -0.713   9.511   3.770  1.00  0.00      A       
ATOM    197  HN  ALA A  15      -1.793  11.537   6.094  1.00  0.00      A       
ATOM    198  HA  ALA A  15      -2.534  10.632   3.572  1.00  0.00      A       
ATOM    199  HB1 ALA A  15       0.147   9.641   4.410  1.00  0.00      A       
ATOM    200  HB2 ALA A  15      -0.947   8.460   3.689  1.00  0.00      A       
ATOM    201  HB3 ALA A  15      -0.496   9.908   2.789  1.00  0.00      A       
ATOM    202  N   ALA A  15      -1.423  11.393   5.198  1.00  0.00      A       
ATOM    203  O   ALA A  15      -2.431   9.137   6.415  1.00  0.00      A       
ATOM    204  C   PRO A  16      -3.966   6.341   5.432  1.00  0.00      A       
ATOM    205  CA  PRO A  16      -4.604   7.726   5.360  1.00  0.00      A       
ATOM    206  CB  PRO A  16      -5.840   7.714   4.470  1.00  0.00      A       
ATOM    207  CD  PRO A  16      -4.060   8.896   3.217  1.00  0.00      A       
ATOM    208  CG  PRO A  16      -5.396   8.152   3.071  1.00  0.00      A       
ATOM    209  HA  PRO A  16      -4.852   8.082   6.341  1.00  0.00      A       
ATOM    210  HB2 PRO A  16      -6.254   6.716   4.432  1.00  0.00      A       
ATOM    211  HB1 PRO A  16      -6.575   8.405   4.850  1.00  0.00      A       
ATOM    212  HD2 PRO A  16      -3.309   8.460   2.571  1.00  0.00      A       
ATOM    213  HD1 PRO A  16      -4.183   9.948   3.011  1.00  0.00      A       
ATOM    214  HG2 PRO A  16      -5.268   7.284   2.439  1.00  0.00      A       
ATOM    215  HG1 PRO A  16      -6.133   8.813   2.642  1.00  0.00      A       
ATOM    216  N   PRO A  16      -3.715   8.687   4.652  1.00  0.00      A       
ATOM    217  O   PRO A  16      -4.619   5.361   5.732  1.00  0.00      A       
ATOM    218  C   LEU A  17      -2.894   3.874   4.552  1.00  0.00      A       
ATOM    219  CA  LEU A  17      -2.017   4.936   5.218  1.00  0.00      A       
ATOM    220  CB  LEU A  17      -1.765   4.550   6.677  1.00  0.00      A       
ATOM    221  CD1 LEU A  17      -0.068   6.349   7.028  1.00  0.00      A       
ATOM    222  CD2 LEU A  17      -0.007   4.282   8.430  1.00  0.00      A       
ATOM    223  CG  LEU A  17      -0.307   4.838   7.036  1.00  0.00      A       
ATOM    224  HN  LEU A  17      -2.191   7.055   4.926  1.00  0.00      A       
ATOM    225  HA  LEU A  17      -1.081   5.007   4.699  1.00  0.00      A       
ATOM    226  HB2 LEU A  17      -2.416   5.125   7.319  1.00  0.00      A       
ATOM    227  HB1 LEU A  17      -1.966   3.497   6.811  1.00  0.00      A       
ATOM    228 HD11 LEU A  17      -0.897   6.842   6.543  1.00  0.00      A       
ATOM    229 HD12 LEU A  17       0.018   6.705   8.044  1.00  0.00      A       
ATOM    230 HD13 LEU A  17       0.844   6.566   6.492  1.00  0.00      A       
ATOM    231 HD21 LEU A  17      -0.709   3.495   8.662  1.00  0.00      A       
ATOM    232 HD22 LEU A  17       0.997   3.886   8.451  1.00  0.00      A       
ATOM    233 HD23 LEU A  17      -0.099   5.073   9.160  1.00  0.00      A       
ATOM    234  HG  LEU A  17       0.342   4.367   6.311  1.00  0.00      A       
ATOM    235  N   LEU A  17      -2.698   6.253   5.164  1.00  0.00      A       
ATOM    236  O   LEU A  17      -3.250   2.881   5.156  1.00  0.00      A       
ATOM    237  C   THR A  18      -3.204   2.024   1.939  1.00  0.00      A       
ATOM    238  CA  THR A  18      -4.096   3.072   2.609  1.00  0.00      A       
ATOM    239  CB  THR A  18      -4.942   3.778   1.548  1.00  0.00      A       
ATOM    240  CG2 THR A  18      -6.177   4.396   2.206  1.00  0.00      A       
ATOM    241  HN  THR A  18      -2.946   4.879   2.841  1.00  0.00      A       
ATOM    242  HA  THR A  18      -4.745   2.588   3.324  1.00  0.00      A       
ATOM    243  HB  THR A  18      -5.257   3.063   0.803  1.00  0.00      A       
ATOM    244  HG1 THR A  18      -3.639   4.393   0.242  1.00  0.00      A       
ATOM    245 HG21 THR A  18      -6.230   4.082   3.237  1.00  0.00      A       
ATOM    246 HG22 THR A  18      -6.108   5.473   2.160  1.00  0.00      A       
ATOM    247 HG23 THR A  18      -7.064   4.070   1.684  1.00  0.00      A       
ATOM    248  N   THR A  18      -3.244   4.072   3.311  1.00  0.00      A       
ATOM    249  O   THR A  18      -3.598   1.376   0.990  1.00  0.00      A       
ATOM    250  OG1 THR A  18      -4.170   4.798   0.931  1.00  0.00      A       
ATOM    251  C   GLY A  19      -0.547  -0.078   2.905  1.00  0.00      A       
ATOM    252  CA  GLY A  19      -1.090   0.847   1.815  1.00  0.00      A       
ATOM    253  HN  GLY A  19      -1.706   2.386   3.192  1.00  0.00      A       
ATOM    254  HA2 GLY A  19      -1.633   0.265   1.083  1.00  0.00      A       
ATOM    255  HA1 GLY A  19      -0.267   1.353   1.335  1.00  0.00      A       
ATOM    256  N   GLY A  19      -2.005   1.853   2.425  1.00  0.00      A       
ATOM    257  O   GLY A  19      -0.259   0.346   4.006  1.00  0.00      A       
ATOM    258  C   THR A  20       1.238  -3.135   3.012  1.00  0.00      A       
