NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype
369928 1bjc cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   ASP A   1     -10.508 -20.810   2.683  1.00  0.00      A       
ATOM      2  CA  ASP A   1     -10.567 -20.944   4.210  1.00  0.00      A       
ATOM      3  CB  ASP A   1     -11.370 -22.205   4.563  1.00  0.00      A       
ATOM      4  CG  ASP A   1     -11.334 -22.420   6.085  1.00  0.00      A       
ATOM      5  HT1 ASP A   1     -11.488 -19.081   4.036  1.00  0.00      A       
ATOM      6  HT2 ASP A   1     -12.061 -20.017   5.331  1.00  0.00      A       
ATOM      7  HT3 ASP A   1     -10.544 -19.259   5.435  1.00  0.00      A       
ATOM      8  HA  ASP A   1      -9.562 -21.016   4.598  1.00  0.00      A       
ATOM      9  HB2 ASP A   1     -12.397 -22.097   4.244  1.00  0.00      A       
ATOM     10  HB1 ASP A   1     -10.944 -23.069   4.072  1.00  0.00      A       
ATOM     11  N   ASP A   1     -11.214 -19.735   4.797  1.00  0.00      A       
ATOM     12  O   ASP A   1     -11.448 -20.344   2.068  1.00  0.00      A       
ATOM     13  OD1 ASP A   1     -12.199 -21.854   6.735  1.00  0.00      A       
ATOM     14  OD2 ASP A   1     -10.442 -23.135   6.514  1.00  0.00      A       
ATOM     15  C   ALA A   2      -9.248 -19.722   0.126  1.00  0.00      A       
ATOM     16  CA  ALA A   2      -9.168 -21.170   0.649  1.00  0.00      A       
ATOM     17  CB  ALA A   2     -10.226 -22.066  -0.051  1.00  0.00      A       
ATOM     18  HN  ALA A   2      -8.688 -21.587   2.703  1.00  0.00      A       
ATOM     19  HA  ALA A   2      -8.181 -21.554   0.443  1.00  0.00      A       
ATOM     20  HB1 ALA A   2     -10.333 -22.998   0.485  1.00  0.00      A       
ATOM     21  HB2 ALA A   2     -11.188 -21.575  -0.088  1.00  0.00      A       
ATOM     22  HB3 ALA A   2      -9.911 -22.285  -1.060  1.00  0.00      A       
ATOM     23  N   ALA A   2      -9.395 -21.227   2.129  1.00  0.00      A       
ATOM     24  O   ALA A   2     -10.070 -19.383  -0.703  1.00  0.00      A       
ATOM     25  C   GLU A   3      -7.534 -17.272  -1.077  1.00  0.00      A       
ATOM     26  CA  GLU A   3      -8.299 -17.460   0.249  1.00  0.00      A       
ATOM     27  CB  GLU A   3      -7.609 -16.687   1.408  1.00  0.00      A       
ATOM     28  CD  GLU A   3      -9.368 -17.652   2.979  1.00  0.00      A       
ATOM     29  CG  GLU A   3      -8.619 -16.378   2.542  1.00  0.00      A       
ATOM     30  HN  GLU A   3      -7.726 -19.250   1.305  1.00  0.00      A       
ATOM     31  HA  GLU A   3      -9.305 -17.092   0.108  1.00  0.00      A       
ATOM     32  HB2 GLU A   3      -6.789 -17.274   1.800  1.00  0.00      A       
ATOM     33  HB1 GLU A   3      -7.213 -15.750   1.047  1.00  0.00      A       
ATOM     34  HG2 GLU A   3      -8.091 -15.978   3.396  1.00  0.00      A       
ATOM     35  HG1 GLU A   3      -9.331 -15.639   2.204  1.00  0.00      A       
ATOM     36  N   GLU A   3      -8.363 -18.907   0.643  1.00  0.00      A       
ATOM     37  O   GLU A   3      -6.824 -16.304  -1.274  1.00  0.00      A       
ATOM     38  OE1 GLU A   3      -8.729 -18.476   3.611  1.00  0.00      A       
ATOM     39  OE2 GLU A   3     -10.541 -17.727   2.650  1.00  0.00      A       
ATOM     40  C   PHE A   4      -7.880 -19.037  -4.283  1.00  0.00      A       
ATOM     41  CA  PHE A   4      -7.058 -18.213  -3.291  1.00  0.00      A       
ATOM     42  CB  PHE A   4      -5.626 -18.795  -3.145  1.00  0.00      A       
ATOM     43  CD1 PHE A   4      -5.964 -21.284  -2.773  1.00  0.00      A       
ATOM     44  CD2 PHE A   4      -5.439 -19.928  -0.882  1.00  0.00      A       
ATOM     45  CE1 PHE A   4      -6.017 -22.396  -1.959  1.00  0.00      A       
ATOM     46  CE2 PHE A   4      -5.490 -21.039  -0.069  1.00  0.00      A       
ATOM     47  CG  PHE A   4      -5.675 -20.041  -2.241  1.00  0.00      A       
ATOM     48  CZ  PHE A   4      -5.780 -22.275  -0.607  1.00  0.00      A       
ATOM     49  HN  PHE A   4      -8.303 -18.975  -1.724  1.00  0.00      A       
ATOM     50  HA  PHE A   4      -7.052 -17.205  -3.655  1.00  0.00      A       
ATOM     51  HB2 PHE A   4      -5.218 -19.070  -4.107  1.00  0.00      A       
ATOM     52  HB1 PHE A   4      -4.974 -18.060  -2.694  1.00  0.00      A       
ATOM     53  HD1 PHE A   4      -6.151 -21.388  -3.832  1.00  0.00      A       
