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
560549 2ls9 18418 cing 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   GLY A   1      18.600   0.060   2.394  1.00  0.00      A       
ATOM      2  CA  GLY A   1      19.911  -0.180   3.113  1.00  0.00      A       
ATOM      3  HT1 GLY A   1      19.747   1.403   4.465  1.00  0.00      A       
ATOM      4  HT2 GLY A   1      20.833   0.196   4.947  1.00  0.00      A       
ATOM      5  HT3 GLY A   1      19.162  -0.075   5.056  1.00  0.00      A       
ATOM      6  HA2 GLY A   1      20.707   0.281   2.548  1.00  0.00      A       
ATOM      7  HA1 GLY A   1      20.090  -1.244   3.164  1.00  0.00      A       
ATOM      8  N   GLY A   1      19.915   0.374   4.489  1.00  0.00      A       
ATOM      9  O   GLY A   1      18.382   1.135   1.829  1.00  0.00      A       
ATOM     10  C   TRP A   2      15.282  -0.839   2.675  1.00  0.00      A       
ATOM     11  CA  TRP A   2      16.453  -0.846   1.697  1.00  0.00      A       
ATOM     12  CB  TRP A   2      16.309  -2.016   0.718  1.00  0.00      A       
ATOM     13  CD1 TRP A   2      18.488  -3.130  -0.036  1.00  0.00      A       
ATOM     14  CD2 TRP A   2      17.845  -1.408  -1.316  1.00  0.00      A       
ATOM     15  CE2 TRP A   2      19.050  -1.928  -1.830  1.00  0.00      A       
ATOM     16  CE3 TRP A   2      17.252  -0.316  -1.962  1.00  0.00      A       
ATOM     17  CG  TRP A   2      17.501  -2.196  -0.170  1.00  0.00      A       
ATOM     18  CH2 TRP A   2      19.070  -0.328  -3.564  1.00  0.00      A       
ATOM     19  CZ2 TRP A   2      19.671  -1.395  -2.955  1.00  0.00      A       
ATOM     20  CZ3 TRP A   2      17.872   0.212  -3.078  1.00  0.00      A       
ATOM     21  HN  TRP A   2      17.938  -1.760   2.912  1.00  0.00      A       
ATOM     22  HA  TRP A   2      16.449   0.079   1.142  1.00  0.00      A       
ATOM     23  HB2 TRP A   2      16.166  -2.930   1.276  1.00  0.00      A       
ATOM     24  HB1 TRP A   2      15.446  -1.844   0.089  1.00  0.00      A       
ATOM     25  HD1 TRP A   2      18.517  -3.877   0.744  1.00  0.00      A       
ATOM     26  HE1 TRP A   2      20.227  -3.537  -1.149  1.00  0.00      A       
ATOM     27  HE3 TRP A   2      16.329   0.113  -1.602  1.00  0.00      A       
ATOM     28  HH2 TRP A   2      19.519   0.120  -4.438  1.00  0.00      A       
ATOM     29  HZ2 TRP A   2      20.594  -1.800  -3.342  1.00  0.00      A       
ATOM     30  HZ3 TRP A   2      17.432   1.055  -3.588  1.00  0.00      A       
ATOM     31  N   TRP A   2      17.724  -0.936   2.410  1.00  0.00      A       
ATOM     32  NE1 TRP A   2      19.419  -2.978  -1.032  1.00  0.00      A       
ATOM     33  O   TRP A   2      14.127  -1.011   2.281  1.00  0.00      A       
ATOM     34  C   GLY A   3      13.711   0.649   4.916  1.00  0.00      A       
ATOM     35  CA  GLY A   3      14.547  -0.610   4.963  1.00  0.00      A       
ATOM     36  HN  GLY A   3      16.519  -0.481   4.208  1.00  0.00      A       
ATOM     37  HA2 GLY A   3      13.900  -1.460   4.808  1.00  0.00      A       
ATOM     38  HA1 GLY A   3      15.008  -0.688   5.938  1.00  0.00      A       
ATOM     39  N   GLY A   3      15.583  -0.626   3.949  1.00  0.00      A       
ATOM     40  O   GLY A   3      12.616   0.693   5.467  1.00  0.00      A       
ATOM     41  C   SER A   4      12.328   2.785   3.097  1.00  0.00      A       
ATOM     42  CA  SER A   4      13.494   2.926   4.077  1.00  0.00      A       
ATOM     43  CB  SER A   4      14.451   4.022   3.605  1.00  0.00      A       
ATOM     44  HN  SER A   4      15.102   1.572   3.820  1.00  0.00      A       
ATOM     45  HA  SER A   4      13.102   3.198   5.045  1.00  0.00      A       
ATOM     46  HB2 SER A   4      14.833   3.769   2.628  1.00  0.00      A       
ATOM     47  HB1 SER A   4      13.923   4.963   3.552  1.00  0.00      A       
ATOM     48  HG  SER A   4      15.965   3.295   4.623  1.00  0.00      A       
