NMR Restraints Grid

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

image mrblock_id pdb_id cing in_recoord in_dress stage program type subtype
371677 1cq0 cing recoord dress 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   PHE A   1      14.345  -1.866   8.638  1.00  0.00      A       
ATOM      2  CA  PHE A   1      14.136  -0.728   9.641  1.00  0.00      A       
ATOM      3  CB  PHE A   1      12.798  -0.887  10.364  1.00  0.00      A       
ATOM      4  CD1 PHE A   1      13.436   1.077  11.808  1.00  0.00      A       
ATOM      5  CD2 PHE A   1      11.153   0.911  11.007  1.00  0.00      A       
ATOM      6  CE1 PHE A   1      13.117   2.269  12.470  1.00  0.00      A       
ATOM      7  CE2 PHE A   1      10.835   2.103  11.668  1.00  0.00      A       
ATOM      8  CG  PHE A   1      12.454   0.398  11.077  1.00  0.00      A       
ATOM      9  CZ  PHE A   1      11.816   2.782  12.400  1.00  0.00      A       
ATOM     10  HT1 PHE A   1      14.375   1.340   9.544  1.00  0.00      A       
ATOM     11  HT2 PHE A   1      13.043   0.754   8.667  1.00  0.00      A       
ATOM     12  HT3 PHE A   1      14.618   0.547   8.065  1.00  0.00      A       
ATOM     13  HA  PHE A   1      14.942  -0.703  10.357  1.00  0.00      A       
ATOM     14  HB2 PHE A   1      12.026  -1.118   9.644  1.00  0.00      A       
ATOM     15  HB1 PHE A   1      12.871  -1.689  11.083  1.00  0.00      A       
ATOM     16  HD1 PHE A   1      14.439   0.681  11.862  1.00  0.00      A       
ATOM     17  HD2 PHE A   1      10.396   0.387  10.443  1.00  0.00      A       
ATOM     18  HE1 PHE A   1      13.874   2.793  13.034  1.00  0.00      A       
ATOM     19  HE2 PHE A   1       9.831   2.499  11.614  1.00  0.00      A       
ATOM     20  HZ  PHE A   1      11.570   3.702  12.910  1.00  0.00      A       
ATOM     21  N   PHE A   1      14.035   0.577   8.925  1.00  0.00      A       
ATOM     22  O   PHE A   1      15.087  -2.795   8.886  1.00  0.00      A       
ATOM     23  C   SER A   2      14.875  -2.456   5.430  1.00  0.00      A       
ATOM     24  CA  SER A   2      13.857  -2.879   6.492  1.00  0.00      A       
ATOM     25  CB  SER A   2      12.471  -3.046   5.869  1.00  0.00      A       
ATOM     26  HN  SER A   2      13.101  -1.042   7.328  1.00  0.00      A       
ATOM     27  HA  SER A   2      14.163  -3.799   6.963  1.00  0.00      A       
ATOM     28  HB2 SER A   2      12.281  -4.090   5.684  1.00  0.00      A       
ATOM     29  HB1 SER A   2      11.723  -2.661   6.550  1.00  0.00      A       
ATOM     30  HG  SER A   2      12.311  -1.404   4.838  1.00  0.00      A       
ATOM     31  N   SER A   2      13.695  -1.800   7.509  1.00  0.00      A       
ATOM     32  O   SER A   2      15.504  -1.422   5.536  1.00  0.00      A       
ATOM     33  OG  SER A   2      12.420  -2.336   4.639  1.00  0.00      A       
ATOM     34  C   GLY A   3      15.318  -2.063   2.260  1.00  0.00      A       
ATOM     35  CA  GLY A   3      16.019  -2.890   3.339  1.00  0.00      A       
ATOM     36  HN  GLY A   3      14.525  -4.077   4.338  1.00  0.00      A       
ATOM     37  HA2 GLY A   3      16.826  -2.313   3.769  1.00  0.00      A       
ATOM     38  HA1 GLY A   3      16.416  -3.791   2.896  1.00  0.00      A       
ATOM     39  N   GLY A   3      15.042  -3.247   4.406  1.00  0.00      A       
ATOM     40  O   GLY A   3      15.322  -0.849   2.307  1.00  0.00      A       
ATOM     41  C   PRO A   4      12.697  -1.490   0.710  1.00  0.00      A       
ATOM     42  CA  PRO A   4      14.019  -2.082   0.209  1.00  0.00      A       
ATOM     43  CB  PRO A   4      13.766  -3.209  -0.788  1.00  0.00      A       
ATOM     44  CD  PRO A   4      14.693  -4.217   1.202  1.00  0.00      A       
ATOM     45  CG  PRO A   4      13.777  -4.461   0.030  1.00  0.00      A       
ATOM     46  HA  PRO A   4      14.636  -1.322  -0.240  1.00  0.00      A       
ATOM     47  HB2 PRO A   4      12.805  -3.078  -1.266  1.00  0.00      A       
ATOM     48  HB1 PRO A   4      14.553  -3.243  -1.525  1.00  0.00      A       
ATOM     49  HD2 PRO A   4      14.284  -4.661   2.099  1.00  0.00      A       