ATOM    259  CA  THR A  20       0.119  -2.292   3.628  1.00  0.00      A       
ATOM    260  CB  THR A  20      -1.011  -3.211   4.098  1.00  0.00      A       
ATOM    261  CG2 THR A  20      -0.546  -4.015   5.313  1.00  0.00      A       
ATOM    262  HN  THR A  20      -0.644  -1.664   1.714  1.00  0.00      A       
ATOM    263  HA  THR A  20       0.508  -1.739   4.470  1.00  0.00      A       
ATOM    264  HB  THR A  20      -1.278  -3.890   3.303  1.00  0.00      A       
ATOM    265  HG1 THR A  20      -2.738  -2.410   3.700  1.00  0.00      A       
ATOM    266 HG21 THR A  20       0.530  -3.961   5.390  1.00  0.00      A       
ATOM    267 HG22 THR A  20      -0.992  -3.606   6.208  1.00  0.00      A       
ATOM    268 HG23 THR A  20      -0.848  -5.046   5.199  1.00  0.00      A       
ATOM    269  N   THR A  20      -0.405  -1.341   2.608  1.00  0.00      A       
ATOM    270  O   THR A  20       1.107  -3.655   1.921  1.00  0.00      A       
ATOM    271  OG1 THR A  20      -2.141  -2.426   4.451  1.00  0.00      A       
ATOM    272  C   VAL A  21       3.492  -5.448   3.845  1.00  0.00      A       
ATOM    273  CA  VAL A  21       3.462  -4.083   3.153  1.00  0.00      A       
ATOM    274  CB  VAL A  21       4.783  -3.354   3.404  1.00  0.00      A       
ATOM    275  CG1 VAL A  21       5.951  -4.268   3.027  1.00  0.00      A       
ATOM    276  CG2 VAL A  21       4.834  -2.086   2.550  1.00  0.00      A       
ATOM    277  HN  VAL A  21       2.423  -2.847   4.578  1.00  0.00      A       
ATOM    278  HA  VAL A  21       3.323  -4.221   2.091  1.00  0.00      A       
ATOM    279  HB  VAL A  21       4.856  -3.091   4.449  1.00  0.00      A       
ATOM    280 HG11 VAL A  21       5.846  -5.215   3.536  1.00  0.00      A       
ATOM    281 HG12 VAL A  21       5.950  -4.432   1.959  1.00  0.00      A       
ATOM    282 HG13 VAL A  21       6.881  -3.804   3.319  1.00  0.00      A       
ATOM    283 HG21 VAL A  21       3.874  -1.593   2.579  1.00  0.00      A       
ATOM    284 HG22 VAL A  21       5.592  -1.421   2.937  1.00  0.00      A       
ATOM    285 HG23 VAL A  21       5.073  -2.348   1.529  1.00  0.00      A       
ATOM    286  N   VAL A  21       2.337  -3.274   3.701  1.00  0.00      A       
ATOM    287  O   VAL A  21       3.672  -5.543   5.042  1.00  0.00      A       
ATOM    288  C   ASP A  22       4.564  -8.630   3.220  1.00  0.00      A       
ATOM    289  CA  ASP A  22       3.337  -7.862   3.715  1.00  0.00      A       
ATOM    290  CB  ASP A  22       2.067  -8.619   3.318  1.00  0.00      A       
ATOM    291  CG  ASP A  22       1.852  -9.792   4.276  1.00  0.00      A       
ATOM    292  HN  ASP A  22       3.174  -6.406   2.135  1.00  0.00      A       
ATOM    293  HA  ASP A  22       3.379  -7.769   4.790  1.00  0.00      A       
ATOM    294  HB2 ASP A  22       1.220  -7.951   3.369  1.00  0.00      A       
ATOM    295  HB1 ASP A  22       2.171  -8.993   2.311  1.00  0.00      A       
ATOM    296  N   ASP A  22       3.318  -6.505   3.100  1.00  0.00      A       
ATOM    297  O   ASP A  22       4.718  -8.879   2.041  1.00  0.00      A       
ATOM    298  OD1 ASP A  22       2.195  -9.654   5.438  1.00  0.00      A       
ATOM    299  OD2 ASP A  22       1.347 -10.810   3.830  1.00  0.00      A       
ATOM    300  C   LEU A  23       6.241 -11.105   3.094  1.00  0.00      A       
ATOM    301  CA  LEU A  23       6.655  -9.759   3.690  1.00  0.00      A       
ATOM    302  CB  LEU A  23       7.555  -9.994   4.905  1.00  0.00      A       
ATOM    303  CD1 LEU A  23       9.480  -9.524   3.383  1.00  0.00      A       
ATOM    304  CD2 LEU A  23       8.549  -7.705   4.819  1.00  0.00      A       
ATOM    305  CG  LEU A  23       8.853  -9.202   4.741  1.00  0.00      A       
ATOM    306  HN  LEU A  23       5.296  -8.797   5.058  1.00  0.00      A       
ATOM    307  HA  LEU A  23       7.193  -9.186   2.949  1.00  0.00      A       
ATOM    308  HB2 LEU A  23       7.044  -9.668   5.800  1.00  0.00      A       
ATOM    309  HB1 LEU A  23       7.785 -11.046   4.984  1.00  0.00      A       
ATOM    310 HD11 LEU A  23       9.100 -10.470   3.026  1.00  0.00      A       
ATOM    311 HD12 LEU A  23       9.228  -8.746   2.677  1.00  0.00      A       
ATOM    312 HD13 LEU A  23      10.553  -9.582   3.486  1.00  0.00      A       
ATOM    313 HD21 LEU A  23       7.598  -7.505   4.348  1.00  0.00      A       
ATOM    314 HD22 LEU A  23       8.509  -7.399   5.854  1.00  0.00      A       
ATOM    315 HD23 LEU A  23       9.325  -7.152   4.311  1.00  0.00      A       
ATOM    316  HG  LEU A  23       9.542  -9.474   5.528  1.00  0.00      A       
ATOM    317  N   LEU A  23       5.439  -9.007   4.112  1.00  0.00      A       
ATOM    318  O   LEU A  23       5.890 -12.027   3.803  1.00  0.00      A       
ATOM    319  C   GLY A  24       5.159 -12.231  -0.160  1.00  0.00      A       
ATOM    320  CA  GLY A  24       5.887 -12.514   1.155  1.00  0.00      A       
ATOM    321  HN  GLY A  24       6.565 -10.471   1.240  1.00  0.00      A       
