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
392258 1pvz 5865 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   THR A   1      -4.290  -6.879   7.396  1.00  0.00      A       
ATOM      2  CA  THR A   1      -5.510  -7.004   8.319  1.00  0.00      A       
ATOM      3  CB  THR A   1      -6.768  -6.326   7.731  1.00  0.00      A       
ATOM      4  CG2 THR A   1      -6.798  -4.796   7.854  1.00  0.00      A       
ATOM      5  HT1 THR A   1      -4.599  -5.618   9.624  1.00  0.00      A       
ATOM      6  HA  THR A   1      -5.762  -8.050   8.477  1.00  0.00      A       
ATOM      7  HB  THR A   1      -7.627  -6.709   8.283  1.00  0.00      A       
ATOM      8  HG1 THR A   1      -6.620  -5.955   5.812  1.00  0.00      A       
ATOM      9 HG21 THR A   1      -7.725  -4.421   7.418  1.00  0.00      A       
ATOM     10 HG22 THR A   1      -6.771  -4.498   8.902  1.00  0.00      A       
ATOM     11 HG23 THR A   1      -5.959  -4.340   7.330  1.00  0.00      A       
ATOM     12  N   THR A   1      -5.192  -6.437   9.617  1.00  0.00      A       
ATOM     13  O   THR A   1      -3.934  -5.762   7.023  1.00  0.00      A       
ATOM     14  OG1 THR A   1      -6.940  -6.678   6.371  1.00  0.00      A       
ATOM     15  C   PRO A   2      -3.108  -7.746   4.578  1.00  0.00      A       
ATOM     16  CA  PRO A   2      -2.552  -7.917   6.003  1.00  0.00      A       
ATOM     17  CB  PRO A   2      -1.808  -9.243   6.196  1.00  0.00      A       
ATOM     18  CD  PRO A   2      -3.898  -9.355   7.365  1.00  0.00      A       
ATOM     19  CG  PRO A   2      -2.938 -10.213   6.537  1.00  0.00      A       
ATOM     20  HA  PRO A   2      -1.875  -7.090   6.219  1.00  0.00      A       
ATOM     21  HB1 PRO A   2      -1.142  -9.158   7.057  1.00  0.00      A       
ATOM     22  HD1 PRO A   2      -3.672  -9.469   8.428  1.00  0.00      A       
ATOM     23  HG1 PRO A   2      -2.585 -11.088   7.082  1.00  0.00      A       
ATOM     24  N   PRO A   2      -3.646  -7.979   6.967  1.00  0.00      A       
ATOM     25  O   PRO A   2      -2.608  -8.355   3.636  1.00  0.00      A       
ATOM     26  C   PHE A   3      -5.440  -5.248   3.350  1.00  0.00      A       
ATOM     27  CA  PHE A   3      -4.912  -6.673   3.227  1.00  0.00      A       
ATOM     28  CB  PHE A   3      -6.105  -7.642   3.134  1.00  0.00      A       
ATOM     29  CD1 PHE A   3      -5.045  -9.824   2.407  1.00  0.00      A       
ATOM     30  CD2 PHE A   3      -6.283  -9.768   4.501  1.00  0.00      A       
ATOM     31  CE1 PHE A   3      -4.781 -11.192   2.599  1.00  0.00      A       
ATOM     32  CE2 PHE A   3      -6.042 -11.142   4.681  1.00  0.00      A       
ATOM     33  CG  PHE A   3      -5.791  -9.109   3.358  1.00  0.00      A       
ATOM     34  CZ  PHE A   3      -5.288 -11.853   3.731  1.00  0.00      A       
ATOM     35  HN  PHE A   3      -4.394  -6.322   5.220  1.00  0.00      A       
ATOM     36  HA  PHE A   3      -4.283  -6.781   2.347  1.00  0.00      A       
ATOM     37  HB1 PHE A   3      -6.552  -7.534   2.145  1.00  0.00      A       
ATOM     38  HD1 PHE A   3      -4.639  -9.314   1.547  1.00  0.00      A       
ATOM     39  HD2 PHE A   3      -6.855  -9.225   5.242  1.00  0.00      A       
ATOM     40  HE1 PHE A   3      -4.187 -11.733   1.878  1.00  0.00      A       
ATOM     41  HE2 PHE A   3      -6.433 -11.650   5.551  1.00  0.00      A       
ATOM     42  HZ  PHE A   3      -5.094 -12.906   3.873  1.00  0.00      A       
ATOM     43  N   PHE A   3      -4.139  -6.906   4.432  1.00  0.00      A       
ATOM     44  O   PHE A   3      -6.006  -4.915   4.393  1.00  0.00      A       
ATOM     45  C   ALA A   4      -5.582  -2.562   0.813  1.00  0.00      A       
ATOM     46  CA  ALA A   4      -5.718  -3.045   2.263  1.00  0.00      A       
ATOM     47  CB  ALA A   4      -4.946  -2.169   3.267  1.00  0.00      A       
