NMR Restraints Grid

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

image mrblock_id pdb_id cing in_recoord stage program type subtype
469465 1agg cing recoord 3-converted-DOCR XPLOR/CNS coordinate ensemble


ATOM      1  C   GLU A   1      15.778  10.998   6.447  1.00  0.00      A       
ATOM      2  CA  GLU A   1      16.491  12.228   5.819  1.00  0.00      A       
ATOM      3  CB  GLU A   1      15.754  12.727   4.542  1.00  0.00      A       
ATOM      4  CD  GLU A   1      14.122  14.434   5.633  1.00  0.00      A       
ATOM      5  CG  GLU A   1      14.295  13.214   4.719  1.00  0.00      A       
ATOM      6  HT1 GLU A   1      18.401  11.521   6.279  1.00  0.00      A       
ATOM      7  HT2 GLU A   1      17.884  11.074   4.775  1.00  0.00      A       
ATOM      8  HT3 GLU A   1      18.391  12.623   5.049  1.00  0.00      A       
ATOM      9  HA  GLU A   1      16.546  13.051   6.560  1.00  0.00      A       
ATOM     10  HB2 GLU A   1      16.334  13.550   4.082  1.00  0.00      A       
ATOM     11  HB1 GLU A   1      15.752  11.926   3.776  1.00  0.00      A       
ATOM     12  HE2 GLU A   1      13.703  14.844   7.490  1.00  0.00      A       
ATOM     13  HG2 GLU A   1      13.882  13.467   3.725  1.00  0.00      A       
ATOM     14  HG1 GLU A   1      13.662  12.382   5.080  1.00  0.00      A       
ATOM     15  N   GLU A   1      17.872  11.839   5.460  1.00  0.00      A       
ATOM     16  O   GLU A   1      15.643   9.944   5.815  1.00  0.00      A       
ATOM     17  OE1 GLU A   1      14.254  15.594   5.247  1.00  0.00      A       
ATOM     18  OE2 GLU A   1      13.806  14.078   6.920  1.00  0.00      A       
ATOM     19  C   ASP A   2      13.115  10.896   8.769  1.00  0.00      A       
ATOM     20  CA  ASP A   2      14.439  10.179   8.388  1.00  0.00      A       
ATOM     21  CB  ASP A   2      15.150   9.637   9.660  1.00  0.00      A       
ATOM     22  CG  ASP A   2      16.360   8.731   9.383  1.00  0.00      A       
ATOM     23  HN  ASP A   2      15.471  12.106   8.087  1.00  0.00      A       
ATOM     24  HA  ASP A   2      14.223   9.310   7.732  1.00  0.00      A       
ATOM     25  HB2 ASP A   2      15.467  10.470  10.317  1.00  0.00      A       
ATOM     26  HB1 ASP A   2      14.429   9.060  10.270  1.00  0.00      A       
ATOM     27  HD2 ASP A   2      15.040   7.318   9.163  1.00  0.00      A       
ATOM     28  N   ASP A   2      15.291  11.178   7.688  1.00  0.00      A       
ATOM     29  O   ASP A   2      13.112  11.834   9.574  1.00  0.00      A       
ATOM     30  OD1 ASP A   2      17.523   9.134   9.390  1.00  0.00      A       
ATOM     31  OD2 ASP A   2      15.992   7.436   9.124  1.00  0.00      A       
ATOM     32  C   ASN A   3       9.667   9.956   7.722  1.00  0.00      A       
ATOM     33  CA  ASN A   3      10.626  10.851   8.567  1.00  0.00      A       
ATOM     34  CB  ASN A   3      10.305  12.349   8.322  1.00  0.00      A       
ATOM     35  CG  ASN A   3      10.536  13.025   6.947  1.00  0.00      A       
ATOM     36  HN  ASN A   3      12.090   9.561   7.657  1.00  0.00      A       
ATOM     37  HA  ASN A   3      10.489  10.659   9.652  1.00  0.00      A       
ATOM     38  HB2 ASN A   3       9.238  12.400   8.601  1.00  0.00      A       
ATOM     39  HB1 ASN A   3      10.823  12.953   9.092  1.00  0.00      A       
ATOM     40 HD21 ASN A   3       9.620  14.676   7.621  1.00  0.00      A       
ATOM     41 HD22 ASN A   3      10.251  14.709   5.898  1.00  0.00      A       
ATOM     42  N   ASN A   3      11.996  10.439   8.175  1.00  0.00      A       
ATOM     43  ND2 ASN A   3      10.089  14.262   6.807  1.00  0.00      A       
ATOM     44  O   ASN A   3       9.197  10.266   6.622  1.00  0.00      A       
ATOM     45  OD1 ASN A   3      11.114  12.466   6.015  1.00  0.00      A       
ATOM     46  C   CYS A   4       7.636   7.187   9.039  1.00  0.00      A       
ATOM     47  CA  CYS A   4       8.472   7.777   7.852  1.00  0.00      A       
ATOM     48  CB  CYS A   4       9.249   6.680   7.133  1.00  0.00      A       
ATOM     49  HN  CYS A   4      10.013   8.794   9.170  1.00  0.00      A       
ATOM     50  HA  CYS A   4       7.764   8.179   7.107  1.00  0.00      A       
ATOM     51  HB2 CYS A   4       8.422   6.027   6.939  1.00  0.00      A       
ATOM     52  HB1 CYS A   4       9.578   6.930   6.114  1.00  0.00      A       
ATOM     53  N   CYS A   4       9.412   8.815   8.344  1.00  0.00      A       