ATOM    322  HA2 GLY A  24       6.773 -13.102   0.958  1.00  0.00      A       
ATOM    323  HA1 GLY A  24       5.231 -13.060   1.815  1.00  0.00      A       
ATOM    324  N   GLY A  24       6.279 -11.226   1.795  1.00  0.00      A       
ATOM    325  O   GLY A  24       5.764 -12.145  -1.210  1.00  0.00      A       
ATOM    326  C   SER A  25       1.658 -11.431  -1.000  1.00  0.00      A       
ATOM    327  CA  SER A  25       3.097 -11.808  -1.359  1.00  0.00      A       
ATOM    328  CB  SER A  25       3.092 -13.056  -2.242  1.00  0.00      A       
ATOM    329  HN  SER A  25       3.393 -12.158   0.746  1.00  0.00      A       
ATOM    330  HA  SER A  25       3.561 -10.991  -1.892  1.00  0.00      A       
ATOM    331  HB2 SER A  25       3.966 -13.650  -2.035  1.00  0.00      A       
ATOM    332  HB1 SER A  25       2.204 -13.639  -2.033  1.00  0.00      A       
ATOM    333  HG  SER A  25       2.279 -12.215  -3.797  1.00  0.00      A       
ATOM    334  N   SER A  25       3.863 -12.085  -0.111  1.00  0.00      A       
ATOM    335  O   SER A  25       1.164 -11.766   0.058  1.00  0.00      A       
ATOM    336  OG  SER A  25       3.106 -12.664  -3.608  1.00  0.00      A       
ATOM    337  C   CYS A  26      -1.284 -11.592  -1.410  1.00  0.00      A       
ATOM    338  CA  CYS A  26      -0.424 -10.338  -1.582  1.00  0.00      A       
ATOM    339  CB  CYS A  26      -0.969  -9.502  -2.741  1.00  0.00      A       
ATOM    340  HN  CYS A  26       1.398 -10.475  -2.721  1.00  0.00      A       
ATOM    341  HA  CYS A  26      -0.453  -9.755  -0.673  1.00  0.00      A       
ATOM    342  HB2 CYS A  26      -0.704  -9.969  -3.678  1.00  0.00      A       
ATOM    343  HB1 CYS A  26      -2.044  -9.436  -2.664  1.00  0.00      A       
ATOM    344  N   CYS A  26       0.982 -10.736  -1.874  1.00  0.00      A       
ATOM    345  O   CYS A  26      -0.909 -12.674  -1.818  1.00  0.00      A       
ATOM    346  SG  CYS A  26      -0.256  -7.837  -2.673  1.00  0.00      A       
ATOM    347  C   ASN A  27      -4.766 -12.253  -0.910  1.00  0.00      A       
ATOM    348  CA  ASN A  27      -3.316 -12.641  -0.612  1.00  0.00      A       
ATOM    349  CB  ASN A  27      -3.205 -13.125   0.836  1.00  0.00      A       
ATOM    350  CG  ASN A  27      -2.083 -14.158   0.944  1.00  0.00      A       
ATOM    351  HN  ASN A  27      -2.718 -10.575  -0.488  1.00  0.00      A       
ATOM    352  HA  ASN A  27      -3.011 -13.433  -1.280  1.00  0.00      A       
ATOM    353  HB2 ASN A  27      -2.986 -12.285   1.479  1.00  0.00      A       
ATOM    354  HB1 ASN A  27      -4.138 -13.576   1.137  1.00  0.00      A       
ATOM    355 HD21 ASN A  27      -3.261 -15.567   1.698  1.00  0.00      A       
ATOM    356 HD22 ASN A  27      -1.637 -16.015   1.490  1.00  0.00      A       
ATOM    357  N   ASN A  27      -2.434 -11.457  -0.809  1.00  0.00      A       
ATOM    358  ND2 ASN A  27      -2.349 -15.345   1.417  1.00  0.00      A       
ATOM    359  O   ASN A  27      -5.080 -11.097  -1.112  1.00  0.00      A       
ATOM    360  OD1 ASN A  27      -0.952 -13.883   0.595  1.00  0.00      A       
ATOM    361  C   ALA A  28      -7.586 -11.863  -0.212  1.00  0.00      A       
ATOM    362  CA  ALA A  28      -7.081 -12.894  -1.223  1.00  0.00      A       
ATOM    363  CB  ALA A  28      -7.918 -14.170  -1.112  1.00  0.00      A       
ATOM    364  HN  ALA A  28      -5.379 -14.136  -0.772  1.00  0.00      A       
ATOM    365  HA  ALA A  28      -7.169 -12.492  -2.221  1.00  0.00      A       
ATOM    366  HB1 ALA A  28      -7.291 -14.984  -0.779  1.00  0.00      A       
ATOM    367  HB2 ALA A  28      -8.716 -14.017  -0.400  1.00  0.00      A       
ATOM    368  HB3 ALA A  28      -8.337 -14.411  -2.077  1.00  0.00      A       
ATOM    369  N   ALA A  28      -5.653 -13.210  -0.938  1.00  0.00      A       
ATOM    370  O   ALA A  28      -6.999 -11.664   0.833  1.00  0.00      A       
ATOM    371  C   GLY A  29      -8.370  -8.914   0.352  1.00  0.00      A       
ATOM    372  CA  GLY A  29      -9.214 -10.187   0.431  1.00  0.00      A       
ATOM    373  HN  GLY A  29      -9.131 -11.380  -1.362  1.00  0.00      A       
ATOM    374  HA2 GLY A  29     -10.237  -9.960   0.166  1.00  0.00      A       
ATOM    375  HA1 GLY A  29      -9.180 -10.576   1.437  1.00  0.00      A       
ATOM    376  N   GLY A  29      -8.672 -11.205  -0.514  1.00  0.00      A       
ATOM    377  O   GLY A  29      -8.524  -8.006   1.144  1.00  0.00      A       
ATOM    378  C   TRP A  30      -6.665  -7.126  -2.173  1.00  0.00      A       
ATOM    379  CA  TRP A  30      -6.627  -7.624  -0.727  1.00  0.00      A       
ATOM    380  CB  TRP A  30      -5.185  -7.967  -0.345  1.00  0.00      A       
ATOM    381  CD1 TRP A  30      -5.457  -9.095   1.900  1.00  0.00      A       
ATOM    382  CD2 TRP A  30      -4.532  -7.051   2.067  1.00  0.00      A       
ATOM    383  CE2 TRP A  30      -4.625  -7.563   3.382  1.00  0.00      A       
ATOM    384  CE3 TRP A  30      -3.980  -5.769   1.892  1.00  0.00      A       