ATOM     50  HD1 PRO A   4      15.680  -4.603   1.000  1.00  0.00      A       
ATOM     51  HG2 PRO A   4      12.778  -4.681   0.379  1.00  0.00      A       
ATOM     52  HG1 PRO A   4      14.153  -5.284  -0.559  1.00  0.00      A       
ATOM     53  N   PRO A   4      14.737  -2.755   1.319  1.00  0.00      A       
ATOM     54  O   PRO A   4      11.790  -2.213   1.070  1.00  0.00      A       
ATOM     55  C   PRO A   5      10.435   0.724   0.026  1.00  0.00      A       
ATOM     56  CA  PRO A   5      11.422   0.529   1.173  1.00  0.00      A       
ATOM     57  CB  PRO A   5      11.962   1.873   1.632  1.00  0.00      A       
ATOM     58  CD  PRO A   5      13.687   0.746   0.313  1.00  0.00      A       
ATOM     59  CG  PRO A   5      13.225   2.083   0.844  1.00  0.00      A       
ATOM     60  HA  PRO A   5      10.961   0.006   1.980  1.00  0.00      A       
ATOM     61  HB2 PRO A   5      11.247   2.656   1.417  1.00  0.00      A       
ATOM     62  HB1 PRO A   5      12.187   1.848   2.687  1.00  0.00      A       
ATOM     63  HD2 PRO A   5      13.775   0.779  -0.765  1.00  0.00      A       
ATOM     64  HD1 PRO A   5      14.626   0.464   0.763  1.00  0.00      A       
ATOM     65  HG2 PRO A   5      13.027   2.751   0.018  1.00  0.00      A       
ATOM     66  HG1 PRO A   5      13.986   2.500   1.479  1.00  0.00      A       
ATOM     67  N   PRO A   5      12.636  -0.183   0.715  1.00  0.00      A       
ATOM     68  O   PRO A   5       9.603   1.609   0.042  1.00  0.00      A       
ATOM     69  C   GLY A   6       8.838  -1.303  -2.292  1.00  0.00      A       
ATOM     70  CA  GLY A   6       9.609   0.008  -2.127  1.00  0.00      A       
ATOM     71  HN  GLY A   6      11.208  -0.791  -0.928  1.00  0.00      A       
ATOM     72  HA2 GLY A   6       8.913   0.819  -1.964  1.00  0.00      A       
ATOM     73  HA1 GLY A   6      10.182   0.199  -3.021  1.00  0.00      A       
ATOM     74  N   GLY A   6      10.529  -0.099  -0.959  1.00  0.00      A       
ATOM     75  O   GLY A   6       7.684  -1.312  -2.674  1.00  0.00      A       
ATOM     76  C   LEU A   7       7.606  -3.806  -1.157  1.00  0.00      A       
ATOM     77  CA  LEU A   7       8.768  -3.720  -2.144  1.00  0.00      A       
ATOM     78  CB  LEU A   7       9.832  -4.772  -1.824  1.00  0.00      A       
ATOM     79  CD1 LEU A   7      11.578  -4.628  -3.605  1.00  0.00      A       
ATOM     80  CD2 LEU A   7      10.716  -6.857  -2.877  1.00  0.00      A       
ATOM     81  CG  LEU A   7      10.343  -5.393  -3.124  1.00  0.00      A       
ATOM     82  HN  LEU A   7      10.395  -2.382  -1.697  1.00  0.00      A       
ATOM     83  HA  LEU A   7       8.413  -3.855  -3.145  1.00  0.00      A       
ATOM     84  HB2 LEU A   7      10.653  -4.305  -1.299  1.00  0.00      A       
ATOM     85  HB1 LEU A   7       9.401  -5.543  -1.204  1.00  0.00      A       
ATOM     86 HD11 LEU A   7      11.508  -3.597  -3.291  1.00  0.00      A       
ATOM     87 HD12 LEU A   7      11.632  -4.673  -4.683  1.00  0.00      A       
ATOM     88 HD13 LEU A   7      12.465  -5.074  -3.182  1.00  0.00      A       
ATOM     89 HD21 LEU A   7      10.761  -7.042  -1.814  1.00  0.00      A       
ATOM     90 HD22 LEU A   7      11.680  -7.062  -3.319  1.00  0.00      A       
ATOM     91 HD23 LEU A   7       9.971  -7.498  -3.323  1.00  0.00      A       
ATOM     92  HG  LEU A   7       9.571  -5.338  -3.877  1.00  0.00      A       
ATOM     93  N   LEU A   7       9.465  -2.411  -2.005  1.00  0.00      A       
ATOM     94  O   LEU A   7       6.482  -3.462  -1.467  1.00  0.00      A       
ATOM     95  C   GLN A   8       6.015  -3.063   1.107  1.00  0.00      A       
ATOM     96  CA  GLN A   8       6.793  -4.371   1.045  1.00  0.00      A       
ATOM     97  CB  GLN A   8       7.511  -4.640   2.368  1.00  0.00      A       
ATOM     98  CD  GLN A   8       8.144  -6.404   4.021  1.00  0.00      A       
ATOM     99  CG  GLN A   8       7.327  -6.106   2.762  1.00  0.00      A       
ATOM    100  HN  GLN A   8       8.781  -4.527   0.250  1.00  0.00      A       
ATOM    101  HA  GLN A   8       6.142  -5.184   0.805  1.00  0.00      A       
ATOM    102  HB2 GLN A   8       8.564  -4.426   2.256  1.00  0.00      A       