ATOM     54  HD2 PHE A   4      -5.212 -18.964  -0.452  1.00  0.00      A       
ATOM     55  HE1 PHE A   4      -6.244 -23.363  -2.383  1.00  0.00      A       
ATOM     56  HE2 PHE A   4      -5.305 -20.942   0.991  1.00  0.00      A       
ATOM     57  HZ  PHE A   4      -5.821 -23.146   0.029  1.00  0.00      A       
ATOM     58  N   PHE A   4      -7.717 -18.226  -1.951  1.00  0.00      A       
ATOM     59  O   PHE A   4      -7.426 -19.350  -5.365  1.00  0.00      A       
ATOM     60  C   ARG A   5     -10.555 -19.368  -5.890  1.00  0.00      A       
ATOM     61  CA  ARG A   5     -10.058 -20.139  -4.650  1.00  0.00      A       
ATOM     62  CB  ARG A   5     -11.226 -20.499  -3.702  1.00  0.00      A       
ATOM     63  CD  ARG A   5     -13.378 -21.796  -3.465  1.00  0.00      A       
ATOM     64  CG  ARG A   5     -12.103 -21.614  -4.318  1.00  0.00      A       
ATOM     65  CZ  ARG A   5     -14.948 -20.220  -4.517  1.00  0.00      A       
ATOM     66  HN  ARG A   5      -9.334 -19.016  -2.969  1.00  0.00      A       
ATOM     67  HA  ARG A   5      -9.562 -21.041  -4.974  1.00  0.00      A       
ATOM     68  HB2 ARG A   5     -10.825 -20.847  -2.761  1.00  0.00      A       
ATOM     69  HB1 ARG A   5     -11.815 -19.615  -3.506  1.00  0.00      A       
ATOM     70  HD2 ARG A   5     -13.984 -22.609  -3.839  1.00  0.00      A       
ATOM     71  HD1 ARG A   5     -13.115 -22.002  -2.438  1.00  0.00      A       
ATOM     72  HE  ARG A   5     -14.099 -19.896  -2.758  1.00  0.00      A       
ATOM     73  HG2 ARG A   5     -12.380 -21.364  -5.332  1.00  0.00      A       
ATOM     74  HG1 ARG A   5     -11.550 -22.542  -4.331  1.00  0.00      A       
ATOM     75 HH11 ARG A   5     -14.572 -21.893  -5.555  1.00  0.00      A       
ATOM     76 HH12 ARG A   5     -15.668 -20.778  -6.298  1.00  0.00      A       
ATOM     77 HH21 ARG A   5     -15.482 -18.483  -3.674  1.00  0.00      A       
ATOM     78 HH22 ARG A   5     -16.196 -18.819  -5.215  1.00  0.00      A       
ATOM     79  N   ARG A   5      -9.079 -19.338  -3.855  1.00  0.00      A       
ATOM     80  NE  ARG A   5     -14.168 -20.524  -3.508  1.00  0.00      A       
ATOM     81  NH1 ARG A   5     -15.072 -21.027  -5.535  1.00  0.00      A       
ATOM     82  NH2 ARG A   5     -15.592 -19.086  -4.465  1.00  0.00      A       
ATOM     83  O   ARG A   5     -11.684 -18.918  -5.958  1.00  0.00      A       
ATOM     84  C   HIS A   6      -8.694 -18.636  -9.036  1.00  0.00      A       
ATOM     85  CA  HIS A   6      -9.929 -18.538  -8.124  1.00  0.00      A       
ATOM     86  CB  HIS A   6     -10.254 -17.032  -7.862  1.00  0.00      A       
ATOM     87  CD2 HIS A   6      -8.327 -16.038  -6.329  1.00  0.00      A       
ATOM     88  CE1 HIS A   6      -9.372 -15.967  -4.540  1.00  0.00      A       
ATOM     89  CG  HIS A   6      -9.601 -16.516  -6.571  1.00  0.00      A       
ATOM     90  HN  HIS A   6      -8.777 -19.642  -6.699  1.00  0.00      A       
ATOM     91  HA  HIS A   6     -10.760 -19.021  -8.614  1.00  0.00      A       
ATOM     92  HB2 HIS A   6      -9.910 -16.422  -8.684  1.00  0.00      A       
ATOM     93  HB1 HIS A   6     -11.324 -16.908  -7.774  1.00  0.00      A       
ATOM     94  HD1 HIS A   6     -11.116 -16.714  -5.247  1.00  0.00      A       
ATOM     95  HD2 HIS A   6      -7.549 -15.954  -7.069  1.00  0.00      A       
ATOM     96  HE1 HIS A   6      -9.624 -15.808  -3.502  1.00  0.00      A       
ATOM     97  N   HIS A   6      -9.660 -19.249  -6.837  1.00  0.00      A       
ATOM     98  ND1 HIS A   6     -10.190 -16.445  -5.422  1.00  0.00      A       
ATOM     99  NE2 HIS A   6      -8.201 -15.700  -5.062  1.00  0.00      A       
ATOM    100  O   HIS A   6      -8.809 -18.473 -10.236  1.00  0.00      A       
ATOM    101  C   ASP A   7      -5.951 -17.719  -9.933  1.00  0.00      A       
ATOM    102  CA  ASP A   7      -6.262 -19.025  -9.185  1.00  0.00      A       
ATOM    103  CB  ASP A   7      -6.381 -20.226 -10.171  1.00  0.00      A       
ATOM    104  CG  ASP A   7      -4.973 -20.744 -10.517  1.00  0.00      A       
ATOM    105  HN  ASP A   7      -7.534 -19.009  -7.469  1.00  0.00      A       
ATOM    106  HA  ASP A   7      -5.474 -19.204  -8.468  1.00  0.00      A       
ATOM    107  HB2 ASP A   7      -6.943 -21.025  -9.710  1.00  0.00      A       
ATOM    108  HB1 ASP A   7      -6.888 -19.933 -11.079  1.00  0.00      A       