ATOM    385  CG  TRP A  30      -5.068  -8.043   1.144  1.00  0.00      A       
ATOM    386  CH2 TRP A  30      -3.640  -5.558   4.294  1.00  0.00      A       
ATOM    387  CZ2 TRP A  30      -4.186  -6.830   4.486  1.00  0.00      A       
ATOM    388  CZ3 TRP A  30      -3.537  -5.028   3.000  1.00  0.00      A       
ATOM    389  HN  TRP A  30      -7.370  -9.582  -1.228  1.00  0.00      A       
ATOM    390  HA  TRP A  30      -6.999  -6.851  -0.070  1.00  0.00      A       
ATOM    391  HB2 TRP A  30      -4.916  -8.920  -0.776  1.00  0.00      A       
ATOM    392  HB1 TRP A  30      -4.522  -7.202  -0.719  1.00  0.00      A       
ATOM    393  HD1 TRP A  30      -5.901 -10.007   1.528  1.00  0.00      A       
ATOM    394  HE1 TRP A  30      -5.383  -9.409   3.982  1.00  0.00      A       
ATOM    395  HE3 TRP A  30      -3.896  -5.351   0.899  1.00  0.00      A       
ATOM    396  HH2 TRP A  30      -3.298  -4.984   5.142  1.00  0.00      A       
ATOM    397  HZ2 TRP A  30      -4.267  -7.243   5.480  1.00  0.00      A       
ATOM    398  HZ3 TRP A  30      -3.115  -4.045   2.855  1.00  0.00      A       
ATOM    399  N   TRP A  30      -7.479  -8.839  -0.599  1.00  0.00      A       
ATOM    400  NE1 TRP A  30      -5.195  -8.811   3.229  1.00  0.00      A       
ATOM    401  O   TRP A  30      -7.180  -7.785  -3.054  1.00  0.00      A       
ATOM    402  C   GLU A  31      -4.805  -4.702  -4.080  1.00  0.00      A       
ATOM    403  CA  GLU A  31      -6.126  -5.427  -3.814  1.00  0.00      A       
ATOM    404  CB  GLU A  31      -7.288  -4.445  -3.978  1.00  0.00      A       
ATOM    405  CD  GLU A  31      -8.855  -5.769  -5.404  1.00  0.00      A       
ATOM    406  CG  GLU A  31      -8.609  -5.215  -4.000  1.00  0.00      A       
ATOM    407  HN  GLU A  31      -5.711  -5.450  -1.700  1.00  0.00      A       
ATOM    408  HA  GLU A  31      -6.239  -6.240  -4.516  1.00  0.00      A       
ATOM    409  HB2 GLU A  31      -7.289  -3.749  -3.151  1.00  0.00      A       
ATOM    410  HB1 GLU A  31      -7.174  -3.903  -4.904  1.00  0.00      A       
ATOM    411  HG2 GLU A  31      -8.562  -6.031  -3.293  1.00  0.00      A       
ATOM    412  HG1 GLU A  31      -9.417  -4.552  -3.730  1.00  0.00      A       
ATOM    413  N   GLU A  31      -6.122  -5.966  -2.425  1.00  0.00      A       
ATOM    414  O   GLU A  31      -4.583  -3.606  -3.606  1.00  0.00      A       
ATOM    415  OE1 GLU A  31      -8.389  -5.156  -6.351  1.00  0.00      A       
ATOM    416  OE2 GLU A  31      -9.504  -6.796  -5.510  1.00  0.00      A       
ATOM    417  C   LYS A  32      -2.839  -3.171  -5.425  1.00  0.00      A       
ATOM    418  CA  LYS A  32      -2.619  -4.656  -5.132  1.00  0.00      A       
ATOM    419  CB  LYS A  32      -1.982  -5.326  -6.352  1.00  0.00      A       
ATOM    420  CD  LYS A  32       0.056  -6.768  -6.467  1.00  0.00      A       
ATOM    421  CE  LYS A  32       1.238  -6.692  -7.436  1.00  0.00      A       
ATOM    422  CG  LYS A  32      -0.462  -5.357  -6.181  1.00  0.00      A       
ATOM    423  HN  LYS A  32      -4.128  -6.192  -5.206  1.00  0.00      A       
ATOM    424  HA  LYS A  32      -1.962  -4.761  -4.281  1.00  0.00      A       
ATOM    425  HB2 LYS A  32      -2.355  -6.336  -6.444  1.00  0.00      A       
ATOM    426  HB1 LYS A  32      -2.231  -4.767  -7.241  1.00  0.00      A       
ATOM    427  HD2 LYS A  32       0.375  -7.228  -5.543  1.00  0.00      A       
ATOM    428  HD1 LYS A  32      -0.732  -7.358  -6.910  1.00  0.00      A       
ATOM    429  HE2 LYS A  32       1.730  -5.737  -7.328  1.00  0.00      A       
ATOM    430  HE1 LYS A  32       1.937  -7.485  -7.214  1.00  0.00      A       
ATOM    431  HG2 LYS A  32      -0.008  -4.660  -6.871  1.00  0.00      A       
ATOM    432  HG1 LYS A  32      -0.207  -5.081  -5.169  1.00  0.00      A       
ATOM    433  HZ1 LYS A  32      -0.117  -6.274  -8.961  1.00  0.00      A       
ATOM    434  HZ2 LYS A  32       1.475  -6.514  -9.497  1.00  0.00      A       
ATOM    435  HZ3 LYS A  32       0.530  -7.844  -9.020  1.00  0.00      A       
ATOM    436  N   LYS A  32      -3.927  -5.307  -4.835  1.00  0.00      A       
ATOM    437  NZ  LYS A  32       0.744  -6.842  -8.834  1.00  0.00      A       
ATOM    438  O   LYS A  32      -3.540  -2.807  -6.348  1.00  0.00      A       
ATOM    439  C   CYS A  33      -1.206  -0.301  -5.619  1.00  0.00      A       
ATOM    440  CA  CYS A  33      -2.425  -0.849  -4.876  1.00  0.00      A       
ATOM    441  CB  CYS A  33      -2.567  -0.132  -3.532  1.00  0.00      A       
ATOM    442  HN  CYS A  33      -1.687  -2.624  -3.903  1.00  0.00      A       
ATOM    443  HA  CYS A  33      -3.313  -0.684  -5.468  1.00  0.00      A       
ATOM    444  HB2 CYS A  33      -2.712  -0.861  -2.748  1.00  0.00      A       
ATOM    445  HB1 CYS A  33      -1.673   0.439  -3.332  1.00  0.00      A       
ATOM    446  N   CYS A  33      -2.248  -2.310  -4.643  1.00  0.00      A       
ATOM    447  O   CYS A  33      -1.239   0.778  -6.176  1.00  0.00      A       