ATOM     54  O   CYS A   4       7.911   7.449  10.218  1.00  0.00      A       
ATOM     55  SG  CYS A   4      10.403   5.650   8.059  1.00  0.00      A       
ATOM     56  C   ILE A   5       6.161   4.218   9.728  1.00  0.00      A       
ATOM     57  CA  ILE A   5       5.754   5.707   9.774  1.00  0.00      A       
ATOM     58  CB  ILE A   5       4.198   5.884   9.556  1.00  0.00      A       
ATOM     59  CD1 ILE A   5       2.426   7.666   9.048  1.00  0.00      A       
ATOM     60  CG1 ILE A   5       3.862   7.375   9.418  1.00  0.00      A       
ATOM     61  CG2 ILE A   5       3.391   5.235  10.734  1.00  0.00      A       
ATOM     62  HN  ILE A   5       6.578   6.126   7.681  1.00  0.00      A       
ATOM     63  HA  ILE A   5       5.979   6.136  10.763  1.00  0.00      A       
ATOM     64  HB  ILE A   5       3.838   5.410   8.653  1.00  0.00      A       
ATOM     65 HD11 ILE A   5       1.764   7.252   9.814  1.00  0.00      A       
ATOM     66 HD12 ILE A   5       2.215   8.746   9.000  1.00  0.00      A       
ATOM     67 HD13 ILE A   5       2.156   7.210   8.078  1.00  0.00      A       
ATOM     68 HG12 ILE A   5       4.121   7.890  10.336  1.00  0.00      A       
ATOM     69 HG11 ILE A   5       4.482   7.810   8.619  1.00  0.00      A       
ATOM     70 HG21 ILE A   5       3.614   4.158  10.855  1.00  0.00      A       
ATOM     71 HG22 ILE A   5       3.544   5.718  11.714  1.00  0.00      A       
ATOM     72 HG23 ILE A   5       2.297   5.244  10.544  1.00  0.00      A       
ATOM     73  N   ILE A   5       6.602   6.364   8.705  1.00  0.00      A       
ATOM     74  O   ILE A   5       5.686   3.450   8.897  1.00  0.00      A       
ATOM     75  C   ALA A   6       6.606   1.228  11.016  1.00  0.00      A       
ATOM     76  CA  ALA A   6       7.584   2.361  10.499  1.00  0.00      A       
ATOM     77  CB  ALA A   6       8.895   2.351  11.309  1.00  0.00      A       
ATOM     78  HN  ALA A   6       7.245   4.415  11.367  1.00  0.00      A       
ATOM     79  HA  ALA A   6       7.772   2.169   9.413  1.00  0.00      A       
ATOM     80  HB1 ALA A   6       9.611   3.113  10.946  1.00  0.00      A       
ATOM     81  HB2 ALA A   6       8.726   2.540  12.387  1.00  0.00      A       
ATOM     82  HB3 ALA A   6       9.410   1.376  11.228  1.00  0.00      A       
ATOM     83  N   ALA A   6       7.041   3.755  10.618  1.00  0.00      A       
ATOM     84  O   ALA A   6       7.021   0.091  11.263  1.00  0.00      A       
ATOM     85  C   GLU A   7       3.186   0.236  10.818  1.00  0.00      A       
ATOM     86  CA  GLU A   7       4.268   0.735  11.806  1.00  0.00      A       
ATOM     87  CB  GLU A   7       3.664   1.604  12.942  1.00  0.00      A       
ATOM     88  CD  GLU A   7       3.901   2.711  15.236  1.00  0.00      A       
ATOM     89  CG  GLU A   7       4.590   1.883  14.149  1.00  0.00      A       
ATOM     90  HN  GLU A   7       5.266   2.593  11.046  1.00  0.00      A       
ATOM     91  HA  GLU A   7       4.662  -0.161  12.252  1.00  0.00      A       
ATOM     92  HB2 GLU A   7       3.288   2.556  12.528  1.00  0.00      A       
ATOM     93  HB1 GLU A   7       2.775   1.081  13.340  1.00  0.00      A       
ATOM     94  HE2 GLU A   7       2.683   2.464  16.735  1.00  0.00      A       
ATOM     95  HG2 GLU A   7       4.949   0.931  14.582  1.00  0.00      A       
ATOM     96  HG1 GLU A   7       5.499   2.420  13.818  1.00  0.00      A       
ATOM     97  N   GLU A   7       5.313   1.567  11.156  1.00  0.00      A       
ATOM     98  O   GLU A   7       2.972   0.775   9.733  1.00  0.00      A       
ATOM     99  OE1 GLU A   7       4.031   3.930  15.344  1.00  0.00      A       
ATOM    100  OE2 GLU A   7       3.118   1.940  16.058  1.00  0.00      A       
ATOM    101  C   ASP A   8      -0.123  -1.202  11.305  1.00  0.00      A       
ATOM    102  CA  ASP A   8       1.257  -1.389  10.616  1.00  0.00      A       
ATOM    103  CB  ASP A   8       1.522  -2.890  10.457  1.00  0.00      A       
ATOM    104  CG  ASP A   8       1.541  -3.790  11.716  1.00  0.00      A       
ATOM    105  HN  ASP A   8       2.819  -1.176  12.183  1.00  0.00      A       
ATOM    106  HA  ASP A   8       1.108  -0.854   9.683  1.00  0.00      A       
ATOM    107  HB2 ASP A   8       0.774  -3.222   9.745  1.00  0.00      A       
ATOM    108  HB1 ASP A   8       2.502  -3.003  10.028  1.00  0.00      A       
ATOM    109  HD2 ASP A   8       0.619  -5.072  10.578  1.00  0.00      A       