ATOM    109  N   ASP A   7      -7.553 -18.896  -8.438  1.00  0.00      A       
ATOM    110  O   ASP A   7      -5.576 -17.712 -11.090  1.00  0.00      A       
ATOM    111  OD1 ASP A   7      -4.473 -21.524  -9.723  1.00  0.00      A       
ATOM    112  OD2 ASP A   7      -4.477 -20.331 -11.553  1.00  0.00      A       
ATOM    113  C   SER A   8      -4.371 -15.071 -10.042  1.00  0.00      A       
ATOM    114  CA  SER A   8      -5.870 -15.287  -9.787  1.00  0.00      A       
ATOM    115  CB  SER A   8      -6.396 -14.224  -8.800  1.00  0.00      A       
ATOM    116  HN  SER A   8      -6.429 -16.731  -8.287  1.00  0.00      A       
ATOM    117  HA  SER A   8      -6.403 -15.226 -10.719  1.00  0.00      A       
ATOM    118  HB2 SER A   8      -7.460 -14.321  -8.649  1.00  0.00      A       
ATOM    119  HB1 SER A   8      -5.879 -14.267  -7.853  1.00  0.00      A       
ATOM    120  HG  SER A   8      -6.962 -12.524  -9.565  1.00  0.00      A       
ATOM    121  N   SER A   8      -6.126 -16.641  -9.213  1.00  0.00      A       
ATOM    122  O   SER A   8      -3.990 -14.418 -10.995  1.00  0.00      A       
ATOM    123  OG  SER A   8      -6.127 -12.978  -9.429  1.00  0.00      A       
ATOM    124  C   GLY A   9      -1.635 -14.244  -8.549  1.00  0.00      A       
ATOM    125  CA  GLY A   9      -2.091 -15.519  -9.267  1.00  0.00      A       
ATOM    126  HN  GLY A   9      -3.978 -16.142  -8.432  1.00  0.00      A       
ATOM    127  HA2 GLY A   9      -1.640 -16.378  -8.794  1.00  0.00      A       
ATOM    128  HA1 GLY A   9      -1.790 -15.478 -10.304  1.00  0.00      A       
ATOM    129  N   GLY A   9      -3.579 -15.634  -9.166  1.00  0.00      A       
ATOM    130  O   GLY A   9      -0.807 -14.290  -7.660  1.00  0.00      A       
ATOM    131  C   TYR A  10      -2.863 -10.759  -8.895  1.00  0.00      A       
ATOM    132  CA  TYR A  10      -1.872 -11.812  -8.375  1.00  0.00      A       
ATOM    133  CB  TYR A  10      -0.423 -11.397  -8.773  1.00  0.00      A       
ATOM    134  CD1 TYR A  10      -0.106 -10.376  -6.420  1.00  0.00      A       
ATOM    135  CD2 TYR A  10       1.808 -11.093  -7.635  1.00  0.00      A       
ATOM    136  CE1 TYR A  10       0.704  -9.979  -5.379  1.00  0.00      A       
ATOM    137  CE2 TYR A  10       2.616 -10.694  -6.591  1.00  0.00      A       
ATOM    138  CG  TYR A  10       0.436 -10.941  -7.568  1.00  0.00      A       
ATOM    139  CZ  TYR A  10       2.070 -10.134  -5.456  1.00  0.00      A       
ATOM    140  HN  TYR A  10      -2.861 -13.182  -9.691  1.00  0.00      A       
ATOM    141  HA  TYR A  10      -1.992 -11.898  -7.307  1.00  0.00      A       
ATOM    142  HB2 TYR A  10       0.075 -12.231  -9.245  1.00  0.00      A       
ATOM    143  HB1 TYR A  10      -0.450 -10.584  -9.485  1.00  0.00      A       
ATOM    144  HD1 TYR A  10      -1.170 -10.240  -6.323  1.00  0.00      A       
ATOM    145  HD2 TYR A  10       2.257 -11.529  -8.515  1.00  0.00      A       
ATOM    146  HE1 TYR A  10       0.259  -9.541  -4.497  1.00  0.00      A       
ATOM    147  HE2 TYR A  10       3.685 -10.822  -6.665  1.00  0.00      A       
ATOM    148  HH  TYR A  10       3.137  -8.824  -4.571  1.00  0.00      A       
ATOM    149  N   TYR A  10      -2.203 -13.141  -8.969  1.00  0.00      A       
ATOM    150  O   TYR A  10      -3.552 -10.973  -9.875  1.00  0.00      A       
ATOM    151  OH  TYR A  10       2.880  -9.735  -4.413  1.00  0.00      A       
ATOM    152  C   GLU A  11      -3.406  -7.334  -7.655  1.00  0.00      A       
ATOM    153  CA  GLU A  11      -3.787  -8.509  -8.555  1.00  0.00      A       
ATOM    154  CB  GLU A  11      -5.272  -8.919  -8.323  1.00  0.00      A       
ATOM    155  CD  GLU A  11      -6.143  -7.055  -9.825  1.00  0.00      A       
ATOM    156  CG  GLU A  11      -6.213  -7.689  -8.423  1.00  0.00      A       
ATOM    157  HN  GLU A  11      -2.304  -9.557  -7.428  1.00  0.00      A       
ATOM    158  HA  GLU A  11      -3.617  -8.219  -9.582  1.00  0.00      A       
ATOM    159  HB2 GLU A  11      -5.567  -9.648  -9.064  1.00  0.00      A       
ATOM    160  HB1 GLU A  11      -5.375  -9.367  -7.346  1.00  0.00      A       
ATOM    161  HG2 GLU A  11      -7.227  -8.002  -8.228  1.00  0.00      A       
ATOM    162  HG1 GLU A  11      -5.940  -6.947  -7.688  1.00  0.00      A       
ATOM    163  N   GLU A  11      -2.892  -9.649  -8.204  1.00  0.00      A       