ATOM     48  HN  ALA A   4      -4.827  -4.791   1.476  1.00  0.00      A       
ATOM     49  HA  ALA A   4      -6.777  -3.024   2.528  1.00  0.00      A       
ATOM     50  HB1 ALA A   4      -3.897  -2.087   2.984  1.00  0.00      A       
ATOM     51  HB2 ALA A   4      -5.385  -1.171   3.308  1.00  0.00      A       
ATOM     52  HB3 ALA A   4      -5.004  -2.590   4.270  1.00  0.00      A       
ATOM     53  N   ALA A   4      -5.249  -4.422   2.319  1.00  0.00      A       
ATOM     54  O   ALA A   4      -5.806  -3.337  -0.115  1.00  0.00      A       
ATOM     55  C   ILE A   5      -3.771  -1.465  -1.391  1.00  0.00      A       
ATOM     56  CA  ILE A   5      -4.950  -0.739  -0.718  1.00  0.00      A       
ATOM     57  CB  ILE A   5      -4.741   0.780  -0.538  1.00  0.00      A       
ATOM     58  CD1 ILE A   5      -5.984   2.917   0.141  1.00  0.00      A       
ATOM     59  CG1 ILE A   5      -6.103   1.451  -0.288  1.00  0.00      A       
ATOM     60  CG2 ILE A   5      -4.025   1.407  -1.736  1.00  0.00      A       
ATOM     61  HN  ILE A   5      -4.964  -0.725   1.397  1.00  0.00      A       
ATOM     62  HA  ILE A   5      -5.843  -0.893  -1.326  1.00  0.00      A       
ATOM     63  HB  ILE A   5      -4.112   0.944   0.337  1.00  0.00      A       
ATOM     64 HD11 ILE A   5      -5.309   3.002   0.992  1.00  0.00      A       
ATOM     65 HD12 ILE A   5      -5.622   3.539  -0.676  1.00  0.00      A       
ATOM     66 HD13 ILE A   5      -6.970   3.281   0.435  1.00  0.00      A       
ATOM     67 HG11 ILE A   5      -6.619   0.921   0.513  1.00  0.00      A       
ATOM     68 HG21 ILE A   5      -3.019   0.999  -1.784  1.00  0.00      A       
ATOM     69 HG22 ILE A   5      -4.565   1.190  -2.658  1.00  0.00      A       
ATOM     70 HG23 ILE A   5      -3.931   2.484  -1.610  1.00  0.00      A       
ATOM     71  N   ILE A   5      -5.180  -1.309   0.601  1.00  0.00      A       
ATOM     72  O   ILE A   5      -2.675  -1.504  -0.840  1.00  0.00      A       
ATOM     73  C   LYS A   6      -1.755  -2.102  -3.622  1.00  0.00      A       
ATOM     74  CA  LYS A   6      -3.012  -2.907  -3.260  1.00  0.00      A       
ATOM     75  CB  LYS A   6      -3.658  -3.543  -4.507  1.00  0.00      A       
ATOM     76  CD  LYS A   6      -1.748  -5.255  -4.942  1.00  0.00      A       
ATOM     77  CE  LYS A   6      -1.201  -6.076  -3.762  1.00  0.00      A       
ATOM     78  CG  LYS A   6      -3.259  -5.004  -4.778  1.00  0.00      A       
ATOM     79  HN  LYS A   6      -4.918  -2.004  -2.963  1.00  0.00      A       
ATOM     80  HA  LYS A   6      -2.739  -3.706  -2.578  1.00  0.00      A       
ATOM     81  HB1 LYS A   6      -3.438  -2.940  -5.390  1.00  0.00      A       
ATOM     82  HD1 LYS A   6      -1.217  -4.310  -5.055  1.00  0.00      A       
ATOM     83  HE1 LYS A   6      -1.591  -7.095  -3.828  1.00  0.00      A       
ATOM     84  HG1 LYS A   6      -3.755  -5.300  -5.706  1.00  0.00      A       
ATOM     85  HZ1 LYS A   6       0.661  -5.198  -3.549  1.00  0.00      A       
ATOM     86  HZ2 LYS A   6       0.571  -6.708  -2.968  1.00  0.00      A       
ATOM     87  HZ3 LYS A   6       0.663  -6.473  -4.602  1.00  0.00      A       
ATOM     88  N   LYS A   6      -3.992  -2.066  -2.568  1.00  0.00      A       
ATOM     89  NZ  LYS A   6       0.276  -6.126  -3.739  1.00  0.00      A       
ATOM     90  O   LYS A   6      -1.835  -1.144  -4.397  1.00  0.00      A       
ATOM     91  C   CYS A   7       1.742  -2.622  -3.904  1.00  0.00      A       
ATOM     92  CA  CYS A   7       0.662  -1.764  -3.241  1.00  0.00      A       
ATOM     93  CB  CYS A   7       1.118  -1.305  -1.856  1.00  0.00      A       
ATOM     94  HN  CYS A   7      -0.562  -3.300  -2.472  1.00  0.00      A       
ATOM     95  HA  CYS A   7       0.526  -0.871  -3.853  1.00  0.00      A       
ATOM     96  HB1 CYS A   7       1.108  -2.137  -1.157  1.00  0.00      A       