ATOM     49  N   SER A   4      14.215   1.667   4.230  1.00  0.00      A       
ATOM     50  O   SER A   4      11.677   3.767   2.743  1.00  0.00      A       
ATOM     51  OG  SER A   4      15.538   4.156   4.504  1.00  0.00      A       
ATOM     52  C   PHE A   5       9.886   0.500   2.462  1.00  0.00      A       
ATOM     53  CA  PHE A   5      10.979   1.284   1.746  1.00  0.00      A       
ATOM     54  CB  PHE A   5      11.481   0.496   0.533  1.00  0.00      A       
ATOM     55  CD1 PHE A   5      13.774   1.304  -0.111  1.00  0.00      A       
ATOM     56  CD2 PHE A   5      11.920   1.969  -1.453  1.00  0.00      A       
ATOM     57  CE1 PHE A   5      14.628   2.019  -0.929  1.00  0.00      A       
ATOM     58  CE2 PHE A   5      12.771   2.686  -2.277  1.00  0.00      A       
ATOM     59  CG  PHE A   5      12.412   1.273  -0.361  1.00  0.00      A       
ATOM     60  CZ  PHE A   5      14.126   2.709  -2.015  1.00  0.00      A       
ATOM     61  HN  PHE A   5      12.636   0.816   2.967  1.00  0.00      A       
ATOM     62  HA  PHE A   5      10.573   2.227   1.412  1.00  0.00      A       
ATOM     63  HB2 PHE A   5      12.011  -0.380   0.882  1.00  0.00      A       
ATOM     64  HB1 PHE A   5      10.634   0.184  -0.059  1.00  0.00      A       
ATOM     65  HD1 PHE A   5      14.168   0.765   0.738  1.00  0.00      A       
ATOM     66  HD2 PHE A   5      10.861   1.952  -1.658  1.00  0.00      A       
ATOM     67  HE1 PHE A   5      15.690   2.035  -0.722  1.00  0.00      A       
ATOM     68  HE2 PHE A   5      12.376   3.225  -3.126  1.00  0.00      A       
ATOM     69  HZ  PHE A   5      14.792   3.266  -2.657  1.00  0.00      A       
ATOM     70  N   PHE A   5      12.074   1.561   2.658  1.00  0.00      A       
ATOM     71  O   PHE A   5       9.448  -0.549   1.984  1.00  0.00      A       
ATOM     72  C   PHE A   6       7.151   0.144   3.680  1.00  0.00      A       
ATOM     73  CA  PHE A   6       8.449   0.375   4.451  1.00  0.00      A       
ATOM     74  CB  PHE A   6       8.147   1.237   5.683  1.00  0.00      A       
ATOM     75  CD1 PHE A   6       9.830   0.736   7.478  1.00  0.00      A       
ATOM     76  CD2 PHE A   6       9.999   2.808   6.313  1.00  0.00      A       
ATOM     77  CE1 PHE A   6      10.930   1.073   8.243  1.00  0.00      A       
ATOM     78  CE2 PHE A   6      11.099   3.153   7.074  1.00  0.00      A       
ATOM     79  CG  PHE A   6       9.352   1.598   6.506  1.00  0.00      A       
ATOM     80  CZ  PHE A   6      11.565   2.283   8.041  1.00  0.00      A       
ATOM     81  HN  PHE A   6       9.835   1.878   3.904  1.00  0.00      A       
ATOM     82  HA  PHE A   6       8.841  -0.577   4.774  1.00  0.00      A       
ATOM     83  HB2 PHE A   6       7.684   2.155   5.361  1.00  0.00      A       
ATOM     84  HB1 PHE A   6       7.459   0.702   6.323  1.00  0.00      A       
ATOM     85  HD1 PHE A   6       9.334  -0.210   7.638  1.00  0.00      A       
ATOM     86  HD2 PHE A   6       9.635   3.488   5.557  1.00  0.00      A       
ATOM     87  HE1 PHE A   6      11.294   0.392   8.999  1.00  0.00      A       
ATOM     88  HE2 PHE A   6      11.594   4.100   6.912  1.00  0.00      A       
ATOM     89  HZ  PHE A   6      12.424   2.548   8.637  1.00  0.00      A       
ATOM     90  N   PHE A   6       9.458   1.023   3.609  1.00  0.00      A       
ATOM     91  O   PHE A   6       6.334   1.060   3.564  1.00  0.00      A       
ATOM     92  C   LYS A   7       5.472  -0.360   1.349  1.00  0.00      A       
ATOM     93  CA  LYS A   7       5.801  -1.444   2.373  1.00  0.00      A       
ATOM     94  CB  LYS A   7       4.587  -1.740   3.257  1.00  0.00      A       
ATOM     95  CD  LYS A   7       5.677  -3.394   4.836  1.00  0.00      A       
ATOM     96  CE  LYS A   7       5.425  -2.625   6.125  1.00  0.00      A       
ATOM     97  CG  LYS A   7       4.569  -3.157   3.822  1.00  0.00      A       