ATOM    110  N   ASP A   8       2.508  -0.838  11.266  1.00  0.00      A       
ATOM    111  O   ASP A   8      -1.172  -1.685  10.880  1.00  0.00      A       
ATOM    112  OD1 ASP A   8       2.042  -3.467  12.793  1.00  0.00      A       
ATOM    113  OD2 ASP A   8       0.945  -5.001  11.478  1.00  0.00      A       
ATOM    114  C   TYR A   9      -0.492   1.543  13.776  1.00  0.00      A       
ATOM    115  CA  TYR A   9      -1.038   0.190  13.168  1.00  0.00      A       
ATOM    116  CB  TYR A   9      -1.490  -0.797  14.297  1.00  0.00      A       
ATOM    117  CD1 TYR A   9      -3.057  -2.434  13.109  1.00  0.00      A       
ATOM    118  CD2 TYR A   9      -1.055  -3.316  14.133  1.00  0.00      A       
ATOM    119  CE1 TYR A   9      -3.372  -3.704  12.632  1.00  0.00      A       
ATOM    120  CE2 TYR A   9      -1.381  -4.588  13.669  1.00  0.00      A       
ATOM    121  CG  TYR A   9      -1.908  -2.231  13.883  1.00  0.00      A       
ATOM    122  CZ  TYR A   9      -2.539  -4.782  12.920  1.00  0.00      A       
ATOM    123  HN  TYR A   9       1.006  -0.256  12.092  1.00  0.00      A       
ATOM    124  HA  TYR A   9      -1.912   0.444  12.534  1.00  0.00      A       
ATOM    125  HB2 TYR A   9      -0.702  -0.854  15.074  1.00  0.00      A       
ATOM    126  HB1 TYR A   9      -2.350  -0.324  14.817  1.00  0.00      A       
ATOM    127  HD1 TYR A   9      -3.630  -1.589  12.763  1.00  0.00      A       
ATOM    128  HD2 TYR A   9      -0.083  -3.171  14.590  1.00  0.00      A       
ATOM    129  HE1 TYR A   9      -4.233  -3.841  11.994  1.00  0.00      A       
ATOM    130  HE2 TYR A   9      -0.701  -5.411  13.837  1.00  0.00      A       
ATOM    131  HH  TYR A   9      -3.641  -5.974  11.909  1.00  0.00      A       
ATOM    132  N   TYR A   9       0.021  -0.451  12.343  1.00  0.00      A       
ATOM    133  O   TYR A   9      -0.915   1.953  14.862  1.00  0.00      A       
ATOM    134  OH  TYR A   9      -2.826  -6.023  12.415  1.00  0.00      A       
ATOM    135  C   GLY A  10      -0.292   4.710  13.227  1.00  0.00      A       
ATOM    136  CA  GLY A  10       0.805   3.663  13.392  1.00  0.00      A       
ATOM    137  HN  GLY A  10       0.673   1.809  12.169  1.00  0.00      A       
ATOM    138  HA2 GLY A  10       1.304   3.714  14.369  1.00  0.00      A       
ATOM    139  HA1 GLY A  10       1.602   3.994  12.707  1.00  0.00      A       
ATOM    140  N   GLY A  10       0.382   2.280  13.045  1.00  0.00      A       
ATOM    141  O   GLY A  10      -1.384   4.410  12.754  1.00  0.00      A       
ATOM    142  C   LYS A  11      -0.303   7.721  11.978  1.00  0.00      A       
ATOM    143  CA  LYS A  11      -0.873   7.102  13.285  1.00  0.00      A       
ATOM    144  CB  LYS A  11      -0.922   8.197  14.374  1.00  0.00      A       
ATOM    145  CD  LYS A  11      -2.483   7.049  16.108  1.00  0.00      A       
ATOM    146  CE  LYS A  11      -2.692   6.577  17.560  1.00  0.00      A       
ATOM    147  CG  LYS A  11      -1.135   7.760  15.843  1.00  0.00      A       
ATOM    148  HN  LYS A  11       1.017   6.023  13.821  1.00  0.00      A       
ATOM    149  HA  LYS A  11      -1.921   6.748  13.142  1.00  0.00      A       
ATOM    150  HB2 LYS A  11      -0.019   8.809  14.274  1.00  0.00      A       
ATOM    151  HB1 LYS A  11      -1.732   8.905  14.112  1.00  0.00      A       
ATOM    152  HD2 LYS A  11      -3.304   7.744  15.847  1.00  0.00      A       
ATOM    153  HD1 LYS A  11      -2.608   6.189  15.421  1.00  0.00      A       
ATOM    154  HE2 LYS A  11      -2.514   7.407  18.269  1.00  0.00      A       
ATOM    155  HE1 LYS A  11      -3.749   6.286  17.700  1.00  0.00      A       
ATOM    156  HG2 LYS A  11      -0.295   7.112  16.157  1.00  0.00      A       
ATOM    157  HG1 LYS A  11      -1.065   8.654  16.491  1.00  0.00      A       
ATOM    158  HZ1 LYS A  11      -2.061   4.623  17.324  1.00  0.00      A       
ATOM    159  HZ2 LYS A  11      -2.050   5.122  18.881  1.00  0.00      A       
ATOM    160  N   LYS A  11       0.014   5.947  13.617  1.00  0.00      A       
ATOM    161  NZ  LYS A  11      -1.841   5.426  17.923  1.00  0.00      A       
ATOM    162  O   LYS A  11       0.886   8.046  11.880  1.00  0.00      A       
ATOM    163  C   CYS A  12      -1.973   9.329   9.130  1.00  0.00      A       
ATOM    164  CA  CYS A  12      -0.863   8.375   9.646  1.00  0.00      A       