ATOM    164  O   GLU A  11      -3.722  -7.304  -6.481  1.00  0.00      A       
ATOM    165  OE1 GLU A  11      -5.266  -6.228 -10.010  1.00  0.00      A       
ATOM    166  OE2 GLU A  11      -6.973  -7.431 -10.636  1.00  0.00      A       
ATOM    167  C   VAL A  12      -3.438  -4.192  -7.501  1.00  0.00      A       
ATOM    168  CA  VAL A  12      -2.270  -5.182  -7.547  1.00  0.00      A       
ATOM    169  CB  VAL A  12      -1.075  -4.609  -8.313  1.00  0.00      A       
ATOM    170  CG1 VAL A  12      -0.674  -3.219  -7.756  1.00  0.00      A       
ATOM    171  CG2 VAL A  12       0.124  -5.576  -8.195  1.00  0.00      A       
ATOM    172  HN  VAL A  12      -2.506  -6.502  -9.209  1.00  0.00      A       
ATOM    173  HA  VAL A  12      -1.972  -5.456  -6.560  1.00  0.00      A       
ATOM    174  HB  VAL A  12      -1.384  -4.552  -9.340  1.00  0.00      A       
ATOM    175 HG11 VAL A  12      -0.440  -3.288  -6.704  1.00  0.00      A       
ATOM    176 HG12 VAL A  12       0.191  -2.838  -8.279  1.00  0.00      A       
ATOM    177 HG13 VAL A  12      -1.481  -2.515  -7.884  1.00  0.00      A       
ATOM    178 HG21 VAL A  12      -0.136  -6.544  -8.597  1.00  0.00      A       
ATOM    179 HG22 VAL A  12       0.967  -5.192  -8.749  1.00  0.00      A       
ATOM    180 HG23 VAL A  12       0.412  -5.695  -7.161  1.00  0.00      A       
ATOM    181  N   VAL A  12      -2.725  -6.402  -8.263  1.00  0.00      A       
ATOM    182  O   VAL A  12      -3.712  -3.583  -6.484  1.00  0.00      A       
ATOM    183  C   HIS A  13      -4.916  -1.723  -8.428  1.00  0.00      A       
ATOM    184  CA  HIS A  13      -5.257  -3.174  -8.819  1.00  0.00      A       
ATOM    185  CB  HIS A  13      -6.431  -3.733  -7.954  1.00  0.00      A       
ATOM    186  CD2 HIS A  13      -8.973  -3.372  -8.616  1.00  0.00      A       
ATOM    187  CE1 HIS A  13      -8.971  -4.414 -10.409  1.00  0.00      A       
ATOM    188  CG  HIS A  13      -7.694  -3.862  -8.814  1.00  0.00      A       
ATOM    189  HN  HIS A  13      -3.773  -4.623  -9.392  1.00  0.00      A       
ATOM    190  HA  HIS A  13      -5.519  -3.183  -9.866  1.00  0.00      A       
ATOM    191  HB2 HIS A  13      -6.185  -4.713  -7.573  1.00  0.00      A       
ATOM    192  HB1 HIS A  13      -6.648  -3.089  -7.115  1.00  0.00      A       
ATOM    193  HD1 HIS A  13      -7.025  -4.963 -10.373  1.00  0.00      A       
ATOM    194  HD2 HIS A  13      -9.285  -2.785  -7.765  1.00  0.00      A       
ATOM    195  HE1 HIS A  13      -9.289  -4.862 -11.338  1.00  0.00      A       
ATOM    196  N   HIS A  13      -4.082  -4.083  -8.636  1.00  0.00      A       
ATOM    197  ND1 HIS A  13      -7.767  -4.494  -9.939  1.00  0.00      A       
ATOM    198  NE2 HIS A  13      -9.755  -3.725  -9.617  1.00  0.00      A       
ATOM    199  O   HIS A  13      -5.762  -0.975  -7.976  1.00  0.00      A       
ATOM    200  C   HIS A  14      -1.927   0.321  -9.117  1.00  0.00      A       
ATOM    201  CA  HIS A  14      -3.182  -0.007  -8.295  1.00  0.00      A       
ATOM    202  CB  HIS A  14      -2.869   0.060  -6.783  1.00  0.00      A       
ATOM    203  CD2 HIS A  14      -2.962   2.721  -6.978  1.00  0.00      A       
ATOM    204  CE1 HIS A  14      -2.547   3.167  -4.997  1.00  0.00      A       
ATOM    205  CG  HIS A  14      -2.794   1.520  -6.305  1.00  0.00      A       
ATOM    206  HN  HIS A  14      -3.037  -2.023  -8.995  1.00  0.00      A       
ATOM    207  HA  HIS A  14      -3.962   0.690  -8.557  1.00  0.00      A       
ATOM    208  HB2 HIS A  14      -3.643  -0.440  -6.220  1.00  0.00      A       
ATOM    209  HB1 HIS A  14      -1.926  -0.422  -6.574  1.00  0.00      A       
ATOM    210  HD1 HIS A  14      -2.369   1.259  -4.346  1.00  0.00      A       
ATOM    211  HD2 HIS A  14      -3.189   2.819  -8.030  1.00  0.00      A       
ATOM    212  HE1 HIS A  14      -2.362   3.710  -4.082  1.00  0.00      A       
ATOM    213  N   HIS A  14      -3.666  -1.376  -8.624  1.00  0.00      A       
ATOM    214  ND1 HIS A  14      -2.540   1.875  -5.089  1.00  0.00      A       
ATOM    215  NE2 HIS A  14      -2.805   3.734  -6.149  1.00  0.00      A       
ATOM    216  O   HIS A  14      -0.864  -0.234  -8.907  1.00  0.00      A       
ATOM    217  C   GLN A  15      -0.127   2.747 -10.233  1.00  0.00      A       
ATOM    218  CA  GLN A  15      -0.983   1.673 -10.930  1.00  0.00      A       