ATOM     98  HN  LYS A   7       7.637  -1.776   3.367  1.00  0.00      A       
ATOM     99  HA  LYS A   7       6.058  -2.345   1.837  1.00  0.00      A       
ATOM    100  HB2 LYS A   7       4.580  -1.045   4.082  1.00  0.00      A       
ATOM    101  HB1 LYS A   7       3.689  -1.598   2.673  1.00  0.00      A       
ATOM    102  HD2 LYS A   7       5.727  -4.450   5.062  1.00  0.00      A       
ATOM    103  HD1 LYS A   7       6.612  -3.069   4.408  1.00  0.00      A       
ATOM    104  HE2 LYS A   7       5.436  -1.567   5.905  1.00  0.00      A       
ATOM    105  HE1 LYS A   7       4.454  -2.901   6.511  1.00  0.00      A       
ATOM    106  HG2 LYS A   7       3.624  -3.322   4.305  1.00  0.00      A       
ATOM    107  HG1 LYS A   7       4.683  -3.856   3.007  1.00  0.00      A       
ATOM    108  HZ1 LYS A   7       6.215  -2.427   8.047  1.00  0.00      A       
ATOM    109  HZ2 LYS A   7       7.390  -2.573   6.834  1.00  0.00      A       
ATOM    110  HZ3 LYS A   7       6.517  -3.939   7.336  1.00  0.00      A       
ATOM    111  N   LYS A   7       6.966  -1.082   3.179  1.00  0.00      A       
ATOM    112  NZ  LYS A   7       6.457  -2.911   7.155  1.00  0.00      A       
ATOM    113  O   LYS A   7       4.365   0.179   1.330  1.00  0.00      A       
ATOM    114  C   LYS A   8       5.102   0.857  -1.385  1.00  0.00      A       
ATOM    115  CA  LYS A   8       6.317   1.034  -0.475  1.00  0.00      A       
ATOM    116  CB  LYS A   8       7.601   1.193  -1.316  1.00  0.00      A       
ATOM    117  CD  LYS A   8       7.910  -1.244  -1.900  1.00  0.00      A       
ATOM    118  CE  LYS A   8       9.287  -1.491  -1.302  1.00  0.00      A       
ATOM    119  CG  LYS A   8       7.765   0.169  -2.438  1.00  0.00      A       
ATOM    120  HN  LYS A   8       7.284  -0.564   0.534  1.00  0.00      A       
ATOM    121  HA  LYS A   8       6.173   1.921   0.090  1.00  0.00      A       
ATOM    122  HB2 LYS A   8       7.600   2.177  -1.761  1.00  0.00      A       
ATOM    123  HB1 LYS A   8       8.456   1.112  -0.658  1.00  0.00      A       
ATOM    124  HD2 LYS A   8       7.167  -1.385  -1.129  1.00  0.00      A       
ATOM    125  HD1 LYS A   8       7.740  -1.950  -2.702  1.00  0.00      A       
ATOM    126  HE2 LYS A   8      10.038  -1.269  -2.046  1.00  0.00      A       
ATOM    127  HE1 LYS A   8       9.417  -0.833  -0.456  1.00  0.00      A       
ATOM    128  HG2 LYS A   8       6.898   0.209  -3.080  1.00  0.00      A       
ATOM    129  HG1 LYS A   8       8.647   0.422  -3.010  1.00  0.00      A       
ATOM    130  HZ1 LYS A   8      10.413  -3.049  -0.474  1.00  0.00      A       
ATOM    131  HZ2 LYS A   8       9.293  -3.555  -1.646  1.00  0.00      A       
ATOM    132  HZ3 LYS A   8       8.759  -3.120  -0.099  1.00  0.00      A       
ATOM    133  N   LYS A   8       6.445  -0.058   0.494  1.00  0.00      A       
ATOM    134  NZ  LYS A   8       9.451  -2.898  -0.848  1.00  0.00      A       
ATOM    135  O   LYS A   8       4.530   1.828  -1.874  1.00  0.00      A       
ATOM    136  C   ALA A   9       2.261  -0.505  -1.739  1.00  0.00      A       
ATOM    137  CA  ALA A   9       3.593  -0.715  -2.453  1.00  0.00      A       
ATOM    138  CB  ALA A   9       3.716  -2.152  -2.939  1.00  0.00      A       
ATOM    139  HN  ALA A   9       5.182  -1.098  -1.110  1.00  0.00      A       
ATOM    140  HA  ALA A   9       3.638  -0.062  -3.314  1.00  0.00      A       
ATOM    141  HB1 ALA A   9       4.663  -2.284  -3.440  1.00  0.00      A       
ATOM    142  HB2 ALA A   9       2.912  -2.371  -3.626  1.00  0.00      A       
ATOM    143  HB3 ALA A   9       3.658  -2.824  -2.095  1.00  0.00      A       
ATOM    144  N   ALA A   9       4.710  -0.385  -1.578  1.00  0.00      A       
ATOM    145  O   ALA A   9       1.286  -0.051  -2.339  1.00  0.00      A       
ATOM    146  C   ALA A  10       0.724   0.776   0.634  1.00  0.00      A       
ATOM    147  CA  ALA A  10       1.020  -0.688   0.343  1.00  0.00      A       