ATOM    165  CB  CYS A  12      -0.703   7.164   8.689  1.00  0.00      A       
ATOM    166  HN  CYS A  12      -2.129   7.695  11.380  1.00  0.00      A       
ATOM    167  HA  CYS A  12       0.088   8.945   9.657  1.00  0.00      A       
ATOM    168  HB2 CYS A  12      -0.288   7.484   7.716  1.00  0.00      A       
ATOM    169  HB1 CYS A  12       0.001   6.408   9.059  1.00  0.00      A       
ATOM    170  N   CYS A  12      -1.194   7.871  11.006  1.00  0.00      A       
ATOM    171  O   CYS A  12      -2.923   9.701   9.830  1.00  0.00      A       
ATOM    172  SG  CYS A  12      -2.206   6.287   8.373  1.00  0.00      A       
ATOM    173  C   THR A  13      -2.886  10.201   5.680  1.00  0.00      A       
ATOM    174  CA  THR A  13      -2.743  10.658   7.169  1.00  0.00      A       
ATOM    175  CB  THR A  13      -2.184  12.114   7.244  1.00  0.00      A       
ATOM    176  CG2 THR A  13      -3.137  13.260   6.881  1.00  0.00      A       
ATOM    177  HN  THR A  13      -0.888   9.442   7.464  1.00  0.00      A       
ATOM    178  HA  THR A  13      -3.742  10.603   7.662  1.00  0.00      A       
ATOM    179  HB  THR A  13      -1.397  12.120   6.507  1.00  0.00      A       
ATOM    180  HG1 THR A  13      -1.373  13.327   8.505  1.00  0.00      A       
ATOM    181 HG21 THR A  13      -4.048  13.272   7.496  1.00  0.00      A       
ATOM    182 HG22 THR A  13      -2.617  14.231   7.015  1.00  0.00      A       
ATOM    183 HG23 THR A  13      -3.413  13.238   5.812  1.00  0.00      A       
ATOM    184  N   THR A  13      -1.792   9.751   7.867  1.00  0.00      A       
ATOM    185  O   THR A  13      -2.085   9.463   5.093  1.00  0.00      A       
ATOM    186  OG1 THR A  13      -1.750  12.446   8.564  1.00  0.00      A       
ATOM    187  C   TRP A  14      -3.745  12.013   3.054  1.00  0.00      A       
ATOM    188  CA  TRP A  14      -4.263  10.669   3.650  1.00  0.00      A       
ATOM    189  CB  TRP A  14      -5.787  10.467   3.396  1.00  0.00      A       
ATOM    190  CD1 TRP A  14      -5.753   7.816   3.526  1.00  0.00      A       
ATOM    191  CD2 TRP A  14      -7.694   8.777   4.033  1.00  0.00      A       
ATOM    192  CE2 TRP A  14      -7.826   7.365   4.099  1.00  0.00      A       
ATOM    193  CE3 TRP A  14      -8.807   9.613   4.314  1.00  0.00      A       
ATOM    194  CG  TRP A  14      -6.386   9.074   3.676  1.00  0.00      A       
ATOM    195  CH2 TRP A  14     -10.148   7.621   4.725  1.00  0.00      A       
ATOM    196  CZ2 TRP A  14      -9.067   6.783   4.450  1.00  0.00      A       
ATOM    197  CZ3 TRP A  14     -10.020   9.014   4.659  1.00  0.00      A       
ATOM    198  HN  TRP A  14      -4.306  11.415   5.783  1.00  0.00      A       
ATOM    199  HA  TRP A  14      -3.725   9.827   3.170  1.00  0.00      A       
ATOM    200  HB2 TRP A  14      -6.360  11.235   3.951  1.00  0.00      A       
ATOM    201  HB1 TRP A  14      -5.998  10.687   2.332  1.00  0.00      A       
ATOM    202  HD1 TRP A  14      -4.728   7.678   3.222  1.00  0.00      A       
ATOM    203  HE1 TRP A  14      -6.423   5.742   3.760  1.00  0.00      A       
ATOM    204  HE3 TRP A  14      -8.724  10.689   4.270  1.00  0.00      A       
ATOM    205  HH2 TRP A  14     -11.098   7.188   5.001  1.00  0.00      A       
ATOM    206  HZ2 TRP A  14      -9.178   5.711   4.513  1.00  0.00      A       
ATOM    207  HZ3 TRP A  14     -10.874   9.637   4.883  1.00  0.00      A       
ATOM    208  N   TRP A  14      -3.972  10.714   5.112  1.00  0.00      A       
ATOM    209  NE1 TRP A  14      -6.624   6.747   3.799  1.00  0.00      A       
ATOM    210  O   TRP A  14      -4.461  13.022   3.076  1.00  0.00      A       
ATOM    211  C   GLY A  15      -0.507  13.556   2.998  1.00  0.00      A       
ATOM    212  CA  GLY A  15      -1.797  13.286   2.181  1.00  0.00      A       
ATOM    213  HN  GLY A  15      -1.963  11.170   2.750  1.00  0.00      A       
ATOM    214  HA2 GLY A  15      -1.533  13.219   1.110  1.00  0.00      A       
ATOM    215  HA1 GLY A  15      -2.453  14.175   2.255  1.00  0.00      A       
ATOM    216  N   GLY A  15      -2.495  12.025   2.559  1.00  0.00      A       
ATOM    217  O   GLY A  15       0.501  13.981   2.429  1.00  0.00      A       
ATOM    218  C   GLY A  16       1.620  12.130   4.938  1.00  0.00      A       
ATOM    219  CA  GLY A  16       0.639  13.289   5.205  1.00  0.00      A       
ATOM    220  HN  GLY A  16      -1.426  12.843   4.599  1.00  0.00      A       