ATOM    448  SG  CYS A  33      -3.993   0.982  -3.590  1.00  0.00      A       
ATOM    449  C   ALA A  34       1.748  -1.734  -7.067  1.00  0.00      A       
ATOM    450  CA  ALA A  34       1.092  -0.561  -6.338  1.00  0.00      A       
ATOM    451  CB  ALA A  34       2.076   0.017  -5.319  1.00  0.00      A       
ATOM    452  HN  ALA A  34      -0.124  -1.905  -5.176  1.00  0.00      A       
ATOM    453  HA  ALA A  34       0.822   0.203  -7.052  1.00  0.00      A       
ATOM    454  HB1 ALA A  34       1.530   0.539  -4.547  1.00  0.00      A       
ATOM    455  HB2 ALA A  34       2.648  -0.785  -4.875  1.00  0.00      A       
ATOM    456  HB3 ALA A  34       2.746   0.705  -5.815  1.00  0.00      A       
ATOM    457  N   ALA A  34      -0.129  -1.038  -5.632  1.00  0.00      A       
ATOM    458  O   ALA A  34       2.035  -2.758  -6.481  1.00  0.00      A       
ATOM    459  C   SER A  35       3.795  -3.266  -8.285  1.00  0.00      A       
ATOM    460  CA  SER A  35       2.631  -2.703  -9.103  1.00  0.00      A       
ATOM    461  CB  SER A  35       3.155  -2.171 -10.437  1.00  0.00      A       
ATOM    462  HN  SER A  35       1.753  -0.759  -8.798  1.00  0.00      A       
ATOM    463  HA  SER A  35       1.906  -3.482  -9.284  1.00  0.00      A       
ATOM    464  HB2 SER A  35       3.721  -2.940 -10.936  1.00  0.00      A       
ATOM    465  HB1 SER A  35       2.319  -1.881 -11.061  1.00  0.00      A       
ATOM    466  HG  SER A  35       4.895  -1.371 -10.095  1.00  0.00      A       
ATOM    467  N   SER A  35       1.990  -1.593  -8.342  1.00  0.00      A       
ATOM    468  O   SER A  35       4.161  -4.417  -8.416  1.00  0.00      A       
ATOM    469  OG  SER A  35       3.996  -1.050 -10.199  1.00  0.00      A       
ATOM    470  C   TYR A  36       5.603  -2.095  -5.335  1.00  0.00      A       
ATOM    471  CA  TYR A  36       5.513  -2.943  -6.607  1.00  0.00      A       
ATOM    472  CB  TYR A  36       6.815  -2.820  -7.401  1.00  0.00      A       
ATOM    473  CD1 TYR A  36       7.366  -5.198  -6.772  1.00  0.00      A       
ATOM    474  CD2 TYR A  36       9.119  -3.527  -6.662  1.00  0.00      A       
ATOM    475  CE1 TYR A  36       8.270  -6.175  -6.338  1.00  0.00      A       
ATOM    476  CE2 TYR A  36      10.023  -4.504  -6.228  1.00  0.00      A       
ATOM    477  CG  TYR A  36       7.790  -3.874  -6.934  1.00  0.00      A       
ATOM    478  CZ  TYR A  36       9.599  -5.828  -6.066  1.00  0.00      A       
ATOM    479  HN  TYR A  36       4.062  -1.537  -7.348  1.00  0.00      A       
ATOM    480  HA  TYR A  36       5.350  -3.977  -6.339  1.00  0.00      A       
ATOM    481  HB2 TYR A  36       6.609  -2.960  -8.453  1.00  0.00      A       
ATOM    482  HB1 TYR A  36       7.242  -1.841  -7.245  1.00  0.00      A       
ATOM    483  HD1 TYR A  36       6.341  -5.466  -6.982  1.00  0.00      A       
ATOM    484  HD2 TYR A  36       9.446  -2.505  -6.786  1.00  0.00      A       
ATOM    485  HE1 TYR A  36       7.943  -7.197  -6.214  1.00  0.00      A       
ATOM    486  HE2 TYR A  36      11.048  -4.236  -6.018  1.00  0.00      A       
ATOM    487  HH  TYR A  36      11.205  -6.349  -5.176  1.00  0.00      A       
ATOM    488  N   TYR A  36       4.376  -2.461  -7.439  1.00  0.00      A       
ATOM    489  O   TYR A  36       4.604  -1.657  -4.800  1.00  0.00      A       
ATOM    490  OH  TYR A  36      10.490  -6.791  -5.639  1.00  0.00      A       
ATOM    491  C   TYR A  37       8.421  -0.871  -3.287  1.00  0.00      A       
ATOM    492  CA  TYR A  37       6.935  -1.042  -3.608  1.00  0.00      A       
ATOM    493  CB  TYR A  37       6.238  -1.751  -2.446  1.00  0.00      A       
ATOM    494  CD1 TYR A  37       6.479   0.378  -1.121  1.00  0.00      A       
ATOM    495  CD2 TYR A  37       6.851  -1.741  -0.003  1.00  0.00      A       
ATOM    496  CE1 TYR A  37       6.749   1.055   0.074  1.00  0.00      A       
ATOM    497  CE2 TYR A  37       7.121  -1.065   1.192  1.00  0.00      A       
ATOM    498  CG  TYR A  37       6.530  -1.020  -1.159  1.00  0.00      A       
ATOM    499  CZ  TYR A  37       7.070   0.334   1.231  1.00  0.00      A       
ATOM    500  HN  TYR A  37       7.585  -2.223  -5.287  1.00  0.00      A       
ATOM    501  HA  TYR A  37       6.485  -0.073  -3.762  1.00  0.00      A       
ATOM    502  HB2 TYR A  37       5.172  -1.764  -2.619  1.00  0.00      A       
ATOM    503  HB1 TYR A  37       6.602  -2.765  -2.373  1.00  0.00      A       
ATOM    504  HD1 TYR A  37       6.231   0.934  -2.013  1.00  0.00      A       
ATOM    505  HD2 TYR A  37       6.890  -2.820  -0.033  1.00  0.00      A       
ATOM    506  HE1 TYR A  37       6.709   2.134   0.104  1.00  0.00      A       
ATOM    507  HE2 TYR A  37       7.368  -1.621   2.083  1.00  0.00      A       
ATOM    508  HH  TYR A  37       7.622   0.355   3.058  1.00  0.00      A       
ATOM    509  N   TYR A  37       6.790  -1.861  -4.844  1.00  0.00      A       
ATOM    510  O   TYR A  37       9.064   0.048  -3.754  1.00  0.00      A       