ATOM    148  CB  ALA A  10       1.143  -1.479   1.636  1.00  0.00      A       
ATOM    149  HN  ALA A  10       3.054  -1.130  -0.019  1.00  0.00      A       
ATOM    150  HA  ALA A  10       0.202  -1.100  -0.230  1.00  0.00      A       
ATOM    151  HB1 ALA A  10       1.399  -2.504   1.408  1.00  0.00      A       
ATOM    152  HB2 ALA A  10       0.201  -1.453   2.165  1.00  0.00      A       
ATOM    153  HB3 ALA A  10       1.915  -1.045   2.255  1.00  0.00      A       
ATOM    154  N   ALA A  10       2.234  -0.816  -0.450  1.00  0.00      A       
ATOM    155  O   ALA A  10      -0.434   1.191   0.671  1.00  0.00      A       
ATOM    156  C   HIS A  11       0.939   3.686  -0.055  1.00  0.00      A       
ATOM    157  CA  HIS A  11       1.666   2.983   1.090  1.00  0.00      A       
ATOM    158  CB  HIS A  11       3.056   3.594   1.288  1.00  0.00      A       
ATOM    159  CD2 HIS A  11       2.632   6.156   1.371  1.00  0.00      A       
ATOM    160  CE1 HIS A  11       3.380   6.528   3.394  1.00  0.00      A       
ATOM    161  CG  HIS A  11       3.042   4.970   1.879  1.00  0.00      A       
ATOM    162  HN  HIS A  11       2.681   1.151   0.779  1.00  0.00      A       
ATOM    163  HA  HIS A  11       1.093   3.106   1.998  1.00  0.00      A       
ATOM    164  HB2 HIS A  11       3.628   2.961   1.951  1.00  0.00      A       
ATOM    165  HB1 HIS A  11       3.558   3.649   0.332  1.00  0.00      A       
ATOM    166  HD1 HIS A  11       3.878   4.573   3.776  1.00  0.00      A       
ATOM    167  HD2 HIS A  11       2.207   6.320   0.390  1.00  0.00      A       
ATOM    168  HE1 HIS A  11       3.654   7.025   4.313  1.00  0.00      A       
ATOM    169  HE2 HIS A  11       2.481   8.023   2.318  1.00  0.00      A       
ATOM    170  N   HIS A  11       1.786   1.555   0.816  1.00  0.00      A       
ATOM    171  ND1 HIS A  11       3.505   5.239   3.145  1.00  0.00      A       
ATOM    172  NE2 HIS A  11       2.853   7.108   2.333  1.00  0.00      A       
ATOM    173  O   HIS A  11       0.154   4.607   0.165  1.00  0.00      A       
ATOM    174  C   VAL A  12      -0.805   3.220  -2.672  1.00  0.00      A       
ATOM    175  CA  VAL A  12       0.582   3.823  -2.453  1.00  0.00      A       
ATOM    176  CB  VAL A  12       1.448   3.605  -3.714  1.00  0.00      A       
ATOM    177  CG1 VAL A  12       0.849   4.314  -4.918  1.00  0.00      A       
ATOM    178  CG2 VAL A  12       2.876   4.077  -3.473  1.00  0.00      A       
ATOM    179  HN  VAL A  12       1.842   2.502  -1.386  1.00  0.00      A       
ATOM    180  HA  VAL A  12       0.478   4.887  -2.287  1.00  0.00      A       
ATOM    181  HB  VAL A  12       1.475   2.546  -3.927  1.00  0.00      A       
ATOM    182 HG11 VAL A  12      -0.125   3.899  -5.134  1.00  0.00      A       
ATOM    183 HG12 VAL A  12       1.495   4.180  -5.773  1.00  0.00      A       
ATOM    184 HG13 VAL A  12       0.753   5.368  -4.702  1.00  0.00      A       
ATOM    185 HG21 VAL A  12       2.871   5.130  -3.227  1.00  0.00      A       
ATOM    186 HG22 VAL A  12       3.460   3.920  -4.367  1.00  0.00      A       
ATOM    187 HG23 VAL A  12       3.309   3.517  -2.658  1.00  0.00      A       
ATOM    188  N   VAL A  12       1.207   3.243  -1.275  1.00  0.00      A       
ATOM    189  O   VAL A  12      -1.725   3.900  -3.128  1.00  0.00      A       
ATOM    190  C   GLY A  13      -3.323   1.811  -1.650  1.00  0.00      A       
ATOM    191  CA  GLY A  13      -2.211   1.257  -2.519  1.00  0.00      A       
ATOM    192  HN  GLY A  13      -0.188   1.468  -1.933  1.00  0.00      A       
ATOM    193  HA2 GLY A  13      -2.502   1.348  -3.557  1.00  0.00      A       
ATOM    194  HA1 GLY A  13      -2.073   0.212  -2.287  1.00  0.00      A       
ATOM    195  N   GLY A  13      -0.949   1.946  -2.327  1.00  0.00      A       
ATOM    196  O   GLY A  13      -4.448   1.992  -2.116  1.00  0.00      A       