ATOM    221  HA2 GLY A  16       1.155  14.247   5.244  1.00  0.00      A       
ATOM    222  HA1 GLY A  16       0.278  13.234   6.246  1.00  0.00      A       
ATOM    223  N   GLY A  16      -0.550  13.301   4.321  1.00  0.00      A       
ATOM    224  O   GLY A  16       1.741  11.608   3.823  1.00  0.00      A       
ATOM    225  C   THR A  17       2.437   9.258   5.823  1.00  0.00      A       
ATOM    226  CA  THR A  17       3.277  10.583   5.955  1.00  0.00      A       
ATOM    227  CB  THR A  17       4.200  10.475   7.238  1.00  0.00      A       
ATOM    228  CG2 THR A  17       5.555   9.800   6.923  1.00  0.00      A       
ATOM    229  HN  THR A  17       2.188  12.403   6.778  1.00  0.00      A       
ATOM    230  HA  THR A  17       3.920  10.730   5.060  1.00  0.00      A       
ATOM    231  HB  THR A  17       3.707   9.847   8.013  1.00  0.00      A       
ATOM    232  HG1 THR A  17       3.664  12.169   7.980  1.00  0.00      A       
ATOM    233 HG21 THR A  17       5.440   8.777   6.528  1.00  0.00      A       
ATOM    234 HG22 THR A  17       6.169  10.349   6.188  1.00  0.00      A       
ATOM    235 HG23 THR A  17       6.169   9.686   7.838  1.00  0.00      A       
ATOM    236  N   THR A  17       2.319  11.735   6.010  1.00  0.00      A       
ATOM    237  O   THR A  17       1.372   9.062   6.433  1.00  0.00      A       
ATOM    238  OG1 THR A  17       4.507  11.768   7.753  1.00  0.00      A       
ATOM    239  C   LYS A  18       3.676   6.104   5.550  1.00  0.00      A       
ATOM    240  CA  LYS A  18       2.593   6.957   4.842  1.00  0.00      A       
ATOM    241  CB  LYS A  18       2.441   6.550   3.340  1.00  0.00      A       
ATOM    242  CD  LYS A  18       0.342   7.940   2.588  1.00  0.00      A       
ATOM    243  CE  LYS A  18      -0.672   6.803   2.357  1.00  0.00      A       
ATOM    244  CG  LYS A  18       1.810   7.538   2.325  1.00  0.00      A       
ATOM    245  HN  LYS A  18       3.930   8.693   4.665  1.00  0.00      A       
ATOM    246  HA  LYS A  18       1.621   6.732   5.316  1.00  0.00      A       
ATOM    247  HB2 LYS A  18       3.420   6.201   2.971  1.00  0.00      A       
ATOM    248  HB1 LYS A  18       1.847   5.618   3.307  1.00  0.00      A       
ATOM    249  HD2 LYS A  18       0.243   8.344   3.614  1.00  0.00      A       
ATOM    250  HD1 LYS A  18       0.097   8.787   1.919  1.00  0.00      A       
ATOM    251  HE2 LYS A  18      -0.568   6.394   1.336  1.00  0.00      A       
ATOM    252  HE1 LYS A  18      -0.480   5.962   3.049  1.00  0.00      A       
ATOM    253  HG2 LYS A  18       2.427   8.454   2.284  1.00  0.00      A       
ATOM    254  HG1 LYS A  18       1.890   7.107   1.309  1.00  0.00      A       
ATOM    255  HZ1 LYS A  18      -2.250   8.052   1.909  1.00  0.00      A       
ATOM    256  HZ2 LYS A  18      -2.170   7.652   3.492  1.00  0.00      A       
ATOM    257  N   LYS A  18       3.012   8.377   4.994  1.00  0.00      A       
ATOM    258  NZ  LYS A  18      -2.054   7.272   2.546  1.00  0.00      A       
ATOM    259  O   LYS A  18       4.696   6.572   6.090  1.00  0.00      A       
ATOM    260  C   CYS A  19       5.572   3.567   5.425  1.00  0.00      A       
ATOM    261  CA  CYS A  19       4.329   3.890   6.313  1.00  0.00      A       
ATOM    262  CB  CYS A  19       3.545   2.675   6.838  1.00  0.00      A       
ATOM    263  HN  CYS A  19       2.629   4.564   4.939  1.00  0.00      A       
ATOM    264  HA  CYS A  19       4.626   4.462   7.217  1.00  0.00      A       
ATOM    265  HB2 CYS A  19       2.769   2.341   6.127  1.00  0.00      A       
ATOM    266  HB1 CYS A  19       4.211   1.805   7.005  1.00  0.00      A       
ATOM    267  N   CYS A  19       3.426   4.792   5.559  1.00  0.00      A       
ATOM    268  O   CYS A  19       5.589   3.479   4.195  1.00  0.00      A       
ATOM    269  SG  CYS A  19       2.828   3.219   8.399  1.00  0.00      A       
ATOM    270  C   CYS A  20       8.539   2.692   4.706  1.00  0.00      A       
ATOM    271  CA  CYS A  20       8.068   3.591   5.889  1.00  0.00      A       
ATOM    272  CB  CYS A  20       8.861   3.177   7.148  1.00  0.00      A       
ATOM    273  HN  CYS A  20       6.368   3.619   7.228  1.00  0.00      A       
ATOM    274  HA  CYS A  20       8.179   4.665   5.743  1.00  0.00      A       
ATOM    275  HB2 CYS A  20       8.390   3.590   8.043  1.00  0.00      A       
ATOM    276  HB1 CYS A  20       8.922   2.082   7.301  1.00  0.00      A       