ATOM    219  CB  GLN A  15      -1.601   2.212 -12.238  1.00  0.00      A       
ATOM    220  CD  GLN A  15      -2.980   1.606 -14.241  1.00  0.00      A       
ATOM    221  CG  GLN A  15      -2.335   1.063 -12.961  1.00  0.00      A       
ATOM    222  HN  GLN A  15      -2.987   1.643 -10.148  1.00  0.00      A       
ATOM    223  HA  GLN A  15      -0.350   0.823 -11.146  1.00  0.00      A       
ATOM    224  HB2 GLN A  15      -2.296   3.010 -12.013  1.00  0.00      A       
ATOM    225  HB1 GLN A  15      -0.823   2.602 -12.879  1.00  0.00      A       
ATOM    226 HE21 GLN A  15      -4.502   2.437 -13.273  1.00  0.00      A       
ATOM    227 HE22 GLN A  15      -4.517   2.637 -14.958  1.00  0.00      A       
ATOM    228  HG2 GLN A  15      -1.639   0.278 -13.222  1.00  0.00      A       
ATOM    229  HG1 GLN A  15      -3.109   0.649 -12.331  1.00  0.00      A       
ATOM    230  N   GLN A  15      -2.103   1.236 -10.039  1.00  0.00      A       
ATOM    231  NE2 GLN A  15      -4.091   2.283 -14.150  1.00  0.00      A       
ATOM    232  O   GLN A  15       0.139   3.810 -10.763  1.00  0.00      A       
ATOM    233  OE1 GLN A  15      -2.480   1.421 -15.333  1.00  0.00      A       
ATOM    234  C   PHE A  16       2.214   2.343  -7.659  1.00  0.00      A       
ATOM    235  CA  PHE A  16       1.114   3.269  -8.169  1.00  0.00      A       
ATOM    236  CB  PHE A  16       0.257   3.806  -7.011  1.00  0.00      A       
ATOM    237  CD1 PHE A  16       1.562   5.805  -6.151  1.00  0.00      A       
ATOM    238  CD2 PHE A  16       1.568   3.811  -4.842  1.00  0.00      A       
ATOM    239  CE1 PHE A  16       2.370   6.419  -5.217  1.00  0.00      A       
ATOM    240  CE2 PHE A  16       2.376   4.425  -3.908  1.00  0.00      A       
ATOM    241  CG  PHE A  16       1.154   4.495  -5.970  1.00  0.00      A       
ATOM    242  CZ  PHE A  16       2.778   5.730  -4.095  1.00  0.00      A       
ATOM    243  HN  PHE A  16       0.007   1.526  -8.690  1.00  0.00      A       
ATOM    244  HA  PHE A  16       1.554   4.062  -8.749  1.00  0.00      A       
ATOM    245  HB2 PHE A  16      -0.465   4.519  -7.381  1.00  0.00      A       
ATOM    246  HB1 PHE A  16      -0.267   2.990  -6.535  1.00  0.00      A       
ATOM    247  HD1 PHE A  16       1.246   6.352  -7.027  1.00  0.00      A       
ATOM    248  HD2 PHE A  16       1.257   2.788  -4.687  1.00  0.00      A       
ATOM    249  HE1 PHE A  16       2.684   7.442  -5.365  1.00  0.00      A       
ATOM    250  HE2 PHE A  16       2.694   3.883  -3.030  1.00  0.00      A       
ATOM    251  HZ  PHE A  16       3.411   6.211  -3.364  1.00  0.00      A       
ATOM    252  N   PHE A  16       0.271   2.399  -9.038  1.00  0.00      A       
ATOM    253  O   PHE A  16       3.389   2.641  -7.738  1.00  0.00      A       
ATOM    254  C   LEU A  17       3.427  -0.354  -7.816  1.00  0.00      A       
ATOM    255  CA  LEU A  17       2.699   0.201  -6.607  1.00  0.00      A       
ATOM    256  CB  LEU A  17       1.890  -0.899  -5.894  1.00  0.00      A       
ATOM    257  CD1 LEU A  17      -0.011   0.129  -4.564  1.00  0.00      A       
ATOM    258  CD2 LEU A  17       1.540  -1.511  -3.459  1.00  0.00      A       
ATOM    259  CG  LEU A  17       1.444  -0.375  -4.500  1.00  0.00      A       
ATOM    260  HN  LEU A  17       0.809   1.057  -7.133  1.00  0.00      A       
ATOM    261  HA  LEU A  17       3.403   0.680  -5.952  1.00  0.00      A       
ATOM    262  HB2 LEU A  17       1.032  -1.167  -6.494  1.00  0.00      A       
ATOM    263  HB1 LEU A  17       2.511  -1.777  -5.782  1.00  0.00      A       
ATOM    264 HD11 LEU A  17      -0.129   0.828  -5.378  1.00  0.00      A       
ATOM    265 HD12 LEU A  17      -0.691  -0.698  -4.713  1.00  0.00      A       
ATOM    266 HD13 LEU A  17      -0.270   0.629  -3.642  1.00  0.00      A       
ATOM    267 HD21 LEU A  17       0.934  -2.353  -3.762  1.00  0.00      A       
ATOM    268 HD22 LEU A  17       2.565  -1.838  -3.361  1.00  0.00      A       
ATOM    269 HD23 LEU A  17       1.197  -1.164  -2.496  1.00  0.00      A       
ATOM    270  HG  LEU A  17       2.083   0.442  -4.194  1.00  0.00      A       
ATOM    271  N   LEU A  17       1.769   1.224  -7.149  1.00  0.00      A       
ATOM    272  O   LEU A  17       4.634  -0.489  -7.831  1.00  0.00      A       