ATOM    197  C   LYS A  14      -4.513   3.994   0.198  1.00  0.00      A       
ATOM    198  CA  LYS A  14      -4.002   2.597   0.559  1.00  0.00      A       
ATOM    199  CB  LYS A  14      -3.419   2.577   1.980  1.00  0.00      A       
ATOM    200  CD  LYS A  14      -2.665   4.963   2.474  1.00  0.00      A       
ATOM    201  CE  LYS A  14      -3.578   5.067   3.686  1.00  0.00      A       
ATOM    202  CG  LYS A  14      -2.235   3.521   2.214  1.00  0.00      A       
ATOM    203  HN  LYS A  14      -2.084   1.969  -0.081  1.00  0.00      A       
ATOM    204  HA  LYS A  14      -4.837   1.914   0.527  1.00  0.00      A       
ATOM    205  HB2 LYS A  14      -4.199   2.832   2.681  1.00  0.00      A       
ATOM    206  HB1 LYS A  14      -3.086   1.571   2.182  1.00  0.00      A       
ATOM    207  HD2 LYS A  14      -1.786   5.564   2.646  1.00  0.00      A       
ATOM    208  HD1 LYS A  14      -3.191   5.335   1.606  1.00  0.00      A       
ATOM    209  HE2 LYS A  14      -4.452   4.454   3.514  1.00  0.00      A       
ATOM    210  HE1 LYS A  14      -3.048   4.701   4.553  1.00  0.00      A       
ATOM    211  HG2 LYS A  14      -1.675   3.171   3.069  1.00  0.00      A       
ATOM    212  HG1 LYS A  14      -1.602   3.498   1.339  1.00  0.00      A       
ATOM    213  HZ1 LYS A  14      -4.489   6.851   3.094  1.00  0.00      A       
ATOM    214  HZ2 LYS A  14      -3.188   7.063   4.158  1.00  0.00      A       
ATOM    215  HZ3 LYS A  14      -4.677   6.497   4.743  1.00  0.00      A       
ATOM    216  N   LYS A  14      -3.007   2.107  -0.391  1.00  0.00      A       
ATOM    217  NZ  LYS A  14      -4.014   6.465   3.937  1.00  0.00      A       
ATOM    218  O   LYS A  14      -5.465   4.485   0.807  1.00  0.00      A       
ATOM    219  C   HIS A  15      -5.728   5.941  -1.702  1.00  0.00      A       
ATOM    220  CA  HIS A  15      -4.283   5.967  -1.219  1.00  0.00      A       
ATOM    221  CB  HIS A  15      -3.379   6.450  -2.350  1.00  0.00      A       
ATOM    222  CD2 HIS A  15      -2.866   8.917  -1.726  1.00  0.00      A       
ATOM    223  CE1 HIS A  15      -3.629   9.871  -3.542  1.00  0.00      A       
ATOM    224  CG  HIS A  15      -3.351   7.939  -2.526  1.00  0.00      A       
ATOM    225  HN  HIS A  15      -3.127   4.189  -1.227  1.00  0.00      A       
ATOM    226  HA  HIS A  15      -4.200   6.640  -0.377  1.00  0.00      A       
ATOM    227  HB2 HIS A  15      -2.369   6.119  -2.162  1.00  0.00      A       
ATOM    228  HB1 HIS A  15      -3.728   6.015  -3.277  1.00  0.00      A       
ATOM    229  HD1 HIS A  15      -4.236   8.128  -4.435  1.00  0.00      A       
ATOM    230  HD2 HIS A  15      -2.419   8.782  -0.751  1.00  0.00      A       
ATOM    231  HE1 HIS A  15      -3.901  10.615  -4.277  1.00  0.00      A       
ATOM    232  HE2 HIS A  15      -2.558  10.942  -2.172  1.00  0.00      A       
ATOM    233  N   HIS A  15      -3.880   4.632  -0.783  1.00  0.00      A       
ATOM    234  ND1 HIS A  15      -3.823   8.572  -3.652  1.00  0.00      A       
ATOM    235  NE2 HIS A  15      -3.047  10.111  -2.382  1.00  0.00      A       
ATOM    236  O   HIS A  15      -6.500   6.873  -1.464  1.00  0.00      A       
ATOM    237  C   VAL A  16      -8.202   3.715  -1.917  1.00  0.00      A       
ATOM    238  CA  VAL A  16      -7.447   4.661  -2.840  1.00  0.00      A       
ATOM    239  CB  VAL A  16      -7.501   4.107  -4.262  1.00  0.00      A       
ATOM    240  CG1 VAL A  16      -7.222   5.200  -5.282  1.00  0.00      A       
ATOM    241  CG2 VAL A  16      -6.531   2.946  -4.440  1.00  0.00      A       
ATOM    242  HN  VAL A  16      -5.420   4.159  -2.554  1.00  0.00      A       
ATOM    243  HA  VAL A  16      -7.934   5.625  -2.835  1.00  0.00      A       
ATOM    244  HB  VAL A  16      -8.495   3.739  -4.412  1.00  0.00      A       
ATOM    245 HG11 VAL A  16      -7.284   4.789  -6.278  1.00  0.00      A       
ATOM    246 HG12 VAL A  16      -6.231   5.599  -5.119  1.00  0.00      A       