ATOM     97  N   CYS A   7      -0.593  -2.492  -3.086  1.00  0.00      A       
ATOM     98  O   CYS A   7       1.695  -3.851  -3.816  1.00  0.00      A       
ATOM     99  SG  CYS A   7       2.778  -0.618  -1.815  1.00  0.00      A       
ATOM    100  C   ALA A   8       5.031  -2.123  -3.843  1.00  0.00      A       
ATOM    101  CA  ALA A   8       4.003  -2.545  -4.901  1.00  0.00      A       
ATOM    102  CB  ALA A   8       4.414  -2.108  -6.310  1.00  0.00      A       
ATOM    103  HN  ALA A   8       2.624  -0.970  -4.671  1.00  0.00      A       
ATOM    104  HA  ALA A   8       3.943  -3.634  -4.900  1.00  0.00      A       
ATOM    105  HB1 ALA A   8       3.678  -2.459  -7.032  1.00  0.00      A       
ATOM    106  HB2 ALA A   8       4.484  -1.023  -6.378  1.00  0.00      A       
ATOM    107  HB3 ALA A   8       5.385  -2.541  -6.556  1.00  0.00      A       
ATOM    108  N   ALA A   8       2.708  -1.969  -4.563  1.00  0.00      A       
ATOM    109  O   ALA A   8       5.525  -2.965  -3.099  1.00  0.00      A       
ATOM    110  C   THR A   9       5.803   1.012  -2.186  1.00  0.00      A       
ATOM    111  CA  THR A   9       6.346  -0.247  -2.876  1.00  0.00      A       
ATOM    112  CB  THR A   9       7.576   0.116  -3.722  1.00  0.00      A       
ATOM    113  CG2 THR A   9       8.283  -1.137  -4.248  1.00  0.00      A       
ATOM    114  HN  THR A   9       4.908  -0.165  -4.397  1.00  0.00      A       
ATOM    115  HA  THR A   9       6.633  -0.958  -2.100  1.00  0.00      A       
ATOM    116  HB  THR A   9       8.289   0.680  -3.116  1.00  0.00      A       
ATOM    117  HG1 THR A   9       7.950   1.224  -5.276  1.00  0.00      A       
ATOM    118 HG21 THR A   9       9.196  -0.849  -4.771  1.00  0.00      A       
ATOM    119 HG22 THR A   9       8.548  -1.788  -3.414  1.00  0.00      A       
ATOM    120 HG23 THR A   9       7.641  -1.683  -4.939  1.00  0.00      A       
ATOM    121  N   THR A   9       5.337  -0.822  -3.764  1.00  0.00      A       
ATOM    122  O   THR A   9       4.767   1.540  -2.579  1.00  0.00      A       
ATOM    123  OG1 THR A   9       7.164   0.907  -4.822  1.00  0.00      A       
ATOM    124  C   ASP A  10       6.013   3.911  -1.692  1.00  0.00      A       
ATOM    125  CA  ASP A  10       6.453   2.873  -0.643  1.00  0.00      A       
ATOM    126  CB  ASP A  10       7.838   3.226  -0.073  1.00  0.00      A       
ATOM    127  CG  ASP A  10       8.938   2.735  -1.004  1.00  0.00      A       
ATOM    128  HN  ASP A  10       7.410   1.037  -0.970  1.00  0.00      A       
ATOM    129  HA  ASP A  10       5.731   2.884   0.172  1.00  0.00      A       
ATOM    130  HB1 ASP A  10       7.965   2.733   0.890  1.00  0.00      A       
ATOM    131  N   ASP A  10       6.535   1.514  -1.190  1.00  0.00      A       
ATOM    132  O   ASP A  10       4.976   4.555  -1.540  1.00  0.00      A       
ATOM    133  OD1 ASP A  10       9.253   1.531  -0.879  1.00  0.00      A       
ATOM    134  OD2 ASP A  10       9.281   3.489  -1.940  1.00  0.00      A       
ATOM    135  C   ALA A  11       5.014   4.705  -4.374  1.00  0.00      A       
ATOM    136  CA  ALA A  11       6.449   4.937  -3.887  1.00  0.00      A       
ATOM    137  CB  ALA A  11       7.454   4.711  -5.021  1.00  0.00      A       
ATOM    138  HN  ALA A  11       7.727   3.673  -2.728  1.00  0.00      A       
ATOM    139  HA  ALA A  11       6.541   5.972  -3.554  1.00  0.00      A       
ATOM    140  HB1 ALA A  11       7.396   3.681  -5.375  1.00  0.00      A       
ATOM    141  HB2 ALA A  11       7.230   5.387  -5.847  1.00  0.00      A       
ATOM    142  HB3 ALA A  11       8.465   4.910  -4.663  1.00  0.00      A       
ATOM    143  N   ALA A  11       6.787   4.070  -2.766  1.00  0.00      A       
ATOM    144  O   ALA A  11       4.270   5.659  -4.598  1.00  0.00      A       