ATOM    277  N   CYS A  20       6.637   3.534   6.242  1.00  0.00      A       
ATOM    278  O   CYS A  20       9.227   3.199   3.816  1.00  0.00      A       
ATOM    279  SG  CYS A  20      10.511   3.901   7.060  1.00  0.00      A       
ATOM    280  C   ARG A  21       7.561   0.291   2.487  1.00  0.00      A       
ATOM    281  CA  ARG A  21       8.603   0.415   3.649  1.00  0.00      A       
ATOM    282  CB  ARG A  21       8.851  -0.925   4.416  1.00  0.00      A       
ATOM    283  CD  ARG A  21      10.857  -1.807   3.004  1.00  0.00      A       
ATOM    284  CG  ARG A  21       9.487  -2.107   3.644  1.00  0.00      A       
ATOM    285  CZ  ARG A  21      12.194  -3.921   2.585  1.00  0.00      A       
ATOM    286  HN  ARG A  21       7.501   1.214   5.434  1.00  0.00      A       
ATOM    287  HA  ARG A  21       9.522   0.778   3.164  1.00  0.00      A       
ATOM    288  HB2 ARG A  21       9.508  -0.737   5.289  1.00  0.00      A       
ATOM    289  HB1 ARG A  21       7.899  -1.283   4.856  1.00  0.00      A       
ATOM    290  HD2 ARG A  21      10.770  -0.963   2.296  1.00  0.00      A       
ATOM    291  HD1 ARG A  21      11.584  -1.481   3.771  1.00  0.00      A       
ATOM    292  HG2 ARG A  21       9.598  -2.954   4.349  1.00  0.00      A       
ATOM    293  HG1 ARG A  21       8.785  -2.479   2.876  1.00  0.00      A       
ATOM    294 HH11 ARG A  21      12.535  -3.244   4.447  1.00  0.00      A       
ATOM    295 HH12 ARG A  21      13.413  -4.773   3.938  1.00  0.00      A       
ATOM    296 HH21 ARG A  21      12.009  -4.779   0.785  1.00  0.00      A       
ATOM    297 HH22 ARG A  21      13.132  -5.587   1.991  1.00  0.00      A       
ATOM    298  N   ARG A  21       8.195   1.391   4.712  1.00  0.00      A       
ATOM    299  NE  ARG A  21      11.379  -2.998   2.257  1.00  0.00      A       
ATOM    300  NH1 ARG A  21      12.773  -3.986   3.780  1.00  0.00      A       
ATOM    301  NH2 ARG A  21      12.473  -4.857   1.697  1.00  0.00      A       
ATOM    302  O   ARG A  21       7.284  -0.784   1.951  1.00  0.00      A       
ATOM    303  C   GLY A  22       4.577   0.833   1.492  1.00  0.00      A       
ATOM    304  CA  GLY A  22       5.888   1.560   1.134  1.00  0.00      A       
ATOM    305  HN  GLY A  22       7.281   2.131   2.831  1.00  0.00      A       
ATOM    306  HA2 GLY A  22       5.673   2.631   0.965  1.00  0.00      A       
ATOM    307  HA1 GLY A  22       6.228   1.182   0.167  1.00  0.00      A       
ATOM    308  N   GLY A  22       7.005   1.444   2.111  1.00  0.00      A       
ATOM    309  O   GLY A  22       4.002   0.096   0.688  1.00  0.00      A       
ATOM    310  C   ARG A  23       1.786   1.248   3.436  1.00  0.00      A       
ATOM    311  CA  ARG A  23       3.058   0.329   3.384  1.00  0.00      A       
ATOM    312  CB  ARG A  23       3.529  -0.079   4.804  1.00  0.00      A       
ATOM    313  CD  ARG A  23       4.011  -2.611   4.734  1.00  0.00      A       
ATOM    314  CG  ARG A  23       4.578  -1.200   4.937  1.00  0.00      A       
ATOM    315  CZ  ARG A  23       5.041  -4.878   5.154  1.00  0.00      A       
ATOM    316  HN  ARG A  23       4.804   1.681   3.235  1.00  0.00      A       
ATOM    317  HA  ARG A  23       2.833  -0.595   2.822  1.00  0.00      A       
ATOM    318  HB2 ARG A  23       4.021   0.794   5.238  1.00  0.00      A       
ATOM    319  HB1 ARG A  23       2.671  -0.294   5.469  1.00  0.00      A       
ATOM    320  HD2 ARG A  23       3.224  -2.802   5.488  1.00  0.00      A       
ATOM    321  HD1 ARG A  23       3.525  -2.694   3.747  1.00  0.00      A       
ATOM    322  HG2 ARG A  23       5.418  -1.002   4.246  1.00  0.00      A       
ATOM    323  HG1 ARG A  23       5.015  -1.130   5.953  1.00  0.00      A       
ATOM    324 HH11 ARG A  23       3.053  -4.944   5.452  1.00  0.00      A       
ATOM    325 HH12 ARG A  23       3.989  -6.502   5.702  1.00  0.00      A       
ATOM    326 HH21 ARG A  23       7.021  -5.056   4.914  1.00  0.00      A       
ATOM    327 HH22 ARG A  23       6.095  -6.559   5.416  1.00  0.00      A       
ATOM    328  N   ARG A  23       4.153   1.071   2.727  1.00  0.00      A       
ATOM    329  NE  ARG A  23       5.090  -3.642   4.843  1.00  0.00      A       
ATOM    330  NH1 ARG A  23       3.912  -5.506   5.469  1.00  0.00      A       
ATOM    331  NH2 ARG A  23       6.166  -5.568   5.162  1.00  0.00      A       