ATOM    511  OH  TYR A  37       7.336   1.001   2.409  1.00  0.00      A       
ATOM    512  C   THR A  38      11.191  -2.745  -2.874  1.00  0.00      A       
ATOM    513  CA  THR A  38      10.416  -1.640  -2.154  1.00  0.00      A       
ATOM    514  CB  THR A  38      10.595  -1.790  -0.641  1.00  0.00      A       
ATOM    515  CG2 THR A  38      10.067  -3.154  -0.195  1.00  0.00      A       
ATOM    516  HN  THR A  38       8.437  -2.487  -2.135  1.00  0.00      A       
ATOM    517  HA  THR A  38      10.788  -0.676  -2.467  1.00  0.00      A       
ATOM    518  HB  THR A  38      10.044  -1.013  -0.134  1.00  0.00      A       
ATOM    519  HG1 THR A  38      12.059  -1.071   0.419  1.00  0.00      A       
ATOM    520 HG21 THR A  38       9.555  -3.628  -1.018  1.00  0.00      A       
ATOM    521 HG22 THR A  38      10.893  -3.774   0.121  1.00  0.00      A       
ATOM    522 HG23 THR A  38       9.381  -3.021   0.629  1.00  0.00      A       
ATOM    523  N   THR A  38       8.972  -1.751  -2.498  1.00  0.00      A       
ATOM    524  O   THR A  38      10.622  -3.555  -3.579  1.00  0.00      A       
ATOM    525  OG1 THR A  38      11.974  -1.684  -0.315  1.00  0.00      A       
ATOM    526  C   ILE A  39      13.095  -5.176  -2.676  1.00  0.00      A       
ATOM    527  CA  ILE A  39      13.288  -3.836  -3.390  1.00  0.00      A       
ATOM    528  CB  ILE A  39      14.767  -3.449  -3.353  1.00  0.00      A       
ATOM    529  CD1 ILE A  39      14.786  -0.961  -3.588  1.00  0.00      A       
ATOM    530  CG1 ILE A  39      15.013  -2.286  -4.317  1.00  0.00      A       
ATOM    531  CG2 ILE A  39      15.619  -4.648  -3.774  1.00  0.00      A       
ATOM    532  HN  ILE A  39      12.925  -2.121  -2.138  1.00  0.00      A       
ATOM    533  HA  ILE A  39      12.966  -3.926  -4.416  1.00  0.00      A       
ATOM    534  HB  ILE A  39      15.037  -3.151  -2.350  1.00  0.00      A       
ATOM    535 HD11 ILE A  39      15.339  -0.961  -2.660  1.00  0.00      A       
ATOM    536 HD12 ILE A  39      15.125  -0.145  -4.209  1.00  0.00      A       
ATOM    537 HD13 ILE A  39      13.733  -0.841  -3.379  1.00  0.00      A       
ATOM    538 HG12 ILE A  39      16.030  -2.329  -4.680  1.00  0.00      A       
ATOM    539 HG11 ILE A  39      14.330  -2.358  -5.150  1.00  0.00      A       
ATOM    540 HG21 ILE A  39      15.038  -5.293  -4.416  1.00  0.00      A       
ATOM    541 HG22 ILE A  39      16.492  -4.301  -4.305  1.00  0.00      A       
ATOM    542 HG23 ILE A  39      15.926  -5.197  -2.896  1.00  0.00      A       
ATOM    543  N   ILE A  39      12.483  -2.784  -2.708  1.00  0.00      A       
ATOM    544  O   ILE A  39      13.501  -6.212  -3.165  1.00  0.00      A       
ATOM    545  C   ILE A  40      10.865  -6.480  -0.198  1.00  0.00      A       
ATOM    546  CA  ILE A  40      12.276  -6.447  -0.788  1.00  0.00      A       
ATOM    547  CB  ILE A  40      13.302  -6.556   0.341  1.00  0.00      A       
ATOM    548  CD1 ILE A  40      14.459  -8.161   1.869  1.00  0.00      A       
ATOM    549  CG1 ILE A  40      13.277  -7.975   0.916  1.00  0.00      A       
ATOM    550  CG2 ILE A  40      12.957  -5.555   1.445  1.00  0.00      A       
ATOM    551  HN  ILE A  40      12.166  -4.324  -1.142  1.00  0.00      A       
ATOM    552  HA  ILE A  40      12.400  -7.277  -1.467  1.00  0.00      A       
ATOM    553  HB  ILE A  40      14.287  -6.340  -0.046  1.00  0.00      A       
ATOM    554 HD11 ILE A  40      15.034  -7.248   1.912  1.00  0.00      A       
ATOM    555 HD12 ILE A  40      14.091  -8.401   2.856  1.00  0.00      A       
ATOM    556 HD13 ILE A  40      15.086  -8.965   1.513  1.00  0.00      A       
ATOM    557 HG12 ILE A  40      12.352  -8.129   1.453  1.00  0.00      A       
ATOM    558 HG11 ILE A  40      13.350  -8.691   0.111  1.00  0.00      A       
ATOM    559 HG21 ILE A  40      12.086  -4.986   1.155  1.00  0.00      A       
ATOM    560 HG22 ILE A  40      12.750  -6.087   2.362  1.00  0.00      A       
ATOM    561 HG23 ILE A  40      13.790  -4.885   1.597  1.00  0.00      A       
ATOM    562  N   ILE A  40      12.484  -5.168  -1.524  1.00  0.00      A       
ATOM    563  O   ILE A  40      10.643  -7.015   0.871  1.00  0.00      A       
ATOM    564  C   ALA A  41       7.564  -5.275  -1.356  1.00  0.00      A       
ATOM    565  CA  ALA A  41       8.514  -5.927  -0.348  1.00  0.00      A       
ATOM    566  CB  ALA A  41       8.468  -5.149   0.968  1.00  0.00      A       
ATOM    567  HN  ALA A  41      10.102  -5.491  -1.743  1.00  0.00      A       
ATOM    568  HA  ALA A  41       8.205  -6.947  -0.172  1.00  0.00      A       
ATOM    569  HB1 ALA A  41       9.474  -4.920   1.286  1.00  0.00      A       
ATOM    570  HB2 ALA A  41       7.918  -4.231   0.824  1.00  0.00      A       
ATOM    571  HB3 ALA A  41       7.980  -5.748   1.723  1.00  0.00      A       
ATOM    572  N   ALA A  41       9.906  -5.917  -0.882  1.00  0.00      A       
ATOM    573  O   ALA A  41       7.980  -4.559  -2.245  1.00  0.00      A       