ATOM    247 HG13 VAL A  16      -7.948   5.993  -5.171  1.00  0.00      A       
ATOM    248 HG21 VAL A  16      -5.523   3.287  -4.258  1.00  0.00      A       
ATOM    249 HG22 VAL A  16      -6.606   2.567  -5.449  1.00  0.00      A       
ATOM    250 HG23 VAL A  16      -6.775   2.159  -3.742  1.00  0.00      A       
ATOM    251  N   VAL A  16      -6.088   4.856  -2.374  1.00  0.00      A       
ATOM    252  O   VAL A  16      -8.936   2.828  -2.359  1.00  0.00      A       
ATOM    253  C   GLY A  17     -10.126   3.141   0.402  1.00  0.00      A       
ATOM    254  CA  GLY A  17      -8.613   3.090   0.390  1.00  0.00      A       
ATOM    255  HN  GLY A  17      -7.454   4.682  -0.376  1.00  0.00      A       
ATOM    256  HA2 GLY A  17      -8.304   2.071   0.220  1.00  0.00      A       
ATOM    257  HA1 GLY A  17      -8.249   3.406   1.356  1.00  0.00      A       
ATOM    258  N   GLY A  17      -8.019   3.934  -0.633  1.00  0.00      A       
ATOM    259  O   GLY A  17     -10.774   2.309   1.040  1.00  0.00      A       
ATOM    260  C   LYS A  18     -12.776   3.010  -0.985  1.00  0.00      A       
ATOM    261  CA  LYS A  18     -12.133   4.258  -0.394  1.00  0.00      A       
ATOM    262  CB  LYS A  18     -12.504   5.475  -1.247  1.00  0.00      A       
ATOM    263  CD  LYS A  18     -10.517   7.038  -1.238  1.00  0.00      A       
ATOM    264  CE  LYS A  18      -9.995   8.395  -0.792  1.00  0.00      A       
ATOM    265  CG  LYS A  18     -11.939   6.796  -0.743  1.00  0.00      A       
ATOM    266  HN  LYS A  18     -10.113   4.720  -0.810  1.00  0.00      A       
ATOM    267  HA  LYS A  18     -12.503   4.404   0.608  1.00  0.00      A       
ATOM    268  HB2 LYS A  18     -12.141   5.316  -2.251  1.00  0.00      A       
ATOM    269  HB1 LYS A  18     -13.580   5.558  -1.276  1.00  0.00      A       
ATOM    270  HD2 LYS A  18      -9.871   6.268  -0.844  1.00  0.00      A       
ATOM    271  HD1 LYS A  18     -10.512   6.996  -2.319  1.00  0.00      A       
ATOM    272  HE2 LYS A  18     -10.714   9.152  -1.070  1.00  0.00      A       
ATOM    273  HE1 LYS A  18      -9.885   8.384   0.282  1.00  0.00      A       
ATOM    274  HG2 LYS A  18     -12.571   7.598  -1.091  1.00  0.00      A       
ATOM    275  HG1 LYS A  18     -11.936   6.781   0.338  1.00  0.00      A       
ATOM    276  HZ1 LYS A  18      -8.762   8.728  -2.451  1.00  0.00      A       
ATOM    277  HZ2 LYS A  18      -7.959   8.035  -1.124  1.00  0.00      A       
ATOM    278  HZ3 LYS A  18      -8.377   9.676  -1.102  1.00  0.00      A       
ATOM    279  N   LYS A  18     -10.687   4.102  -0.317  1.00  0.00      A       
ATOM    280  NZ  LYS A  18      -8.683   8.728  -1.409  1.00  0.00      A       
ATOM    281  O   LYS A  18     -13.894   2.648  -0.630  1.00  0.00      A       
ATOM    282  C   ALA A  19     -11.732  -0.065  -2.069  1.00  0.00      A       
ATOM    283  CA  ALA A  19     -12.549   1.140  -2.516  1.00  0.00      A       
ATOM    284  CB  ALA A  19     -12.508   1.277  -4.029  1.00  0.00      A       
ATOM    285  HN  ALA A  19     -11.167   2.692  -2.131  1.00  0.00      A       
ATOM    286  HA  ALA A  19     -13.577   1.000  -2.216  1.00  0.00      A       
ATOM    287  HB1 ALA A  19     -12.923   0.389  -4.482  1.00  0.00      A       
ATOM    288  HB2 ALA A  19     -11.483   1.397  -4.349  1.00  0.00      A       
ATOM    289  HB3 ALA A  19     -13.083   2.139  -4.330  1.00  0.00      A       
ATOM    290  N   ALA A  19     -12.058   2.353  -1.885  1.00  0.00      A       
ATOM    291  O   ALA A  19     -11.734  -1.110  -2.719  1.00  0.00      A       
ATOM    292  C   ALA A  20     -10.834  -1.633   0.781  1.00  0.00      A       
ATOM    293  CA  ALA A  20     -10.193  -0.991  -0.434  1.00  0.00      A       
ATOM    294  CB  ALA A  20      -8.812  -0.474  -0.078  1.00  0.00      A       
ATOM    295  HN  ALA A  20     -11.084   0.932  -0.463  1.00  0.00      A       