ATOM    103  HB1 GLN A   8       7.096  -4.007   3.138  1.00  0.00      A       
ATOM    104 HE21 GLN A   8       8.767  -8.173   3.370  1.00  0.00      A       
ATOM    105 HE22 GLN A   8       9.327  -7.728   4.909  1.00  0.00      A       
ATOM    106  HG2 GLN A   8       6.281  -6.298   2.957  1.00  0.00      A       
ATOM    107  HG1 GLN A   8       7.665  -6.741   1.957  1.00  0.00      A       
ATOM    108  N   GLN A   8       7.872  -4.261   0.029  1.00  0.00      A       
ATOM    109  NE2 GLN A   8       8.800  -7.528   4.107  1.00  0.00      A       
ATOM    110  O   GLN A   8       4.849  -3.027   1.454  1.00  0.00      A       
ATOM    111  OE1 GLN A   8       8.185  -5.605   4.936  1.00  0.00      A       
ATOM    112  C   GLY A   9       4.999  -0.642  -0.412  1.00  0.00      A       
ATOM    113  CA  GLY A   9       5.973  -0.674   0.755  1.00  0.00      A       
ATOM    114  HN  GLY A   9       7.585  -2.064   0.451  1.00  0.00      A       
ATOM    115  HA2 GLY A   9       5.437  -0.547   1.686  1.00  0.00      A       
ATOM    116  HA1 GLY A   9       6.699   0.116   0.639  1.00  0.00      A       
ATOM    117  N   GLY A   9       6.656  -1.993   0.747  1.00  0.00      A       
ATOM    118  O   GLY A   9       3.798  -0.619  -0.233  1.00  0.00      A       
ATOM    119  C   ARG A  10       3.629  -1.834  -2.643  1.00  0.00      A       
ATOM    120  CA  ARG A  10       4.604  -0.674  -2.788  1.00  0.00      A       
ATOM    121  CB  ARG A  10       5.516  -0.872  -4.000  1.00  0.00      A       
ATOM    122  CD  ARG A  10       5.679  -0.628  -6.482  1.00  0.00      A       
ATOM    123  CG  ARG A  10       4.729  -0.594  -5.283  1.00  0.00      A       
ATOM    124  CZ  ARG A  10       5.242  -0.743  -8.861  1.00  0.00      A       
ATOM    125  HN  ARG A  10       6.475  -0.713  -1.734  1.00  0.00      A       
ATOM    126  HA  ARG A  10       4.083   0.254  -2.857  1.00  0.00      A       
ATOM    127  HB2 ARG A  10       6.353  -0.192  -3.935  1.00  0.00      A       
ATOM    128  HB1 ARG A  10       5.878  -1.889  -4.016  1.00  0.00      A       
ATOM    129  HD2 ARG A  10       6.402   0.173  -6.410  1.00  0.00      A       
ATOM    130  HD1 ARG A  10       6.177  -1.583  -6.541  1.00  0.00      A       
ATOM    131  HE  ARG A  10       3.897  -0.079  -7.560  1.00  0.00      A       
ATOM    132  HG2 ARG A  10       3.964  -1.347  -5.406  1.00  0.00      A       
ATOM    133  HG1 ARG A  10       4.269   0.381  -5.219  1.00  0.00      A       
ATOM    134 HH11 ARG A  10       7.165  -0.791  -8.307  1.00  0.00      A       
ATOM    135 HH12 ARG A  10       6.857  -1.139  -9.976  1.00  0.00      A       
ATOM    136 HH21 ARG A  10       3.421  -0.767  -9.694  1.00  0.00      A       
ATOM    137 HH22 ARG A  10       4.738  -1.125 -10.761  1.00  0.00      A       
ATOM    138  N   ARG A  10       5.507  -0.672  -1.612  1.00  0.00      A       
ATOM    139  NE  ARG A  10       4.803  -0.436  -7.671  1.00  0.00      A       
ATOM    140  NH1 ARG A  10       6.521  -0.903  -9.064  1.00  0.00      A       
ATOM    141  NH2 ARG A  10       4.402  -0.890  -9.849  1.00  0.00      A       
ATOM    142  O   ARG A  10       2.488  -1.774  -3.056  1.00  0.00      A       
ATOM    143  C   LEU A  11       2.171  -3.720  -0.776  1.00  0.00      A       
ATOM    144  CA  LEU A  11       3.236  -4.067  -1.797  1.00  0.00      A       
ATOM    145  CB  LEU A  11       4.181  -5.139  -1.253  1.00  0.00      A       
ATOM    146  CD1 LEU A  11       6.190  -6.520  -1.800  1.00  0.00      A       
ATOM    147  CD2 LEU A  11       4.231  -6.496  -3.350  1.00  0.00      A       
ATOM    148  CG  LEU A  11       5.071  -5.656  -2.385  1.00  0.00      A       
ATOM    149  HN  LEU A  11       4.990  -2.876  -1.697  1.00  0.00      A       
ATOM    150  HA  LEU A  11       2.796  -4.390  -2.708  1.00  0.00      A       
ATOM    151  HB2 LEU A  11       4.797  -4.715  -0.474  1.00  0.00      A       
ATOM    152  HB1 LEU A  11       3.603  -5.957  -0.850  1.00  0.00      A       
ATOM    153 HD11 LEU A  11       7.141  -6.036  -1.964  1.00  0.00      A       
ATOM    154 HD12 LEU A  11       6.190  -7.486  -2.285  1.00  0.00      A       