ATOM    574  C   ASP A  42       4.382  -3.969  -1.384  1.00  0.00      A       
ATOM    575  CA  ASP A  42       5.303  -4.913  -2.158  1.00  0.00      A       
ATOM    576  CB  ASP A  42       4.469  -6.022  -2.804  1.00  0.00      A       
ATOM    577  CG  ASP A  42       4.395  -5.792  -4.314  1.00  0.00      A       
ATOM    578  HN  ASP A  42       5.978  -6.095  -0.489  1.00  0.00      A       
ATOM    579  HA  ASP A  42       5.824  -4.360  -2.925  1.00  0.00      A       
ATOM    580  HB2 ASP A  42       4.930  -6.980  -2.607  1.00  0.00      A       
ATOM    581  HB1 ASP A  42       3.472  -6.011  -2.391  1.00  0.00      A       
ATOM    582  N   ASP A  42       6.289  -5.517  -1.217  1.00  0.00      A       
ATOM    583  O   ASP A  42       4.761  -3.405  -0.377  1.00  0.00      A       
ATOM    584  OD1 ASP A  42       5.404  -5.983  -4.973  1.00  0.00      A       
ATOM    585  OD2 ASP A  42       3.331  -5.429  -4.787  1.00  0.00      A       
ATOM    586  C   CYS A  43       0.809  -3.151  -1.618  1.00  0.00      A       
ATOM    587  CA  CYS A  43       2.234  -2.884  -1.132  1.00  0.00      A       
ATOM    588  CB  CYS A  43       2.615  -1.430  -1.419  1.00  0.00      A       
ATOM    589  HN  CYS A  43       2.887  -4.255  -2.658  1.00  0.00      A       
ATOM    590  HA  CYS A  43       2.292  -3.068  -0.069  1.00  0.00      A       
ATOM    591  HB2 CYS A  43       3.104  -1.369  -2.380  1.00  0.00      A       
ATOM    592  HB1 CYS A  43       1.725  -0.820  -1.430  1.00  0.00      A       
ATOM    593  N   CYS A  43       3.175  -3.791  -1.844  1.00  0.00      A       
ATOM    594  O   CYS A  43       0.392  -2.665  -2.651  1.00  0.00      A       
ATOM    595  SG  CYS A  43       3.740  -0.835  -0.129  1.00  0.00      A       
ATOM    596  C   CYS A  44      -2.314  -3.349  -0.526  1.00  0.00      A       
ATOM    597  CA  CYS A  44      -1.336  -4.233  -1.303  1.00  0.00      A       
ATOM    598  CB  CYS A  44      -1.642  -5.703  -1.012  1.00  0.00      A       
ATOM    599  HN  CYS A  44       0.418  -4.312  -0.056  1.00  0.00      A       
ATOM    600  HA  CYS A  44      -1.444  -4.046  -2.361  1.00  0.00      A       
ATOM    601  HB2 CYS A  44      -0.824  -6.137  -0.457  1.00  0.00      A       
ATOM    602  HB1 CYS A  44      -2.549  -5.773  -0.429  1.00  0.00      A       
ATOM    603  N   CYS A  44       0.060  -3.927  -0.883  1.00  0.00      A       
ATOM    604  O   CYS A  44      -1.945  -2.674   0.413  1.00  0.00      A       
ATOM    605  SG  CYS A  44      -1.855  -6.599  -2.572  1.00  0.00      A       
ATOM    606  C   ARG A  45      -5.714  -3.408   0.284  1.00  0.00      A       
ATOM    607  CA  ARG A  45      -4.566  -2.518  -0.195  1.00  0.00      A       
ATOM    608  CB  ARG A  45      -5.111  -1.449  -1.145  1.00  0.00      A       
ATOM    609  CD  ARG A  45      -6.603   0.499  -0.672  1.00  0.00      A       
ATOM    610  CG  ARG A  45      -5.229  -0.117  -0.401  1.00  0.00      A       
ATOM    611  CZ  ARG A  45      -7.306   2.009  -2.430  1.00  0.00      A       
ATOM    612  HN  ARG A  45      -3.837  -3.908  -1.669  1.00  0.00      A       
ATOM    613  HA  ARG A  45      -4.100  -2.042   0.655  1.00  0.00      A       
ATOM    614  HB2 ARG A  45      -4.439  -1.337  -1.983  1.00  0.00      A       
ATOM    615  HB1 ARG A  45      -6.086  -1.748  -1.501  1.00  0.00      A       
ATOM    616  HD2 ARG A  45      -7.373  -0.228  -0.456  1.00  0.00      A       
ATOM    617  HD1 ARG A  45      -6.740   1.365  -0.042  1.00  0.00      A       
ATOM    618  HE  ARG A  45      -6.290   0.344  -2.798  1.00  0.00      A       
ATOM    619  HG2 ARG A  45      -5.112  -0.286   0.659  1.00  0.00      A       
ATOM    620  HG1 ARG A  45      -4.461   0.557  -0.747  1.00  0.00      A       
ATOM    621 HH11 ARG A  45      -6.165   3.170  -1.265  1.00  0.00      A       
ATOM    622 HH12 ARG A  45      -7.397   3.991  -2.163  1.00  0.00      A       
ATOM    623 HH21 ARG A  45      -8.591   1.107  -3.672  1.00  0.00      A       
ATOM    624 HH22 ARG A  45      -8.770   2.824  -3.526  1.00  0.00      A       
ATOM    625  N   ARG A  45      -3.561  -3.353  -0.910  1.00  0.00      A       
ATOM    626  NE  ARG A  45      -6.693   0.905  -2.103  1.00  0.00      A       
ATOM    627  NH1 ARG A  45      -6.926   3.145  -1.912  1.00  0.00      A       
ATOM    628  NH2 ARG A  45      -8.300   1.978  -3.275  1.00  0.00      A       
ATOM    629  O   ARG A  45      -6.555  -3.820  -0.488  1.00  0.00      A       
ATOM    630  C   LYS A  46      -8.202  -3.995   1.682  1.00  0.00      A       
ATOM    631  CA  LYS A  46      -6.844  -4.577   2.082  1.00  0.00      A       
ATOM    632  CB  LYS A  46      -6.748  -4.641   3.608  1.00  0.00      A       
ATOM    633  CD  LYS A  46      -6.976  -6.149   5.587  1.00  0.00      A       
ATOM    634  CE  LYS A  46      -7.257  -7.591   6.012  1.00  0.00      A       
ATOM    635  CG  LYS A  46      -7.293  -5.984   4.099  1.00  0.00      A       
ATOM    636  HN  LYS A  46      -5.062  -3.369   2.159  1.00  0.00      A       