ATOM    145  C   ASP A  12       2.258   3.541  -3.885  1.00  0.00      A       
ATOM    146  CA  ASP A  12       3.261   3.101  -4.951  1.00  0.00      A       
ATOM    147  CB  ASP A  12       3.136   1.609  -5.282  1.00  0.00      A       
ATOM    148  CG  ASP A  12       2.070   1.359  -6.337  1.00  0.00      A       
ATOM    149  HN  ASP A  12       5.212   2.690  -4.205  1.00  0.00      A       
ATOM    150  HA  ASP A  12       3.069   3.661  -5.868  1.00  0.00      A       
ATOM    151  HB1 ASP A  12       2.906   1.048  -4.380  1.00  0.00      A       
ATOM    152  N   ASP A  12       4.613   3.439  -4.531  1.00  0.00      A       
ATOM    153  O   ASP A  12       1.275   4.192  -4.208  1.00  0.00      A       
ATOM    154  OD1 ASP A  12       1.010   2.025  -6.322  1.00  0.00      A       
ATOM    155  OD2 ASP A  12       2.342   0.555  -7.248  1.00  0.00      A       
ATOM    156  C   CYS A  13       1.467   5.287  -1.745  1.00  0.00      A       
ATOM    157  CA  CYS A  13       1.738   3.795  -1.486  1.00  0.00      A       
ATOM    158  CB  CYS A  13       2.512   3.622  -0.164  1.00  0.00      A       
ATOM    159  HN  CYS A  13       3.361   2.720  -2.416  1.00  0.00      A       
ATOM    160  HA  CYS A  13       0.795   3.252  -1.443  1.00  0.00      A       
ATOM    161  HB1 CYS A  13       2.939   4.582   0.119  1.00  0.00      A       
ATOM    162  N   CYS A  13       2.514   3.246  -2.606  1.00  0.00      A       
ATOM    163  O   CYS A  13       0.316   5.717  -1.845  1.00  0.00      A       
ATOM    164  SG  CYS A  13       1.699   3.018   1.345  1.00  0.00      A       
ATOM    165  C   SER A  14       1.626   7.756  -3.469  1.00  0.00      A       
ATOM    166  CA  SER A  14       2.539   7.461  -2.271  1.00  0.00      A       
ATOM    167  CB  SER A  14       3.969   7.979  -2.501  1.00  0.00      A       
ATOM    168  HN  SER A  14       3.453   5.565  -1.880  1.00  0.00      A       
ATOM    169  HA  SER A  14       2.150   7.978  -1.402  1.00  0.00      A       
ATOM    170  HB1 SER A  14       4.162   8.108  -3.567  1.00  0.00      A       
ATOM    171  HG  SER A  14       5.120   9.399  -1.866  1.00  0.00      A       
ATOM    172  N   SER A  14       2.556   6.039  -1.946  1.00  0.00      A       
ATOM    173  O   SER A  14       0.807   8.671  -3.416  1.00  0.00      A       
ATOM    174  OG  SER A  14       4.172   9.211  -1.828  1.00  0.00      A       
ATOM    175  C   ARG A  15      -0.537   7.174  -5.449  1.00  0.00      A       
ATOM    176  CA  ARG A  15       0.964   7.088  -5.763  1.00  0.00      A       
ATOM    177  CB  ARG A  15       1.259   5.903  -6.698  1.00  0.00      A       
ATOM    178  CD  ARG A  15       0.246   4.743  -8.697  1.00  0.00      A       
ATOM    179  CG  ARG A  15       0.758   6.082  -8.136  1.00  0.00      A       
ATOM    180  CZ  ARG A  15       2.184   3.319  -9.407  1.00  0.00      A       
ATOM    181  HN  ARG A  15       2.475   6.247  -4.509  1.00  0.00      A       
ATOM    182  HA  ARG A  15       1.267   8.008  -6.265  1.00  0.00      A       
ATOM    183  HB1 ARG A  15       0.760   5.027  -6.298  1.00  0.00      A       
ATOM    184  HD1 ARG A  15      -0.052   4.864  -9.741  1.00  0.00      A       
ATOM    185  HE  ARG A  15       1.069   3.021  -7.725  1.00  0.00      A       
ATOM    186  HG1 ARG A  15       1.565   6.485  -8.748  1.00  0.00      A       
ATOM    187 HH11 ARG A  15       1.985   5.052 -10.436  1.00  0.00      A       
ATOM    188 HH12 ARG A  15       3.199   3.979 -11.072  1.00  0.00      A       
ATOM    189 HH21 ARG A  15       2.618   1.488  -8.577  1.00  0.00      A       
ATOM    190 HH22 ARG A  15       3.608   1.928  -9.932  1.00  0.00      A       
ATOM    191  N   ARG A  15       1.764   6.974  -4.544  1.00  0.00      A       
ATOM    192  NE  ARG A  15       1.207   3.630  -8.539  1.00  0.00      A       
ATOM    193  NH1 ARG A  15       2.478   4.173 -10.394  1.00  0.00      A       