ATOM    155 HD13 LEU A  11       6.029  -6.649  -0.740  1.00  0.00      A       
ATOM    156 HD21 LEU A  11       4.534  -7.531  -3.283  1.00  0.00      A       
ATOM    157 HD22 LEU A  11       4.380  -6.141  -4.359  1.00  0.00      A       
ATOM    158 HD23 LEU A  11       3.187  -6.409  -3.088  1.00  0.00      A       
ATOM    159  HG  LEU A  11       5.502  -4.819  -2.914  1.00  0.00      A       
ATOM    160  N   LEU A  11       4.087  -2.881  -2.026  1.00  0.00      A       
ATOM    161  O   LEU A  11       1.027  -3.538  -1.099  1.00  0.00      A       
ATOM    162  C   GLN A  12       0.765  -2.034   1.028  1.00  0.00      A       
ATOM    163  CA  GLN A  12       1.555  -3.250   1.492  1.00  0.00      A       
ATOM    164  CB  GLN A  12       2.375  -2.923   2.741  1.00  0.00      A       
ATOM    165  CD  GLN A  12       2.557  -4.514   4.659  1.00  0.00      A       
ATOM    166  CG  GLN A  12       3.059  -4.193   3.250  1.00  0.00      A       
ATOM    167  HN  GLN A  12       3.473  -3.743   0.686  1.00  0.00      A       
ATOM    168  HA  GLN A  12       0.902  -4.073   1.680  1.00  0.00      A       
ATOM    169  HB2 GLN A  12       3.123  -2.183   2.496  1.00  0.00      A       
ATOM    170  HB1 GLN A  12       1.723  -2.536   3.509  1.00  0.00      A       
ATOM    171 HE21 GLN A  12       4.375  -4.851   5.383  1.00  0.00      A       
ATOM    172 HE22 GLN A  12       3.106  -5.032   6.495  1.00  0.00      A       
ATOM    173  HG2 GLN A  12       2.829  -5.016   2.588  1.00  0.00      A       
ATOM    174  HG1 GLN A  12       4.128  -4.041   3.276  1.00  0.00      A       
ATOM    175  N   GLN A  12       2.546  -3.606   0.453  1.00  0.00      A       
ATOM    176  NE2 GLN A  12       3.418  -4.825   5.589  1.00  0.00      A       
ATOM    177  O   GLN A  12      -0.405  -1.890   1.308  1.00  0.00      A       
ATOM    178  OE1 GLN A  12       1.370  -4.482   4.915  1.00  0.00      A       
ATOM    179  C   ARG A  13      -0.270  -0.341  -1.291  1.00  0.00      A       
ATOM    180  CA  ARG A  13       0.715   0.042  -0.201  1.00  0.00      A       
ATOM    181  CB  ARG A  13       1.821   0.934  -0.765  1.00  0.00      A       
ATOM    182  CD  ARG A  13       2.312   3.093  -1.924  1.00  0.00      A       
ATOM    183  CG  ARG A  13       1.202   2.186  -1.388  1.00  0.00      A       
ATOM    184  CZ  ARG A  13       1.453   4.919  -0.585  1.00  0.00      A       
ATOM    185  HN  ARG A  13       2.336  -1.323   0.083  1.00  0.00      A       
ATOM    186  HA  ARG A  13       0.217   0.538   0.594  1.00  0.00      A       
ATOM    187  HB2 ARG A  13       2.493   1.221   0.031  1.00  0.00      A       
ATOM    188  HB1 ARG A  13       2.370   0.392  -1.521  1.00  0.00      A       
ATOM    189  HD2 ARG A  13       3.215   2.963  -1.343  1.00  0.00      A       
ATOM    190  HD1 ARG A  13       2.499   2.885  -2.965  1.00  0.00      A       
ATOM    191  HE  ARG A  13       1.689   5.057  -2.551  1.00  0.00      A       
ATOM    192  HG2 ARG A  13       0.548   1.898  -2.199  1.00  0.00      A       
ATOM    193  HG1 ARG A  13       0.635   2.718  -0.639  1.00  0.00      A       
ATOM    194 HH11 ARG A  13       3.067   4.156   0.322  1.00  0.00      A       
ATOM    195 HH12 ARG A  13       1.968   5.018   1.348  1.00  0.00      A       
ATOM    196 HH21 ARG A  13      -0.238   5.785  -1.215  1.00  0.00      A       
ATOM    197 HH22 ARG A  13       0.097   5.940   0.477  1.00  0.00      A       
ATOM    198  N   ARG A  13       1.404  -1.168   0.303  1.00  0.00      A       
ATOM    199  NE  ARG A  13       1.786   4.477  -1.767  1.00  0.00      A       
ATOM    200  NH1 ARG A  13       2.223   4.679   0.442  1.00  0.00      A       
ATOM    201  NH2 ARG A  13       0.352   5.601  -0.429  1.00  0.00      A       
ATOM    202  O   ARG A  13      -1.469  -0.209  -1.144  1.00  0.00      A       
ATOM    203  C   LEU A  14      -1.608  -2.329  -3.002  1.00  0.00      A       
ATOM    204  CA  LEU A  14      -0.669  -1.234  -3.493  1.00  0.00      A       
ATOM    205  CB  LEU A  14       0.252  -1.739  -4.613  1.00  0.00      A       
ATOM    206  CD1 LEU A  14      -0.355  -4.165  -4.721  1.00  0.00      A       