ATOM    637  HA  LYS A  46      -6.744  -5.572   1.673  1.00  0.00      A       
ATOM    638  HB2 LYS A  46      -5.715  -4.540   3.907  1.00  0.00      A       
ATOM    639  HB1 LYS A  46      -7.328  -3.840   4.040  1.00  0.00      A       
ATOM    640  HD2 LYS A  46      -5.935  -5.918   5.760  1.00  0.00      A       
ATOM    641  HD1 LYS A  46      -7.595  -5.478   6.164  1.00  0.00      A       
ATOM    642  HE2 LYS A  46      -8.202  -7.911   5.597  1.00  0.00      A       
ATOM    643  HE1 LYS A  46      -6.469  -8.234   5.650  1.00  0.00      A       
ATOM    644  HG2 LYS A  46      -8.363  -6.013   3.952  1.00  0.00      A       
ATOM    645  HG1 LYS A  46      -6.831  -6.785   3.543  1.00  0.00      A       
ATOM    646  HZ1 LYS A  46      -7.217  -6.711   7.899  1.00  0.00      A       
ATOM    647  HZ2 LYS A  46      -8.229  -8.072   7.790  1.00  0.00      A       
ATOM    648  HZ3 LYS A  46      -6.545  -8.271   7.847  1.00  0.00      A       
ATOM    649  N   LYS A  46      -5.753  -3.711   1.553  1.00  0.00      A       
ATOM    650  NZ  LYS A  46      -7.317  -7.667   7.499  1.00  0.00      A       
ATOM    651  O   LYS A  46      -8.788  -3.213   2.404  1.00  0.00      A       
ATOM    652  C   LYS A  47     -10.116  -2.351   0.394  1.00  0.00      A       
ATOM    653  CA  LYS A  47     -10.027  -3.848   0.088  1.00  0.00      A       
ATOM    654  CB  LYS A  47     -11.147  -4.586   0.825  1.00  0.00      A       
ATOM    655  CD  LYS A  47     -12.260  -6.805   1.112  1.00  0.00      A       
ATOM    656  CE  LYS A  47     -13.701  -6.506   0.694  1.00  0.00      A       
ATOM    657  CG  LYS A  47     -11.297  -5.994   0.243  1.00  0.00      A       
ATOM    658  HN  LYS A  47      -8.216  -5.009  -0.026  1.00  0.00      A       
ATOM    659  HA  LYS A  47     -10.133  -4.004  -0.975  1.00  0.00      A       
ATOM    660  HB2 LYS A  47     -10.903  -4.653   1.875  1.00  0.00      A       
ATOM    661  HB1 LYS A  47     -12.074  -4.048   0.703  1.00  0.00      A       
ATOM    662  HD2 LYS A  47     -12.059  -7.859   0.984  1.00  0.00      A       
ATOM    663  HD1 LYS A  47     -12.125  -6.536   2.148  1.00  0.00      A       
ATOM    664  HE2 LYS A  47     -14.368  -7.204   1.177  1.00  0.00      A       
ATOM    665  HE1 LYS A  47     -13.959  -5.499   0.987  1.00  0.00      A       
ATOM    666  HG2 LYS A  47     -11.686  -5.927  -0.762  1.00  0.00      A       
ATOM    667  HG1 LYS A  47     -10.334  -6.481   0.226  1.00  0.00      A       
ATOM    668  HZ1 LYS A  47     -13.255  -7.445  -1.110  1.00  0.00      A       
ATOM    669  HZ2 LYS A  47     -14.825  -6.800  -1.034  1.00  0.00      A       
ATOM    670  HZ3 LYS A  47     -13.490  -5.770  -1.243  1.00  0.00      A       
ATOM    671  N   LYS A  47      -8.706  -4.374   0.538  1.00  0.00      A       
ATOM    672  NZ  LYS A  47     -13.828  -6.640  -0.785  1.00  0.00      A       
ATOM    673  O   LYS A  47     -10.594  -1.948   1.435  1.00  0.00      A       
ATOM    674  C   LYS A  48      -9.263   0.245   1.165  1.00  0.00      A       
ATOM    675  CA  LYS A  48      -9.718  -0.055  -0.265  1.00  0.00      A       
ATOM    676  CB  LYS A  48     -11.154   0.436  -0.456  1.00  0.00      A       
ATOM    677  CD  LYS A  48     -12.660   1.548  -2.111  1.00  0.00      A       
ATOM    678  CE  LYS A  48     -13.484   1.056  -3.303  1.00  0.00      A       
ATOM    679  CG  LYS A  48     -11.424   0.663  -1.945  1.00  0.00      A       
ATOM    680  HN  LYS A  48      -9.277  -1.868  -1.340  1.00  0.00      A       
ATOM    681  HA  LYS A  48      -9.068   0.452  -0.963  1.00  0.00      A       
ATOM    682  HB2 LYS A  48     -11.841  -0.304  -0.073  1.00  0.00      A       
ATOM    683  HB1 LYS A  48     -11.291   1.365   0.078  1.00  0.00      A       
ATOM    684  HD2 LYS A  48     -13.260   1.501  -1.213  1.00  0.00      A       
ATOM    685  HD1 LYS A  48     -12.353   2.568  -2.285  1.00  0.00      A       
ATOM    686  HE2 LYS A  48     -13.006   0.191  -3.738  1.00  0.00      A       
ATOM    687  HE1 LYS A  48     -14.476   0.790  -2.969  1.00  0.00      A       
ATOM    688  HG2 LYS A  48     -10.569   1.148  -2.395  1.00  0.00      A       
ATOM    689  HG1 LYS A  48     -11.595  -0.287  -2.428  1.00  0.00      A       
ATOM    690  HZ1 LYS A  48     -12.621   2.434  -4.604  1.00  0.00      A       
ATOM    691  HZ2 LYS A  48     -14.088   1.787  -5.157  1.00  0.00      A       
ATOM    692  HZ3 LYS A  48     -14.087   2.951  -3.919  1.00  0.00      A       
ATOM    693  N   LYS A  48      -9.659  -1.524  -0.506  1.00  0.00      A       
ATOM    694  NZ  LYS A  48     -13.577   2.139  -4.323  1.00  0.00      A       
ATOM    695  O   LYS A  48      -8.085   0.382   1.429  1.00  0.00      A       
ATOM    696  HN1 NH2 A  49      -9.879   0.545   3.029  1.00  0.00      A       
ATOM    697  HN2 NH2 A  49     -11.108   0.244   1.898  1.00  0.00      A       
ATOM    698  N   NH2 A  49     -10.158   0.354   2.109  1.00  0.00      A       
END


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