ATOM    194  NH2 ARG A  15       2.858   2.169  -9.306  1.00  0.00      A       
ATOM    195  O   ARG A  15      -1.237   7.965  -6.074  1.00  0.00      A       
ATOM    196  C   LYS A  16      -2.671   7.584  -3.159  1.00  0.00      A       
ATOM    197  CA  LYS A  16      -2.454   6.429  -4.139  1.00  0.00      A       
ATOM    198  CB  LYS A  16      -2.984   5.128  -3.510  1.00  0.00      A       
ATOM    199  CD  LYS A  16      -1.415   3.327  -4.311  1.00  0.00      A       
ATOM    200  CE  LYS A  16      -1.291   1.802  -4.278  1.00  0.00      A       
ATOM    201  CG  LYS A  16      -2.846   3.866  -4.376  1.00  0.00      A       
ATOM    202  HN  LYS A  16      -0.408   5.761  -3.992  1.00  0.00      A       
ATOM    203  HA  LYS A  16      -3.059   6.621  -5.027  1.00  0.00      A       
ATOM    204  HB1 LYS A  16      -4.050   5.281  -3.334  1.00  0.00      A       
ATOM    205  HD1 LYS A  16      -0.962   3.676  -3.382  1.00  0.00      A       
ATOM    206  HE1 LYS A  16      -2.063   1.376  -3.646  1.00  0.00      A       
ATOM    207  HG1 LYS A  16      -3.136   4.086  -5.404  1.00  0.00      A       
ATOM    208  HZ1 LYS A  16      -2.179   1.500  -6.120  1.00  0.00      A       
ATOM    209  HZ2 LYS A  16      -0.515   1.422  -6.114  1.00  0.00      A       
ATOM    210  HZ3 LYS A  16      -1.422   0.176  -5.469  1.00  0.00      A       
ATOM    211  N   LYS A  16      -1.045   6.350  -4.521  1.00  0.00      A       
ATOM    212  NZ  LYS A  16      -1.371   1.184  -5.610  1.00  0.00      A       
ATOM    213  O   LYS A  16      -3.593   8.380  -3.326  1.00  0.00      A       
ATOM    214  C   CYS A  17      -0.674   9.064  -0.575  1.00  0.00      A       
ATOM    215  CA  CYS A  17      -2.043   8.479  -0.936  1.00  0.00      A       
ATOM    216  CB  CYS A  17      -2.654   7.659   0.207  1.00  0.00      A       
ATOM    217  HN  CYS A  17      -1.090   6.959  -2.058  1.00  0.00      A       
ATOM    218  HA  CYS A  17      -2.757   9.268  -1.165  1.00  0.00      A       
ATOM    219  HB1 CYS A  17      -3.670   7.389  -0.080  1.00  0.00      A       
ATOM    220  N   CYS A  17      -1.861   7.622  -2.101  1.00  0.00      A       
ATOM    221  O   CYS A  17       0.191   8.330  -0.102  1.00  0.00      A       
ATOM    222  SG  CYS A  17      -1.788   6.115   0.568  1.00  0.00      A       
ATOM    223  C   PRO A  18       1.579  11.004   0.465  1.00  0.00      A       
ATOM    224  CA  PRO A  18       0.909  10.918  -0.907  1.00  0.00      A       
ATOM    225  CB  PRO A  18       0.751  12.297  -1.558  1.00  0.00      A       
ATOM    226  CD  PRO A  18      -1.413  11.351  -1.256  1.00  0.00      A       
ATOM    227  CG  PRO A  18      -0.680  12.691  -1.197  1.00  0.00      A       
ATOM    228  HA  PRO A  18       1.537  10.301  -1.550  1.00  0.00      A       
ATOM    229  HB1 PRO A  18       0.826  12.190  -2.641  1.00  0.00      A       
ATOM    230  HD1 PRO A  18      -1.734  11.148  -2.279  1.00  0.00      A       
ATOM    231  HG1 PRO A  18      -1.100  13.425  -1.886  1.00  0.00      A       
ATOM    232  N   PRO A  18      -0.432  10.357  -0.850  1.00  0.00      A       
ATOM    233  O   PRO A  18       0.941  10.848   1.504  1.00  0.00      A       
ATOM    234  C   GLY A  19       4.523  10.169   1.933  1.00  0.00      A       
ATOM    235  CA  GLY A  19       3.715  11.431   1.635  1.00  0.00      A       
ATOM    236  HN  GLY A  19       3.335  11.375  -0.454  1.00  0.00      A       
ATOM    237  HA2 GLY A  19       4.412  12.251   1.463  1.00  0.00      A       
ATOM    238  HA1 GLY A  19       3.106  11.680   2.506  1.00  0.00      A       
ATOM    239  N   GLY A  19       2.886  11.281   0.446  1.00  0.00      A       
ATOM    240  O   GLY A  19       5.045  10.021   3.034  1.00  0.00      A       
ATOM    241  C   ASN A  20       5.097   7.207   2.304  1.00  0.00      A       