ATOM    296  HA  ALA A  20     -10.087  -1.737  -1.209  1.00  0.00      A       
ATOM    297  HB1 ALA A  20      -8.903   0.299   0.669  1.00  0.00      A       
ATOM    298  HB2 ALA A  20      -8.339  -0.072  -0.960  1.00  0.00      A       
ATOM    299  HB3 ALA A  20      -8.218  -1.285   0.314  1.00  0.00      A       
ATOM    300  N   ALA A  20     -11.031   0.082  -0.953  1.00  0.00      A       
ATOM    301  O   ALA A  20     -10.402  -2.690   1.233  1.00  0.00      A       
ATOM    302  C   LEU A  21     -13.199  -2.857   2.242  1.00  0.00      A       
ATOM    303  CA  LEU A  21     -12.589  -1.478   2.477  1.00  0.00      A       
ATOM    304  CB  LEU A  21     -13.661  -0.464   2.906  1.00  0.00      A       
ATOM    305  CD1 LEU A  21     -15.688  -1.013   1.504  1.00  0.00      A       
ATOM    306  CD2 LEU A  21     -15.258   1.339   2.215  1.00  0.00      A       
ATOM    307  CG  LEU A  21     -14.615   0.023   1.807  1.00  0.00      A       
ATOM    308  HN  LEU A  21     -12.201  -0.179   0.849  1.00  0.00      A       
ATOM    309  HA  LEU A  21     -11.860  -1.563   3.269  1.00  0.00      A       
ATOM    310  HB2 LEU A  21     -14.255  -0.916   3.687  1.00  0.00      A       
ATOM    311  HB1 LEU A  21     -13.159   0.398   3.318  1.00  0.00      A       
ATOM    312 HD11 LEU A  21     -15.223  -1.928   1.168  1.00  0.00      A       
ATOM    313 HD12 LEU A  21     -16.343  -0.637   0.732  1.00  0.00      A       
ATOM    314 HD13 LEU A  21     -16.263  -1.210   2.398  1.00  0.00      A       
ATOM    315 HD21 LEU A  21     -15.827   1.195   3.122  1.00  0.00      A       
ATOM    316 HD22 LEU A  21     -15.915   1.678   1.427  1.00  0.00      A       
ATOM    317 HD23 LEU A  21     -14.490   2.077   2.387  1.00  0.00      A       
ATOM    318  HG  LEU A  21     -14.050   0.193   0.903  1.00  0.00      A       
ATOM    319  N   LEU A  21     -11.886  -0.997   1.288  1.00  0.00      A       
ATOM    320  O   LEU A  21     -13.632  -3.523   3.178  1.00  0.00      A       
ATOM    321  C   THR A  22     -12.800  -5.703   1.001  1.00  0.00      A       
ATOM    322  CA  THR A  22     -13.759  -4.575   0.616  1.00  0.00      A       
ATOM    323  CB  THR A  22     -14.021  -4.630  -0.897  1.00  0.00      A       
ATOM    324  CG2 THR A  22     -15.149  -5.600  -1.220  1.00  0.00      A       
ATOM    325  HN  THR A  22     -12.823  -2.707   0.290  1.00  0.00      A       
ATOM    326  HA  THR A  22     -14.695  -4.710   1.134  1.00  0.00      A       
ATOM    327  HB  THR A  22     -13.121  -4.966  -1.394  1.00  0.00      A       
ATOM    328  HG1 THR A  22     -14.022  -3.214  -2.277  1.00  0.00      A       
ATOM    329 HG21 THR A  22     -14.874  -6.593  -0.894  1.00  0.00      A       
ATOM    330 HG22 THR A  22     -15.325  -5.609  -2.286  1.00  0.00      A       
ATOM    331 HG23 THR A  22     -16.048  -5.290  -0.710  1.00  0.00      A       
ATOM    332  N   THR A  22     -13.206  -3.282   0.989  1.00  0.00      A       
ATOM    333  O   THR A  22     -13.200  -6.857   1.142  1.00  0.00      A       
ATOM    334  OG1 THR A  22     -14.362  -3.320  -1.374  1.00  0.00      A       
ATOM    335  C   HIS A  23      -9.438  -5.731   2.407  1.00  0.00      A       
ATOM    336  CA  HIS A  23     -10.506  -6.344   1.511  1.00  0.00      A       
ATOM    337  CB  HIS A  23      -9.875  -6.924   0.232  1.00  0.00      A       
ATOM    338  CD2 HIS A  23      -8.288  -5.103  -0.734  1.00  0.00      A       
ATOM    339  CE1 HIS A  23      -9.381  -4.676  -2.583  1.00  0.00      A       
ATOM    340  CG  HIS A  23      -9.387  -5.897  -0.749  1.00  0.00      A       
ATOM    341  HN  HIS A  23     -11.274  -4.410   1.110  1.00  0.00      A       
ATOM    342  HA  HIS A  23     -10.988  -7.144   2.053  1.00  0.00      A       
ATOM    343  HB2 HIS A  23      -9.030  -7.535   0.508  1.00  0.00      A       
ATOM    344  HB1 HIS A  23     -10.606  -7.540  -0.271  1.00  0.00      A       
ATOM    345  HD1 HIS A  23     -10.890  -6.033  -2.235  1.00  0.00      A       