ATOM    273  C   VAL A  18       4.085  -0.112 -10.707  1.00  0.00      A       
ATOM    274  CA  VAL A  18       3.229  -1.205 -10.070  1.00  0.00      A       
ATOM    275  CB  VAL A  18       2.049  -1.654 -10.974  1.00  0.00      A       
ATOM    276  CG1 VAL A  18       2.377  -1.560 -12.484  1.00  0.00      A       
ATOM    277  CG2 VAL A  18       1.768  -3.122 -10.622  1.00  0.00      A       
ATOM    278  HN  VAL A  18       1.679  -0.518  -8.743  1.00  0.00      A       
ATOM    279  HA  VAL A  18       3.866  -2.029  -9.802  1.00  0.00      A       
ATOM    280  HB  VAL A  18       1.181  -1.047 -10.759  1.00  0.00      A       
ATOM    281 HG11 VAL A  18       3.369  -1.937 -12.684  1.00  0.00      A       
ATOM    282 HG12 VAL A  18       1.665  -2.135 -13.058  1.00  0.00      A       
ATOM    283 HG13 VAL A  18       2.316  -0.530 -12.803  1.00  0.00      A       
ATOM    284 HG21 VAL A  18       1.856  -3.265  -9.554  1.00  0.00      A       
ATOM    285 HG22 VAL A  18       0.775  -3.399 -10.936  1.00  0.00      A       
ATOM    286 HG23 VAL A  18       2.492  -3.762 -11.108  1.00  0.00      A       
ATOM    287  N   VAL A  18       2.645  -0.655  -8.818  1.00  0.00      A       
ATOM    288  O   VAL A  18       5.138  -0.388 -11.242  1.00  0.00      A       
ATOM    289  C   PHE A  19       5.786   2.284 -10.619  1.00  0.00      A       
ATOM    290  CA  PHE A  19       4.367   2.255 -11.204  1.00  0.00      A       
ATOM    291  CB  PHE A  19       3.630   3.563 -10.870  1.00  0.00      A       
ATOM    292  CD1 PHE A  19       5.226   5.353 -11.705  1.00  0.00      A       
ATOM    293  CD2 PHE A  19       3.247   4.933 -12.969  1.00  0.00      A       
ATOM    294  CE1 PHE A  19       5.600   6.323 -12.610  1.00  0.00      A       
ATOM    295  CE2 PHE A  19       3.621   5.904 -13.875  1.00  0.00      A       
ATOM    296  CG  PHE A  19       4.046   4.649 -11.877  1.00  0.00      A       
ATOM    297  CZ  PHE A  19       4.797   6.600 -13.696  1.00  0.00      A       
ATOM    298  HN  PHE A  19       2.754   1.237 -10.159  1.00  0.00      A       
ATOM    299  HA  PHE A  19       4.435   2.119 -12.270  1.00  0.00      A       
ATOM    300  HB2 PHE A  19       2.565   3.413 -10.936  1.00  0.00      A       
ATOM    301  HB1 PHE A  19       3.873   3.902  -9.872  1.00  0.00      A       
ATOM    302  HD1 PHE A  19       5.861   5.143 -10.857  1.00  0.00      A       
ATOM    303  HD2 PHE A  19       2.323   4.392 -13.118  1.00  0.00      A       
ATOM    304  HE1 PHE A  19       6.522   6.867 -12.469  1.00  0.00      A       
ATOM    305  HE2 PHE A  19       2.991   6.120 -14.726  1.00  0.00      A       
ATOM    306  HZ  PHE A  19       5.090   7.360 -14.405  1.00  0.00      A       
ATOM    307  N   PHE A  19       3.609   1.103 -10.618  1.00  0.00      A       
ATOM    308  O   PHE A  19       6.757   2.538 -11.305  1.00  0.00      A       
ATOM    309  C   PHE A  20       7.917   0.790  -9.082  1.00  0.00      A       
ATOM    310  CA  PHE A  20       7.109   1.981  -8.589  1.00  0.00      A       
ATOM    311  CB  PHE A  20       6.758   1.863  -7.086  1.00  0.00      A       
ATOM    312  CD1 PHE A  20       8.376   3.631  -6.245  1.00  0.00      A       
ATOM    313  CD2 PHE A  20       8.530   1.437  -5.324  1.00  0.00      A       
ATOM    314  CE1 PHE A  20       9.419   4.042  -5.440  1.00  0.00      A       
ATOM    315  CE2 PHE A  20       9.573   1.847  -4.519  1.00  0.00      A       
ATOM    316  CG  PHE A  20       7.922   2.324  -6.194  1.00  0.00      A       
ATOM    317  CZ  PHE A  20      10.018   3.150  -4.577  1.00  0.00      A       
ATOM    318  HN  PHE A  20       5.021   1.797  -8.861  1.00  0.00      A       
ATOM    319  HA  PHE A  20       7.655   2.884  -8.797  1.00  0.00      A       
ATOM    320  HB2 PHE A  20       5.899   2.479  -6.863  1.00  0.00      A       
ATOM    321  HB1 PHE A  20       6.513   0.840  -6.837  1.00  0.00      A       
ATOM    322  HD1 PHE A  20       7.913   4.338  -6.919  1.00  0.00      A       
ATOM    323  HD2 PHE A  20       8.189   0.413  -5.271  1.00  0.00      A       
ATOM    324  HE1 PHE A  20       9.767   5.063  -5.487  1.00  0.00      A       
ATOM    325  HE2 PHE A  20      10.040   1.147  -3.843  1.00  0.00      A       
ATOM    326  HZ  PHE A  20      10.834   3.471  -3.946  1.00  0.00      A       
ATOM    327  N   PHE A  20       5.838   2.005  -9.345  1.00  0.00      A       