ATOM    332  O   ARG A  23       1.912   2.436   3.788  1.00  0.00      A       
ATOM    333  C   PRO A  24      -1.266   2.127   4.257  1.00  0.00      A       
ATOM    334  CA  PRO A  24      -0.645   1.614   2.922  1.00  0.00      A       
ATOM    335  CB  PRO A  24      -1.588   0.686   2.125  1.00  0.00      A       
ATOM    336  CD  PRO A  24       0.304  -0.653   2.707  1.00  0.00      A       
ATOM    337  CG  PRO A  24      -1.209  -0.736   2.535  1.00  0.00      A       
ATOM    338  HA  PRO A  24      -0.398   2.514   2.322  1.00  0.00      A       
ATOM    339  HB2 PRO A  24      -2.662   0.895   2.283  1.00  0.00      A       
ATOM    340  HB1 PRO A  24      -1.406   0.821   1.042  1.00  0.00      A       
ATOM    341  HD2 PRO A  24       0.662  -1.370   3.469  1.00  0.00      A       
ATOM    342  HD1 PRO A  24       0.814  -0.885   1.754  1.00  0.00      A       
ATOM    343  HG2 PRO A  24      -1.691  -1.007   3.492  1.00  0.00      A       
ATOM    344  HG1 PRO A  24      -1.515  -1.494   1.793  1.00  0.00      A       
ATOM    345  N   PRO A  24       0.556   0.754   3.093  1.00  0.00      A       
ATOM    346  O   PRO A  24      -0.838   1.756   5.356  1.00  0.00      A       
ATOM    347  C   CYS A  25      -4.582   3.455   4.924  1.00  0.00      A       
ATOM    348  CA  CYS A  25      -3.066   3.502   5.279  1.00  0.00      A       
ATOM    349  CB  CYS A  25      -2.617   4.945   5.637  1.00  0.00      A       
ATOM    350  HN  CYS A  25      -2.538   3.220   3.156  1.00  0.00      A       
ATOM    351  HA  CYS A  25      -2.884   2.862   6.167  1.00  0.00      A       
ATOM    352  HB2 CYS A  25      -1.990   5.392   4.854  1.00  0.00      A       
ATOM    353  HB1 CYS A  25      -3.486   5.597   5.822  1.00  0.00      A       
ATOM    354  N   CYS A  25      -2.285   2.994   4.125  1.00  0.00      A       
ATOM    355  O   CYS A  25      -5.024   3.710   3.798  1.00  0.00      A       
ATOM    356  SG  CYS A  25      -1.650   4.855   7.121  1.00  0.00      A       
ATOM    357  C   ARG A  26      -7.212   3.783   7.338  1.00  0.00      A       
ATOM    358  CA  ARG A  26      -6.841   3.167   5.967  1.00  0.00      A       
ATOM    359  CB  ARG A  26      -7.437   1.745   5.775  1.00  0.00      A       
ATOM    360  CD  ARG A  26      -9.562   2.348   4.335  1.00  0.00      A       
ATOM    361  CG  ARG A  26      -8.969   1.646   5.576  1.00  0.00      A       
ATOM    362  CZ  ARG A  26      -8.370   2.447   2.113  1.00  0.00      A       
ATOM    363  HN  ARG A  26      -4.865   3.105   6.870  1.00  0.00      A       
ATOM    364  HA  ARG A  26      -7.191   3.822   5.144  1.00  0.00      A       
ATOM    365  HB2 ARG A  26      -6.955   1.263   4.905  1.00  0.00      A       
ATOM    366  HB1 ARG A  26      -7.160   1.108   6.635  1.00  0.00      A       
ATOM    367  HD2 ARG A  26     -10.661   2.235   4.363  1.00  0.00      A       
ATOM    368  HD1 ARG A  26      -9.399   3.438   4.409  1.00  0.00      A       
ATOM    369  HG2 ARG A  26      -9.251   0.576   5.550  1.00  0.00      A       
ATOM    370  HG1 ARG A  26      -9.472   2.042   6.478  1.00  0.00      A       
ATOM    371 HH11 ARG A  26      -8.274   4.207   3.083  1.00  0.00      A       
ATOM    372 HH12 ARG A  26      -7.454   4.109   1.444  1.00  0.00      A       
ATOM    373 HH21 ARG A  26      -8.322   0.818   0.951  1.00  0.00      A       
ATOM    374 HH22 ARG A  26      -7.481   2.323   0.323  1.00  0.00      A       
ATOM    375  N   ARG A  26      -5.359   3.124   5.966  1.00  0.00      A       
ATOM    376  NE  ARG A  26      -9.082   1.782   3.045  1.00  0.00      A       
ATOM    377  NH1 ARG A  26      -7.994   3.719   2.225  1.00  0.00      A       
ATOM    378  NH2 ARG A  26      -8.023   1.797   1.018  1.00  0.00      A       
ATOM    379  O   ARG A  26      -6.632   3.417   8.377  1.00  0.00      A       
ATOM    380  C   CYS A  27      -9.082   4.747   9.759  1.00  0.00      A       
ATOM    381  CA  CYS A  27      -8.355   5.529   8.611  1.00  0.00      A       
ATOM    382  CB  CYS A  27      -9.212   6.811   8.338  1.00  0.00      A       
ATOM    383  HN  CYS A  27      -8.570   5.007   6.467  1.00  0.00      A       
ATOM    384  HA  CYS A  27      -7.318   5.797   8.842  1.00  0.00      A       
ATOM    385  HB2 CYS A  27     -10.005   6.580   7.642  1.00  0.00      A       
ATOM    386  HB1 CYS A  27      -9.754   7.173   9.233  1.00  0.00      A       
ATOM    387  N   CYS A  27      -8.160   4.744   7.370  1.00  0.00      A       