ATOM    346  HD2 HIS A  23      -7.533  -5.071   0.039  1.00  0.00      A       
ATOM    347  HE1 HIS A  23      -9.667  -4.249  -3.532  1.00  0.00      A       
ATOM    348  HE2 HIS A  23      -7.575  -3.773  -2.201  1.00  0.00      A       
ATOM    349  N   HIS A  23     -11.529  -5.357   1.184  1.00  0.00      A       
ATOM    350  ND1 HIS A  23     -10.050  -5.604  -1.921  1.00  0.00      A       
ATOM    351  NE2 HIS A  23      -8.310  -4.355  -1.883  1.00  0.00      A       
ATOM    352  O   HIS A  23      -8.242  -5.873   2.161  1.00  0.00      A       
ATOM    353  C   TYR A  24      -9.642  -4.045   5.677  1.00  0.00      A       
ATOM    354  CA  TYR A  24      -8.970  -4.351   4.345  1.00  0.00      A       
ATOM    355  CB  TYR A  24      -8.483  -3.053   3.688  1.00  0.00      A       
ATOM    356  CD1 TYR A  24      -6.275  -2.451   4.763  1.00  0.00      A       
ATOM    357  CD2 TYR A  24      -8.162  -1.061   5.208  1.00  0.00      A       
ATOM    358  CE1 TYR A  24      -5.489  -1.643   5.563  1.00  0.00      A       
ATOM    359  CE2 TYR A  24      -7.381  -0.249   6.005  1.00  0.00      A       
ATOM    360  CG  TYR A  24      -7.624  -2.177   4.574  1.00  0.00      A       
ATOM    361  CZ  TYR A  24      -6.048  -0.542   6.180  1.00  0.00      A       
ATOM    362  HN  TYR A  24     -10.847  -5.011   3.623  1.00  0.00      A       
ATOM    363  HA  TYR A  24      -8.122  -4.994   4.519  1.00  0.00      A       
ATOM    364  HB2 TYR A  24      -7.901  -3.304   2.815  1.00  0.00      A       
ATOM    365  HB1 TYR A  24      -9.342  -2.472   3.382  1.00  0.00      A       
ATOM    366  HD1 TYR A  24      -5.841  -3.314   4.278  1.00  0.00      A       
ATOM    367  HD2 TYR A  24      -9.212  -0.834   5.074  1.00  0.00      A       
ATOM    368  HE1 TYR A  24      -4.444  -1.873   5.699  1.00  0.00      A       
ATOM    369  HE2 TYR A  24      -7.817   0.613   6.487  1.00  0.00      A       
ATOM    370  HH  TYR A  24      -4.425   0.431   6.528  1.00  0.00      A       
ATOM    371  N   TYR A  24      -9.883  -5.045   3.448  1.00  0.00      A       
ATOM    372  O   TYR A  24      -9.207  -4.516   6.727  1.00  0.00      A       
ATOM    373  OH  TYR A  24      -5.271   0.268   6.973  1.00  0.00      A       
ATOM    374  C   LEU A  25     -12.462  -3.776   7.235  1.00  0.00      A       
ATOM    375  CA  LEU A  25     -11.379  -2.787   6.803  1.00  0.00      A       
ATOM    376  CB  LEU A  25     -11.982  -1.418   6.501  1.00  0.00      A       
ATOM    377  CD1 LEU A  25     -11.454  -0.358   8.686  1.00  0.00      A       
ATOM    378  CD2 LEU A  25     -13.260   0.572   7.227  1.00  0.00      A       
ATOM    379  CG  LEU A  25     -12.556  -0.683   7.694  1.00  0.00      A       
ATOM    380  HN  LEU A  25     -11.044  -2.974   4.751  1.00  0.00      A       
ATOM    381  HA  LEU A  25     -10.653  -2.686   7.595  1.00  0.00      A       
ATOM    382  HB2 LEU A  25     -11.213  -0.800   6.062  1.00  0.00      A       
ATOM    383  HB1 LEU A  25     -12.769  -1.544   5.776  1.00  0.00      A       
ATOM    384 HD11 LEU A  25     -11.875   0.153   9.539  1.00  0.00      A       
ATOM    385 HD12 LEU A  25     -10.719   0.276   8.209  1.00  0.00      A       
ATOM    386 HD13 LEU A  25     -10.982  -1.274   9.008  1.00  0.00      A       
ATOM    387 HD21 LEU A  25     -13.733   1.057   8.069  1.00  0.00      A       
ATOM    388 HD22 LEU A  25     -14.006   0.306   6.493  1.00  0.00      A       
ATOM    389 HD23 LEU A  25     -12.540   1.240   6.782  1.00  0.00      A       
ATOM    390  HG  LEU A  25     -13.280  -1.317   8.183  1.00  0.00      A       
ATOM    391  N   LEU A  25     -10.702  -3.256   5.618  1.00  0.00      A       
ATOM    392  OT1 LEU A  25     -13.636  -3.587   6.851  1.00  0.00      A       
ATOM    393  OT2 LEU A  25     -12.133  -4.748   7.944  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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