ATOM    328  O   PHE A  20       9.059   0.934  -9.451  1.00  0.00      A       
ATOM    329  C   ALA A  21       8.660  -1.484 -10.892  1.00  0.00      A       
ATOM    330  CA  ALA A  21       7.957  -1.606  -9.540  1.00  0.00      A       
ATOM    331  CB  ALA A  21       6.885  -2.686  -9.585  1.00  0.00      A       
ATOM    332  HN  ALA A  21       6.360  -0.385  -8.792  1.00  0.00      A       
ATOM    333  HA  ALA A  21       8.710  -1.849  -8.812  1.00  0.00      A       
ATOM    334  HB1 ALA A  21       6.310  -2.659  -8.671  1.00  0.00      A       
ATOM    335  HB2 ALA A  21       6.218  -2.506 -10.416  1.00  0.00      A       
ATOM    336  HB3 ALA A  21       7.338  -3.658  -9.694  1.00  0.00      A       
ATOM    337  N   ALA A  21       7.291  -0.352  -9.088  1.00  0.00      A       
ATOM    338  O   ALA A  21       9.813  -1.837 -11.031  1.00  0.00      A       
ATOM    339  C   GLU A  22       9.636   0.161 -13.311  1.00  0.00      A       
ATOM    340  CA  GLU A  22       8.431  -0.785 -13.230  1.00  0.00      A       
ATOM    341  CB  GLU A  22       7.289  -0.226 -14.088  1.00  0.00      A       
ATOM    342  CD  GLU A  22       4.858  -0.571 -14.685  1.00  0.00      A       
ATOM    343  CG  GLU A  22       6.125  -1.239 -14.126  1.00  0.00      A       
ATOM    344  HN  GLU A  22       7.006  -0.731 -11.611  1.00  0.00      A       
ATOM    345  HA  GLU A  22       8.727  -1.743 -13.621  1.00  0.00      A       
ATOM    346  HB2 GLU A  22       6.954   0.712 -13.669  1.00  0.00      A       
ATOM    347  HB1 GLU A  22       7.640  -0.047 -15.095  1.00  0.00      A       
ATOM    348  HG2 GLU A  22       6.402  -2.058 -14.765  1.00  0.00      A       
ATOM    349  HG1 GLU A  22       5.908  -1.633 -13.145  1.00  0.00      A       
ATOM    350  N   GLU A  22       7.922  -0.981 -11.838  1.00  0.00      A       
ATOM    351  O   GLU A  22      10.526  -0.031 -14.117  1.00  0.00      A       
ATOM    352  OE1 GLU A  22       4.381   0.337 -14.023  1.00  0.00      A       
ATOM    353  OE2 GLU A  22       4.434  -1.009 -15.742  1.00  0.00      A       
ATOM    354  C   ASP A  23      11.941   1.745 -11.603  1.00  0.00      A       
ATOM    355  CA  ASP A  23      10.700   2.171 -12.402  1.00  0.00      A       
ATOM    356  CB  ASP A  23      10.077   3.458 -11.805  1.00  0.00      A       
ATOM    357  CG  ASP A  23      11.170   4.473 -11.415  1.00  0.00      A       
ATOM    358  HN  ASP A  23       8.858   1.216 -11.842  1.00  0.00      A       
ATOM    359  HA  ASP A  23      11.002   2.379 -13.412  1.00  0.00      A       
ATOM    360  HB2 ASP A  23       9.420   3.914 -12.530  1.00  0.00      A       
ATOM    361  HB1 ASP A  23       9.495   3.212 -10.928  1.00  0.00      A       
ATOM    362  N   ASP A  23       9.612   1.149 -12.458  1.00  0.00      A       
ATOM    363  O   ASP A  23      13.057   1.787 -12.085  1.00  0.00      A       
ATOM    364  OD1 ASP A  23      11.624   5.157 -12.318  1.00  0.00      A       
ATOM    365  OD2 ASP A  23      11.487   4.502 -10.236  1.00  0.00      A       
ATOM    366  C   VAL A  24      13.341  -0.433  -9.851  1.00  0.00      A       
ATOM    367  CA  VAL A  24      12.706   0.896  -9.423  1.00  0.00      A       
ATOM    368  CB  VAL A  24      12.040   0.748  -8.032  1.00  0.00      A       
ATOM    369  CG1 VAL A  24      13.121   0.675  -6.932  1.00  0.00      A       
ATOM    370  CG2 VAL A  24      11.040   1.909  -7.709  1.00  0.00      A       
ATOM    371  HN  VAL A  24      10.741   1.341 -10.115  1.00  0.00      A       
ATOM    372  HA  VAL A  24      13.470   1.647  -9.351  1.00  0.00      A       
ATOM    373  HB  VAL A  24      11.500  -0.179  -8.044  1.00  0.00      A       
ATOM    374 HG11 VAL A  24      13.733   1.565  -6.944  1.00  0.00      A       
ATOM    375 HG12 VAL A  24      12.654   0.586  -5.961  1.00  0.00      A       
ATOM    376 HG13 VAL A  24      13.754  -0.186  -7.089  1.00  0.00      A       
ATOM    377 HG21 VAL A  24      10.801   2.511  -8.572  1.00  0.00      A       
ATOM    378 HG22 VAL A  24      10.119   1.473  -7.353  1.00  0.00      A       
ATOM    379 HG23 VAL A  24      11.420   2.563  -6.940  1.00  0.00      A       
ATOM    380  N   VAL A  24      11.671   1.349 -10.395  1.00  0.00      A       
ATOM    381  O   VAL A  24      14.551  -0.558  -9.876  1.00  0.00      A       
ATOM    382  C   GLY A  25      12.789  -2.925 -12.115  1.00  0.00      A       