ATOM    207  CD2 LEU A  14       2.004  -3.448  -5.112  1.00  0.00      A       
ATOM    208  CG  LEU A  14       0.729  -3.164  -4.315  1.00  0.00      A       
ATOM    209  HN  LEU A  14       1.203  -0.927  -2.455  1.00  0.00      A       
ATOM    210  HA  LEU A  14      -1.235  -0.392  -3.833  1.00  0.00      A       
ATOM    211  HB2 LEU A  14      -0.288  -1.732  -5.549  1.00  0.00      A       
ATOM    212  HB1 LEU A  14       1.109  -1.086  -4.691  1.00  0.00      A       
ATOM    213 HD11 LEU A  14      -0.867  -4.519  -3.839  1.00  0.00      A       
ATOM    214 HD12 LEU A  14       0.100  -5.000  -5.232  1.00  0.00      A       
ATOM    215 HD13 LEU A  14      -1.062  -3.682  -5.379  1.00  0.00      A       
ATOM    216 HD21 LEU A  14       2.848  -3.487  -4.439  1.00  0.00      A       
ATOM    217 HD22 LEU A  14       2.157  -2.663  -5.837  1.00  0.00      A       
ATOM    218 HD23 LEU A  14       1.906  -4.395  -5.622  1.00  0.00      A       
ATOM    219  HG  LEU A  14       0.934  -3.263  -3.260  1.00  0.00      A       
ATOM    220  N   LEU A  14       0.233  -0.826  -2.379  1.00  0.00      A       
ATOM    221  O   LEU A  14      -2.752  -2.420  -3.402  1.00  0.00      A       
ATOM    222  C   LEU A  15      -3.006  -3.640  -0.618  1.00  0.00      A       
ATOM    223  CA  LEU A  15      -1.972  -4.234  -1.557  1.00  0.00      A       
ATOM    224  CB  LEU A  15      -1.013  -5.150  -0.795  1.00  0.00      A       
ATOM    225  CD1 LEU A  15       1.123  -6.431  -0.996  1.00  0.00      A       
ATOM    226  CD2 LEU A  15      -0.745  -6.858  -2.597  1.00  0.00      A       
ATOM    227  CG  LEU A  15      -0.026  -5.787  -1.774  1.00  0.00      A       
ATOM    228  HN  LEU A  15      -0.202  -3.023  -1.800  1.00  0.00      A       
ATOM    229  HA  LEU A  15      -2.452  -4.774  -2.342  1.00  0.00      A       
ATOM    230  HB2 LEU A  15      -0.473  -4.574  -0.058  1.00  0.00      A       
ATOM    231  HB1 LEU A  15      -1.577  -5.927  -0.300  1.00  0.00      A       
ATOM    232 HD11 LEU A  15       0.828  -7.417  -0.669  1.00  0.00      A       
ATOM    233 HD12 LEU A  15       1.360  -5.823  -0.135  1.00  0.00      A       
ATOM    234 HD13 LEU A  15       1.991  -6.507  -1.633  1.00  0.00      A       
ATOM    235 HD21 LEU A  15      -1.811  -6.772  -2.446  1.00  0.00      A       
ATOM    236 HD22 LEU A  15      -0.414  -7.836  -2.283  1.00  0.00      A       
ATOM    237 HD23 LEU A  15      -0.519  -6.720  -3.644  1.00  0.00      A       
ATOM    238  HG  LEU A  15       0.368  -5.027  -2.434  1.00  0.00      A       
ATOM    239  N   LEU A  15      -1.127  -3.143  -2.115  1.00  0.00      A       
ATOM    240  O   LEU A  15      -4.196  -3.755  -0.830  1.00  0.00      A       
ATOM    241  C   GLN A  16      -4.403  -1.382   0.612  1.00  0.00      A       
ATOM    242  CA  GLN A  16      -3.531  -2.383   1.362  1.00  0.00      A       
ATOM    243  CB  GLN A  16      -2.696  -1.679   2.431  1.00  0.00      A       
ATOM    244  CD  GLN A  16      -2.781  -0.447   4.603  1.00  0.00      A       
ATOM    245  CG  GLN A  16      -3.618  -1.144   3.528  1.00  0.00      A       
ATOM    246  HN  GLN A  16      -1.600  -2.915   0.557  1.00  0.00      A       
ATOM    247  HA  GLN A  16      -4.132  -3.140   1.804  1.00  0.00      A       
ATOM    248  HB2 GLN A  16      -1.995  -2.381   2.859  1.00  0.00      A       
ATOM    249  HB1 GLN A  16      -2.157  -0.858   1.984  1.00  0.00      A       
ATOM    250 HE21 GLN A  16      -3.804  -1.236   6.111  1.00  0.00      A       
ATOM    251 HE22 GLN A  16      -2.533  -0.204   6.558  1.00  0.00      A       
ATOM    252  HG2 GLN A  16      -4.315  -0.438   3.100  1.00  0.00      A       
ATOM    253  HG1 GLN A  16      -4.162  -1.963   3.973  1.00  0.00      A       
ATOM    254  N   GLN A  16      -2.562  -2.996   0.415  1.00  0.00      A       
ATOM    255  NE2 GLN A  16      -3.063  -0.646   5.862  1.00  0.00      A       
ATOM    256  O   GLN A  16      -5.611  -1.356   0.748  1.00  0.00      A       
ATOM    257  OE1 GLN A  16      -1.862   0.285   4.295  1.00  0.00      A       
ATOM    258  C   ALA A  17      -5.447  -0.268  -1.986  1.00  0.00      A       