ATOM    242  CA  ASN A  20       5.426   8.036   1.052  1.00  0.00      A       
ATOM    243  CB  ASN A  20       6.931   8.353   0.971  1.00  0.00      A       
ATOM    244  CG  ASN A  20       7.294   9.209  -0.239  1.00  0.00      A       
ATOM    245  HN  ASN A  20       4.181   9.429   0.066  1.00  0.00      A       
ATOM    246  HA  ASN A  20       5.175   7.413   0.194  1.00  0.00      A       
ATOM    247  HB1 ASN A  20       7.490   7.418   0.902  1.00  0.00      A       
ATOM    248 HD21 ASN A  20       8.463  10.441   0.882  1.00  0.00      A       
ATOM    249 HD22 ASN A  20       8.351  10.825  -0.827  1.00  0.00      A       
ATOM    250  N   ASN A  20       4.647   9.266   0.953  1.00  0.00      A       
ATOM    251  ND2 ASN A  20       8.102  10.246  -0.040  1.00  0.00      A       
ATOM    252  O   ASN A  20       6.014   6.810   3.022  1.00  0.00      A       
ATOM    253  OD1 ASN A  20       6.830   8.967  -1.351  1.00  0.00      A       
ATOM    254  C   PRO A  21       4.071   4.579   3.336  1.00  0.00      A       
ATOM    255  CA  PRO A  21       3.472   5.965   3.637  1.00  0.00      A       
ATOM    256  CB  PRO A  21       1.941   5.956   3.712  1.00  0.00      A       
ATOM    257  CD  PRO A  21       2.628   7.389   1.894  1.00  0.00      A       
ATOM    258  CG  PRO A  21       1.470   6.518   2.368  1.00  0.00      A       
ATOM    259  HA  PRO A  21       3.877   6.347   4.575  1.00  0.00      A       
ATOM    260  HB1 PRO A  21       1.626   6.639   4.502  1.00  0.00      A       
ATOM    261  HD1 PRO A  21       2.422   8.417   2.195  1.00  0.00      A       
ATOM    262  HG1 PRO A  21       0.548   7.093   2.462  1.00  0.00      A       
ATOM    263  N   PRO A  21       3.815   6.904   2.580  1.00  0.00      A       
ATOM    264  O   PRO A  21       4.386   4.276   2.186  1.00  0.00      A       
ATOM    265  C   PRO A  22       3.834   1.402   3.662  1.00  0.00      A       
ATOM    266  CA  PRO A  22       4.863   2.414   4.178  1.00  0.00      A       
ATOM    267  CB  PRO A  22       5.368   2.026   5.569  1.00  0.00      A       
ATOM    268  CD  PRO A  22       4.043   4.008   5.763  1.00  0.00      A       
ATOM    269  CG  PRO A  22       4.361   2.706   6.498  1.00  0.00      A       
ATOM    270  HA  PRO A  22       5.705   2.466   3.485  1.00  0.00      A       
ATOM    271  HB1 PRO A  22       6.354   2.466   5.728  1.00  0.00      A       
ATOM    272  HD1 PRO A  22       4.741   4.782   6.091  1.00  0.00      A       
ATOM    273  HG1 PRO A  22       4.768   2.880   7.495  1.00  0.00      A       
ATOM    274  N   PRO A  22       4.266   3.728   4.354  1.00  0.00      A       
ATOM    275  O   PRO A  22       2.633   1.543   3.901  1.00  0.00      A       
ATOM    276  C   CYS A  23       3.948  -2.014   3.460  1.00  0.00      A       
ATOM    277  CA  CYS A  23       3.510  -0.814   2.631  1.00  0.00      A       
ATOM    278  CB  CYS A  23       3.607  -1.128   1.132  1.00  0.00      A       
ATOM    279  HN  CYS A  23       5.313   0.282   2.846  1.00  0.00      A       
ATOM    280  HA  CYS A  23       2.468  -0.613   2.861  1.00  0.00      A       
ATOM    281  HB1 CYS A  23       3.011  -2.017   0.929  1.00  0.00      A       
ATOM    282  N   CYS A  23       4.318   0.345   2.998  1.00  0.00      A       
ATOM    283  O   CYS A  23       5.107  -2.100   3.878  1.00  0.00      A       
ATOM    284  SG  CYS A  23       2.967   0.187   0.079  1.00  0.00      A       
ATOM    285  C   ARG A  24       2.453  -5.278   3.724  1.00  0.00      A       
ATOM    286  CA  ARG A  24       3.289  -4.198   4.407  1.00  0.00      A       
ATOM    287  CB  ARG A  24       2.940  -4.045   5.899  1.00  0.00      A       
ATOM    288  CD  ARG A  24       5.110  -4.119   7.271  1.00  0.00      A       
ATOM    289  CG  ARG A  24       3.859  -4.883   6.802  1.00  0.00      A       
ATOM    290  CZ  ARG A  24       7.113  -3.239   5.996  1.00  0.00      A       