ATOM    383  CA  GLY A  25      12.962  -2.730 -10.607  1.00  0.00      A       
ATOM    384  HN  GLY A  25      11.533  -1.200 -10.132  1.00  0.00      A       
ATOM    385  HA2 GLY A  25      14.002  -2.864 -10.345  1.00  0.00      A       
ATOM    386  HA1 GLY A  25      12.373  -3.477 -10.094  1.00  0.00      A       
ATOM    387  N   GLY A  25      12.495  -1.378 -10.173  1.00  0.00      A       
ATOM    388  O   GLY A  25      11.907  -2.353 -12.727  1.00  0.00      A       
ATOM    389  C   SER A  26      12.685  -5.233 -14.403  1.00  0.00      A       
ATOM    390  CA  SER A  26      13.624  -4.045 -14.123  1.00  0.00      A       
ATOM    391  CB  SER A  26      15.063  -4.367 -14.575  1.00  0.00      A       
ATOM    392  HN  SER A  26      14.338  -4.165 -12.111  1.00  0.00      A       
ATOM    393  HA  SER A  26      13.261  -3.178 -14.645  1.00  0.00      A       
ATOM    394  HB2 SER A  26      15.486  -5.185 -14.012  1.00  0.00      A       
ATOM    395  HB1 SER A  26      15.112  -4.575 -15.634  1.00  0.00      A       
ATOM    396  HG  SER A  26      16.142  -2.842 -15.122  1.00  0.00      A       
ATOM    397  N   SER A  26      13.653  -3.741 -12.662  1.00  0.00      A       
ATOM    398  O   SER A  26      12.911  -6.013 -15.309  1.00  0.00      A       
ATOM    399  OG  SER A  26      15.786  -3.176 -14.295  1.00  0.00      A       
ATOM    400  C   ASN A  27      10.006  -6.403 -15.150  1.00  0.00      A       
ATOM    401  CA  ASN A  27      10.640  -6.427 -13.752  1.00  0.00      A       
ATOM    402  CB  ASN A  27       9.549  -6.252 -12.664  1.00  0.00      A       
ATOM    403  CG  ASN A  27       8.868  -4.875 -12.769  1.00  0.00      A       
ATOM    404  HN  ASN A  27      11.523  -4.662 -12.898  1.00  0.00      A       
ATOM    405  HA  ASN A  27      11.143  -7.372 -13.618  1.00  0.00      A       
ATOM    406  HB2 ASN A  27       8.798  -7.022 -12.769  1.00  0.00      A       
ATOM    407  HB1 ASN A  27       9.995  -6.337 -11.683  1.00  0.00      A       
ATOM    408 HD21 ASN A  27       7.034  -5.616 -12.594  1.00  0.00      A       
ATOM    409 HD22 ASN A  27       7.124  -3.930 -12.772  1.00  0.00      A       
ATOM    410  N   ASN A  27      11.648  -5.327 -13.606  1.00  0.00      A       
ATOM    411  ND2 ASN A  27       7.566  -4.802 -12.706  1.00  0.00      A       
ATOM    412  O   ASN A  27       9.714  -7.434 -15.725  1.00  0.00      A       
ATOM    413  OD1 ASN A  27       9.509  -3.853 -12.908  1.00  0.00      A       
ATOM    414  C   LYS A  28       9.528  -3.543 -17.472  1.00  0.00      A       
ATOM    415  CA  LYS A  28       9.219  -4.976 -16.983  1.00  0.00      A       
ATOM    416  CB  LYS A  28       7.687  -5.194 -16.891  1.00  0.00      A       
ATOM    417  CD  LYS A  28       5.736  -4.657 -15.344  1.00  0.00      A       
ATOM    418  CE  LYS A  28       4.542  -4.330 -16.273  1.00  0.00      A       
ATOM    419  CG  LYS A  28       7.057  -4.137 -15.954  1.00  0.00      A       
ATOM    420  HN  LYS A  28      10.088  -4.434 -15.090  1.00  0.00      A       
ATOM    421  HA  LYS A  28       9.650  -5.683 -17.678  1.00  0.00      A       
ATOM    422  HB2 LYS A  28       7.252  -5.107 -17.876  1.00  0.00      A       
ATOM    423  HB1 LYS A  28       7.492  -6.190 -16.521  1.00  0.00      A       
ATOM    424  HD2 LYS A  28       5.795  -5.725 -15.185  1.00  0.00      A       
ATOM    425  HD1 LYS A  28       5.591  -4.185 -14.384  1.00  0.00      A       
ATOM    426  HE2 LYS A  28       4.812  -3.601 -17.025  1.00  0.00      A       
ATOM    427  HE1 LYS A  28       4.207  -5.228 -16.771  1.00  0.00      A       
ATOM    428  HG2 LYS A  28       7.738  -3.903 -15.150  1.00  0.00      A       
ATOM    429  HG1 LYS A  28       6.882  -3.230 -16.516  1.00  0.00      A       
ATOM    430  HZ1 LYS A  28       3.668  -3.732 -14.474  1.00  0.00      A       
ATOM    431  HZ2 LYS A  28       3.177  -2.824 -15.820  1.00  0.00      A       
ATOM    432  HZ3 LYS A  28       2.574  -4.394 -15.592  1.00  0.00      A       
ATOM    433  N   LYS A  28       9.823  -5.204 -15.634  1.00  0.00      A       
ATOM    434  NZ  LYS A  28       3.406  -3.779 -15.480  1.00  0.00      A       
ATOM    435  OT1 LYS A  28       9.517  -3.375 -18.680  1.00  0.00      A       
ATOM    436  OT2 LYS A  28       9.756  -2.698 -16.619  1.00  0.00      A       
END


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