ATOM    259  CA  ALA A  17      -4.551   0.438  -0.969  1.00  0.00      A       
ATOM    260  CB  ALA A  17      -3.493   1.283  -1.678  1.00  0.00      A       
ATOM    261  HN  ALA A  17      -2.827  -0.624  -0.274  1.00  0.00      A       
ATOM    262  HA  ALA A  17      -5.133   1.053  -0.310  1.00  0.00      A       
ATOM    263  HB1 ALA A  17      -3.958   2.161  -2.101  1.00  0.00      A       
ATOM    264  HB2 ALA A  17      -3.037   0.703  -2.466  1.00  0.00      A       
ATOM    265  HB3 ALA A  17      -2.737   1.584  -0.968  1.00  0.00      A       
ATOM    266  N   ALA A  17      -3.789  -0.568  -0.187  1.00  0.00      A       
ATOM    267  O   ALA A  17      -6.619   0.027  -2.104  1.00  0.00      A       
ATOM    268  C   SER A  18      -6.222  -3.237  -3.107  1.00  0.00      A       
ATOM    269  CA  SER A  18      -5.736  -1.929  -3.710  1.00  0.00      A       
ATOM    270  CB  SER A  18      -4.823  -2.177  -4.910  1.00  0.00      A       
ATOM    271  HN  SER A  18      -3.977  -1.439  -2.608  1.00  0.00      A       
ATOM    272  HA  SER A  18      -6.564  -1.322  -3.988  1.00  0.00      A       
ATOM    273  HB2 SER A  18      -4.087  -1.393  -4.973  1.00  0.00      A       
ATOM    274  HB1 SER A  18      -4.323  -3.129  -4.789  1.00  0.00      A       
ATOM    275  HG  SER A  18      -5.318  -2.927  -6.635  1.00  0.00      A       
ATOM    276  N   SER A  18      -4.910  -1.207  -2.718  1.00  0.00      A       
ATOM    277  O   SER A  18      -6.424  -4.224  -3.786  1.00  0.00      A       
ATOM    278  OG  SER A  18      -5.602  -2.184  -6.099  1.00  0.00      A       
ATOM    279  C   GLY A  19      -7.233  -4.148   0.327  1.00  0.00      A       
ATOM    280  CA  GLY A  19      -6.884  -4.466  -1.131  1.00  0.00      A       
ATOM    281  HN  GLY A  19      -6.231  -2.416  -1.320  1.00  0.00      A       
ATOM    282  HA2 GLY A  19      -7.761  -4.844  -1.637  1.00  0.00      A       
ATOM    283  HA1 GLY A  19      -6.106  -5.214  -1.155  1.00  0.00      A       
ATOM    284  N   GLY A  19      -6.408  -3.235  -1.825  1.00  0.00      A       
ATOM    285  O   GLY A  19      -7.196  -5.011   1.181  1.00  0.00      A       
ATOM    286  C   ASN A  20      -8.595  -1.202   2.078  1.00  0.00      A       
ATOM    287  CA  ASN A  20      -7.933  -2.572   2.030  1.00  0.00      A       
ATOM    288  CB  ASN A  20      -6.607  -2.561   2.791  1.00  0.00      A       
ATOM    289  CG  ASN A  20      -6.849  -2.966   4.246  1.00  0.00      A       
ATOM    290  HN  ASN A  20      -7.610  -2.233  -0.076  1.00  0.00      A       
ATOM    291  HA  ASN A  20      -8.585  -3.309   2.445  1.00  0.00      A       
ATOM    292  HB2 ASN A  20      -5.924  -3.259   2.331  1.00  0.00      A       
ATOM    293  HB1 ASN A  20      -6.183  -1.568   2.762  1.00  0.00      A       
ATOM    294 HD21 ASN A  20      -5.020  -3.698   4.494  1.00  0.00      A       
ATOM    295 HD22 ASN A  20      -6.033  -3.799   5.853  1.00  0.00      A       
ATOM    296  N   ASN A  20      -7.578  -2.922   0.624  1.00  0.00      A       
ATOM    297  ND2 ASN A  20      -5.887  -3.535   4.920  1.00  0.00      A       
ATOM    298  O   ASN A  20      -9.769  -1.071   2.361  1.00  0.00      A       
ATOM    299  OD1 ASN A  20      -7.924  -2.764   4.774  1.00  0.00      A       
ATOM    300  C   HIS A  21      -8.499   1.727   0.384  1.00  0.00      A       
ATOM    301  CA  HIS A  21      -8.421   1.189   1.807  1.00  0.00      A       
ATOM    302  CB  HIS A  21      -7.462   2.023   2.656  1.00  0.00      A       
ATOM    303  CD2 HIS A  21      -8.463   1.232   4.954  1.00  0.00      A       
ATOM    304  CE1 HIS A  21      -8.675   3.174   5.890  1.00  0.00      A       
ATOM    305  CG  HIS A  21      -8.015   2.162   4.048  1.00  0.00      A       
ATOM    306  HN  HIS A  21      -6.913  -0.329   1.562  1.00  0.00      A       
ATOM    307  HA  HIS A  21      -9.400   1.176   2.248  1.00  0.00      A       
ATOM    308  HB2 HIS A  21      -6.500   1.534   2.698  1.00  0.00      A       
ATOM    309  HB1 HIS A  21      -7.349   3.003   2.216  1.00  0.00      A       
ATOM    310  HD1 HIS A  21      -7.929   4.265   4.283  1.00  0.00      A       
ATOM    311  HD2 HIS A  21      -8.489   0.165   4.789  1.00  0.00      A       