ATOM    291  HN  ARG A  24       2.089  -2.821   3.344  1.00  0.00      A       
ATOM    292  HA  ARG A  24       4.339  -4.463   4.283  1.00  0.00      A       
ATOM    293  HB1 ARG A  24       1.906  -4.366   6.047  1.00  0.00      A       
ATOM    294  HD1 ARG A  24       5.759  -4.842   7.768  1.00  0.00      A       
ATOM    295  HE  ARG A  24       5.203  -2.994   5.458  1.00  0.00      A       
ATOM    296  HG1 ARG A  24       4.147  -5.802   6.290  1.00  0.00      A       
ATOM    297 HH11 ARG A  24       7.671  -4.128   7.741  1.00  0.00      A       
ATOM    298 HH12 ARG A  24       8.989  -3.552   6.770  1.00  0.00      A       
ATOM    299 HH21 ARG A  24       6.801  -2.271   4.252  1.00  0.00      A       
ATOM    300 HH22 ARG A  24       8.495  -2.419   4.693  1.00  0.00      A       
ATOM    301  N   ARG A  24       3.031  -2.949   3.709  1.00  0.00      A       
ATOM    302  NE  ARG A  24       5.795  -3.426   6.165  1.00  0.00      A       
ATOM    303  NH1 ARG A  24       7.997  -3.679   6.898  1.00  0.00      A       
ATOM    304  NH2 ARG A  24       7.524  -2.598   4.899  1.00  0.00      A       
ATOM    305  O   ARG A  24       1.335  -5.005   3.298  1.00  0.00      A       
ATOM    306  C   ASN A  25       1.980  -7.087   1.375  1.00  0.00      A       
ATOM    307  CA  ASN A  25       2.393  -7.562   2.782  1.00  0.00      A       
ATOM    308  CB  ASN A  25       1.228  -8.151   3.599  1.00  0.00      A       
ATOM    309  CG  ASN A  25       0.901  -9.603   3.241  1.00  0.00      A       
ATOM    310  HN  ASN A  25       3.942  -6.641   3.913  1.00  0.00      A       
ATOM    311  HA  ASN A  25       3.148  -8.341   2.661  1.00  0.00      A       
ATOM    312  HB1 ASN A  25       0.336  -7.536   3.494  1.00  0.00      A       
ATOM    313 HD21 ASN A  25       0.262  -9.103   1.384  1.00  0.00      A       
ATOM    314 HD22 ASN A  25       0.147 -10.812   1.812  1.00  0.00      A       
ATOM    315  N   ASN A  25       3.020  -6.476   3.539  1.00  0.00      A       
ATOM    316  ND2 ASN A  25       0.390  -9.863   2.045  1.00  0.00      A       
ATOM    317  O   ASN A  25       1.008  -7.563   0.795  1.00  0.00      A       
ATOM    318  OD1 ASN A  25       1.114 -10.498   4.051  1.00  0.00      A       
ATOM    319  C   GLY A  26       1.033  -4.797  -0.455  1.00  0.00      A       
ATOM    320  CA  GLY A  26       2.390  -5.509  -0.462  1.00  0.00      A       
ATOM    321  HN  GLY A  26       3.527  -5.783   1.312  1.00  0.00      A       
ATOM    322  HA2 GLY A  26       3.160  -4.772  -0.701  1.00  0.00      A       
ATOM    323  HA1 GLY A  26       2.394  -6.273  -1.240  1.00  0.00      A       
ATOM    324  N   GLY A  26       2.719  -6.124   0.815  1.00  0.00      A       
ATOM    325  O   GLY A  26       0.393  -4.691  -1.503  1.00  0.00      A       
ATOM    326  C   PHE A  27      -0.170  -2.133   1.525  1.00  0.00      A       
ATOM    327  CA  PHE A  27      -0.573  -3.423   0.817  1.00  0.00      A       
ATOM    328  CB  PHE A  27      -1.672  -4.161   1.582  1.00  0.00      A       
ATOM    329  CD1 PHE A  27      -3.181  -5.105  -0.213  1.00  0.00      A       
ATOM    330  CD2 PHE A  27      -1.873  -6.649   1.126  1.00  0.00      A       
ATOM    331  CE1 PHE A  27      -3.784  -6.186  -0.877  1.00  0.00      A       
ATOM    332  CE2 PHE A  27      -2.436  -7.731   0.430  1.00  0.00      A       
ATOM    333  CG  PHE A  27      -2.252  -5.333   0.815  1.00  0.00      A       
ATOM    334  CZ  PHE A  27      -3.402  -7.501  -0.564  1.00  0.00      A       
ATOM    335  HN  PHE A  27       1.127  -4.422   1.549  1.00  0.00      A       
ATOM    336  HA  PHE A  27      -0.957  -3.168  -0.169  1.00  0.00      A       
ATOM    337  HB1 PHE A  27      -2.477  -3.455   1.784  1.00  0.00      A       
ATOM    338  HD1 PHE A  27      -3.472  -4.098  -0.455  1.00  0.00      A       
ATOM    339  HD2 PHE A  27      -1.193  -6.838   1.941  1.00  0.00      A       
ATOM    340  HE1 PHE A  27      -4.571  -6.004  -1.597  1.00  0.00      A       
ATOM    341  HE2 PHE A  27      -2.180  -8.739   0.723  1.00  0.00      A       
ATOM    342  HZ  PHE A  27      -3.881  -8.337  -1.056  1.00  0.00      A       
ATOM    343  N   PHE A  27       0.604  -4.268   0.693  1.00  0.00      A       
ATOM    344  O   PHE A  27       0.634  -2.172   2.454  1.00  0.00      A       
ATOM    345  C   CYS A  28      -0.979   0.534   2.941  1.00  0.00      A       
ATOM    346  CA  CYS A  28      -0.335   0.317   1.574  1.00  0.00      A       
ATOM    347  CB  CYS A  28      -0.763   1.401   0.582  1.00  0.00      A       
ATOM    348  HN  CYS A  28      -1.382  -1.050   0.324  1.00  0.00      A       
ATOM    349  HA  CYS A  28       0.741   0.365   1.697  1.00  0.00      A       
ATOM    350  HB1 CYS A  28      -1.840   1.355   0.437  1.00  0.00      A       
ATOM    351  N   CYS A  28      -0.683  -0.996   1.056  1.00  0.00      A       
ATOM    352  O   CYS A  28      -2.154   0.220   3.116  1.00  0.00      A       
ATOM    353  SG  CYS A  28      -0.357   3.074   1.113  1.00  0.00      A       
ATOM    354  C   ALA A  29      -1.790   2.277   5.382  1.00  0.00      A       
ATOM    355  CA  ALA A  29      -0.690   1.215   5.278  1.00  0.00      A       
ATOM    356  CB  ALA A  29       0.487   1.574   6.187  1.00  0.00      A       
ATOM    357  HN  ALA A  29       0.769   1.247   3.728  1.00  0.00      A       
ATOM    358  HA  ALA A  29      -1.103   0.267   5.625  1.00  0.00      A       
ATOM    359  HB1 ALA A  29       0.137   1.676   7.216  1.00  0.00      A       
ATOM    360  HB2 ALA A  29       1.239   0.788   6.147  1.00  0.00      A       
ATOM    361  HB3 ALA A  29       0.930   2.519   5.868  1.00  0.00      A       
ATOM    362  N   ALA A  29      -0.210   1.038   3.912  1.00  0.00      A       
ATOM    363  O   ALA A  29      -2.595   2.237   6.309  1.00  0.00      A       
ATOM    364  C   CYS A  30      -4.198   3.771   4.293  1.00  0.00      A       
ATOM    365  CA  CYS A  30      -2.788   4.331   4.504  1.00  0.00      A       
ATOM    366  CB  CYS A  30      -2.452   5.399   3.458  1.00  0.00      A       
ATOM    367  HN  CYS A  30      -1.156   3.209   3.698  1.00  0.00      A       
ATOM    368  HA  CYS A  30      -2.726   4.797   5.490  1.00  0.00      A       
ATOM    369  HB1 CYS A  30      -1.370   5.517   3.409  1.00  0.00      A       
ATOM    370  N   CYS A  30      -1.802   3.256   4.472  1.00  0.00      A       
ATOM    371  O   CYS A  30      -4.392   2.804   3.558  1.00  0.00      A       
ATOM    372  SG  CYS A  30      -3.062   5.034   1.797  1.00  0.00      A       
ATOM    373  C   THR A  31      -7.061   4.208   3.355  1.00  0.00      A       
ATOM    374  CA  THR A  31      -6.579   3.960   4.786  1.00  0.00      A       
ATOM    375  CB  THR A  31      -7.474   4.645   5.832  1.00  0.00      A       
ATOM    376  CG2 THR A  31      -7.497   6.173   5.706  1.00  0.00      A       
ATOM    377  HN  THR A  31      -4.985   5.171   5.528  1.00  0.00      A       
ATOM    378  HA  THR A  31      -6.633   2.885   4.964  1.00  0.00      A       
ATOM    379  HB  THR A  31      -7.110   4.380   6.825  1.00  0.00      A       
ATOM    380  HG1 THR A  31      -9.329   4.497   6.415  1.00  0.00      A       
ATOM    381 HG21 THR A  31      -7.893   6.473   4.735  1.00  0.00      A       
ATOM    382 HG22 THR A  31      -8.135   6.593   6.486  1.00  0.00      A       
ATOM    383 HG23 THR A  31      -6.497   6.587   5.824  1.00  0.00      A       
ATOM    384  N   THR A  31      -5.192   4.377   4.945  1.00  0.00      A       
ATOM    385  OT1 THR A  31      -6.574   5.110   2.673  1.00  0.00      A       
ATOM    386  OG1 THR A  31      -8.791   4.155   5.697  1.00  0.00      A       
END


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