ATOM    312  HE1 HIS A  21      -8.897   3.955   6.603  1.00  0.00      A       
ATOM    313  N   HIS A  21      -7.849  -0.185   1.793  1.00  0.00      A       
ATOM    314  ND1 HIS A  21      -8.160   3.393   4.667  1.00  0.00      A       
ATOM    315  NE2 HIS A  21      -8.880   1.874   6.116  1.00  0.00      A       
ATOM    316  O   HIS A  21      -8.341   2.907   0.133  1.00  0.00      A       
ATOM    317  C   ALA A  22      -9.936   2.349  -2.090  1.00  0.00      A       
ATOM    318  CA  ALA A  22      -8.856   1.288  -1.962  1.00  0.00      A       
ATOM    319  CB  ALA A  22      -9.231   0.029  -2.743  1.00  0.00      A       
ATOM    320  HN  ALA A  22      -8.881  -0.077  -0.306  1.00  0.00      A       
ATOM    321  HA  ALA A  22      -7.919   1.669  -2.297  1.00  0.00      A       
ATOM    322  HB1 ALA A  22      -8.512  -0.134  -3.531  1.00  0.00      A       
ATOM    323  HB2 ALA A  22     -10.215   0.151  -3.172  1.00  0.00      A       
ATOM    324  HB3 ALA A  22      -9.233  -0.821  -2.076  1.00  0.00      A       
ATOM    325  N   ALA A  22      -8.753   0.858  -0.545  1.00  0.00      A       
ATOM    326  O   ALA A  22      -9.854   3.254  -2.900  1.00  0.00      A       
ATOM    327  C   ALA A  23     -11.504   4.546  -0.691  1.00  0.00      A       
ATOM    328  CA  ALA A  23     -12.022   3.268  -1.317  1.00  0.00      A       
ATOM    329  CB  ALA A  23     -13.179   2.678  -0.511  1.00  0.00      A       
ATOM    330  HN  ALA A  23     -10.958   1.527  -0.621  1.00  0.00      A       
ATOM    331  HA  ALA A  23     -12.314   3.450  -2.330  1.00  0.00      A       
ATOM    332  HB1 ALA A  23     -14.098   2.782  -1.069  1.00  0.00      A       
ATOM    333  HB2 ALA A  23     -13.268   3.203   0.429  1.00  0.00      A       
ATOM    334  HB3 ALA A  23     -12.990   1.632  -0.321  1.00  0.00      A       
ATOM    335  N   ALA A  23     -10.937   2.254  -1.273  1.00  0.00      A       
ATOM    336  O   ALA A  23     -11.537   5.605  -1.290  1.00  0.00      A       
ATOM    337  C   GLY A  24      -9.251   6.125   0.182  1.00  0.00      A       
ATOM    338  CA  GLY A  24     -10.377   5.654   1.103  1.00  0.00      A       
ATOM    339  HN  GLY A  24     -10.900   3.580   0.933  1.00  0.00      A       
ATOM    340  HA2 GLY A  24     -11.132   6.424   1.195  1.00  0.00      A       
ATOM    341  HA1 GLY A  24      -9.973   5.413   2.073  1.00  0.00      A       
ATOM    342  N   GLY A  24     -10.963   4.449   0.485  1.00  0.00      A       
ATOM    343  O   GLY A  24      -8.807   7.254   0.256  1.00  0.00      A       
ATOM    344  C   ILE A  25      -8.355   6.271  -2.904  1.00  0.00      A       
ATOM    345  CA  ILE A  25      -7.721   5.677  -1.656  1.00  0.00      A       
ATOM    346  CB  ILE A  25      -6.961   4.391  -1.985  1.00  0.00      A       
ATOM    347  CD1 ILE A  25      -4.869   5.015  -0.763  1.00  0.00      A       
ATOM    348  CG1 ILE A  25      -6.041   4.032  -0.815  1.00  0.00      A       
ATOM    349  CG2 ILE A  25      -6.120   4.600  -3.246  1.00  0.00      A       
ATOM    350  HN  ILE A  25      -9.190   4.361  -0.785  1.00  0.00      A       
ATOM    351  HA  ILE A  25      -7.070   6.389  -1.192  1.00  0.00      A       
ATOM    352  HB  ILE A  25      -7.665   3.589  -2.150  1.00  0.00      A       
ATOM    353 HD11 ILE A  25      -4.372   5.033  -1.722  1.00  0.00      A       
ATOM    354 HD12 ILE A  25      -4.171   4.703  -0.001  1.00  0.00      A       
ATOM    355 HD13 ILE A  25      -5.239   6.003  -0.530  1.00  0.00      A       
ATOM    356 HG12 ILE A  25      -6.597   4.085   0.110  1.00  0.00      A       
ATOM    357 HG11 ILE A  25      -5.661   3.030  -0.950  1.00  0.00      A       
ATOM    358 HG21 ILE A  25      -5.925   5.654  -3.379  1.00  0.00      A       
ATOM    359 HG22 ILE A  25      -6.659   4.223  -4.104  1.00  0.00      A       
ATOM    360 HG23 ILE A  25      -5.185   4.070  -3.148  1.00  0.00      A       
ATOM    361  N   ILE A  25      -8.801   5.267  -0.716  1.00  0.00      A       
ATOM    362  O   ILE A  25      -7.860   7.214  -3.490  1.00  0.00      A       
ATOM    363  C   LEU A  26     -11.146   7.373  -4.047  1.00  0.00      A       
ATOM    364  CA  LEU A  26     -10.184   6.262  -4.482  1.00  0.00      A       
ATOM    365  CB  LEU A  26     -10.957   5.069  -5.047  1.00  0.00      A       
ATOM    366  CD1 LEU A  26     -10.690   3.025  -6.459  1.00  0.00      A       
ATOM    367  CD2 LEU A  26     -10.288   5.285  -7.444  1.00  0.00      A       
ATOM    368  CG  LEU A  26     -10.154   4.430  -6.181  1.00  0.00      A       
ATOM    369  HN  LEU A  26      -9.844   4.991  -2.779  1.00  0.00      A       
ATOM    370  HA  LEU A  26      -9.483   6.631  -5.211  1.00  0.00      A       
ATOM    371  HB2 LEU A  26     -11.118   4.342  -4.265  1.00  0.00      A       
ATOM    372  HB1 LEU A  26     -11.909   5.405  -5.429  1.00  0.00      A       
ATOM    373 HD11 LEU A  26     -11.768   3.058  -6.525  1.00  0.00      A       
ATOM    374 HD12 LEU A  26     -10.398   2.363  -5.658  1.00  0.00      A       
ATOM    375 HD13 LEU A  26     -10.284   2.663  -7.392  1.00  0.00      A       
ATOM    376 HD21 LEU A  26     -10.296   4.644  -8.313  1.00  0.00      A       
ATOM    377 HD22 LEU A  26      -9.453   5.967  -7.507  1.00  0.00      A       
ATOM    378 HD23 LEU A  26     -11.209   5.847  -7.402  1.00  0.00      A       
ATOM    379  HG  LEU A  26      -9.114   4.368  -5.895  1.00  0.00      A       
ATOM    380  N   LEU A  26      -9.468   5.732  -3.291  1.00  0.00      A       
ATOM    381  O   LEU A  26     -11.817   7.981  -4.857  1.00  0.00      A       
ATOM    382  C   THR A  27     -11.668   9.185  -0.886  1.00  0.00      A       
ATOM    383  CA  THR A  27     -12.121   8.715  -2.273  1.00  0.00      A       
ATOM    384  CB  THR A  27     -13.501   8.060  -2.195  1.00  0.00      A       
ATOM    385  CG2 THR A  27     -14.553   9.119  -1.866  1.00  0.00      A       
ATOM    386  HN  THR A  27     -10.661   7.147  -2.132  1.00  0.00      A       
ATOM    387  HA  THR A  27     -12.142   9.542  -2.964  1.00  0.00      A       
ATOM    388  HB  THR A  27     -13.499   7.307  -1.422  1.00  0.00      A       
ATOM    389  HG1 THR A  27     -14.302   6.653  -3.273  1.00  0.00      A       
ATOM    390 HG21 THR A  27     -15.390   9.018  -2.541  1.00  0.00      A       
ATOM    391 HG22 THR A  27     -14.120  10.103  -1.973  1.00  0.00      A       
ATOM    392 HG23 THR A  27     -14.893   8.985  -0.849  1.00  0.00      A       
ATOM    393  N   THR A  27     -11.212   7.645  -2.768  1.00  0.00      A       
ATOM    394  O   THR A  27     -12.466   9.621  -0.080  1.00  0.00      A       
ATOM    395  OG1 THR A  27     -13.807   7.457  -3.445  1.00  0.00      A       
ATOM    396  C   MET A  28     -10.574  10.843   1.156  1.00  0.00      A       
ATOM    397  CA  MET A  28      -9.886   9.543   0.729  1.00  0.00      A       
ATOM    398  CB  MET A  28      -8.388   9.776   0.527  1.00  0.00      A       
ATOM    399  CE  MET A  28      -4.990   9.068   1.354  1.00  0.00      A       
ATOM    400  CG  MET A  28      -7.639   9.438   1.817  1.00  0.00      A       
ATOM    401  HN  MET A  28      -9.767   8.745  -1.270  1.00  0.00      A       
ATOM    402  HA  MET A  28     -10.042   8.773   1.468  1.00  0.00      A       
ATOM    403  HB2 MET A  28      -8.031   9.145  -0.274  1.00  0.00      A       
ATOM    404  HB1 MET A  28      -8.216  10.812   0.274  1.00  0.00      A       
ATOM    405  HE1 MET A  28      -5.566   8.283   0.883  1.00  0.00      A       
ATOM    406  HE2 MET A  28      -4.470   8.665   2.208  1.00  0.00      A       
ATOM    407  HE3 MET A  28      -4.271   9.466   0.651  1.00  0.00      A       
ATOM    408  HG2 MET A  28      -8.257   9.686   2.667  1.00  0.00      A       
ATOM    409  HG1 MET A  28      -7.410   8.383   1.834  1.00  0.00      A       
ATOM    410  N   MET A  28     -10.392   9.099  -0.604  1.00  0.00      A       
ATOM    411  OT1 MET A  28     -10.939  11.612   0.281  1.00  0.00      A       
ATOM    412  OT2 MET A  28     -10.723  11.048   2.349  1.00  0.00      A       
ATOM    413  SD  MET A  28      -6.102  10.391   1.890  1.00  0.00      A       
END


Please acknowledge these references in publications where the data from this site have been utilized.

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