ATOM    388  O   CYS A  27      -9.682   3.679   9.601  1.00  0.00      A       
ATOM    389  SG  CYS A  27      -8.362   8.282   7.745  1.00  0.00      A       
ATOM    390  C   SER A  28     -11.276   4.975  12.023  1.00  0.00      A       
ATOM    391  CA  SER A  28      -9.723   5.101  12.192  1.00  0.00      A       
ATOM    392  CB  SER A  28      -9.316   6.278  13.136  1.00  0.00      A       
ATOM    393  HN  SER A  28      -8.497   6.299  10.830  1.00  0.00      A       
ATOM    394  HA  SER A  28      -9.384   4.141  12.626  1.00  0.00      A       
ATOM    395  HB2 SER A  28      -9.447   7.264  12.649  1.00  0.00      A       
ATOM    396  HB1 SER A  28      -9.939   6.352  14.043  1.00  0.00      A       
ATOM    397  HG  SER A  28      -7.431   6.144  12.782  1.00  0.00      A       
ATOM    398  N   SER A  28      -8.986   5.403  10.935  1.00  0.00      A       
ATOM    399  O   SER A  28     -11.851   5.114  10.937  1.00  0.00      A       
ATOM    400  OG  SER A  28      -7.970   6.134  13.575  1.00  0.00      A       
ATOM    401  C   MET A  29     -14.310   5.645  12.856  1.00  0.00      A       
ATOM    402  CA  MET A  29     -13.409   4.422  13.227  1.00  0.00      A       
ATOM    403  CB  MET A  29     -13.724   3.990  14.688  1.00  0.00      A       
ATOM    404  CE  MET A  29     -11.533   0.493  15.424  1.00  0.00      A       
ATOM    405  CG  MET A  29     -13.391   2.527  15.037  1.00  0.00      A       
ATOM    406  HN  MET A  29     -11.360   4.767  13.990  1.00  0.00      A       
ATOM    407  HA  MET A  29     -13.670   3.603  12.528  1.00  0.00      A       
ATOM    408  HB2 MET A  29     -13.241   4.665  15.422  1.00  0.00      A       
ATOM    409  HB1 MET A  29     -14.803   4.133  14.876  1.00  0.00      A       
ATOM    410  HE1 MET A  29     -12.038  -0.084  14.628  1.00  0.00      A       
ATOM    411  HE2 MET A  29     -10.484   0.152  15.481  1.00  0.00      A       
ATOM    412  HE3 MET A  29     -12.023   0.258  16.387  1.00  0.00      A       
ATOM    413  HG2 MET A  29     -13.812   2.272  16.027  1.00  0.00      A       
ATOM    414  HG1 MET A  29     -13.857   1.835  14.311  1.00  0.00      A       
ATOM    415  N   MET A  29     -11.941   4.692  13.152  1.00  0.00      A       
ATOM    416  O   MET A  29     -15.389   5.445  12.290  1.00  0.00      A       
ATOM    417  SD  MET A  29     -11.604   2.262  15.081  1.00  0.00      A       
ATOM    418  C   ILE A  30     -14.541   8.486  11.306  1.00  0.00      A       
ATOM    419  CA  ILE A  30     -14.634   8.127  12.840  1.00  0.00      A       
ATOM    420  CB  ILE A  30     -14.084   9.256  13.813  1.00  0.00      A       
ATOM    421  CD1 ILE A  30     -16.382  10.448  14.216  1.00  0.00      A       
ATOM    422  CG1 ILE A  30     -14.936  10.559  13.705  1.00  0.00      A       
ATOM    423  CG2 ILE A  30     -12.610   9.664  13.513  1.00  0.00      A       
ATOM    424  HN  ILE A  30     -12.911   6.855  13.528  1.00  0.00      A       
ATOM    425  HA  ILE A  30     -15.704   7.951  13.035  1.00  0.00      A       
ATOM    426  HB  ILE A  30     -14.130   8.894  14.859  1.00  0.00      A       
ATOM    427 HD11 ILE A  30     -16.419  10.086  15.260  1.00  0.00      A       
ATOM    428 HD12 ILE A  30     -16.886  11.431  14.192  1.00  0.00      A       
ATOM    429 HD13 ILE A  30     -16.989   9.761  13.599  1.00  0.00      A       
ATOM    430 HG12 ILE A  30     -14.454  11.363  14.294  1.00  0.00      A       
ATOM    431 HG11 ILE A  30     -14.947  10.941  12.666  1.00  0.00      A       
ATOM    432 HG21 ILE A  30     -11.927   8.795  13.513  1.00  0.00      A       
ATOM    433 HG22 ILE A  30     -12.496  10.170  12.537  1.00  0.00      A       
ATOM    434 HG23 ILE A  30     -12.222  10.361  14.278  1.00  0.00      A       
ATOM    435  N   ILE A  30     -13.876   6.879  13.172  1.00  0.00      A       
ATOM    436  O   ILE A  30     -15.559   8.912  10.751  1.00  0.00      A       
ATOM    437  C   GLY A  31     -11.925   9.530   8.927  1.00  0.00      A       
ATOM    438  CA  GLY A  31     -13.194   8.699   9.217  1.00  0.00      A       
ATOM    439  HN  GLY A  31     -12.611   8.078  11.275  1.00  0.00      A       
ATOM    440  HA2 GLY A  31     -13.152   7.769   8.619  1.00  0.00      A       
ATOM    441  HA1 GLY A  31     -14.064   9.254   8.816  1.00  0.00      A       
ATOM    442  N   GLY A  31     -13.383   8.313  10.642  1.00  0.00      A       
ATOM    443  O   GLY A  31     -11.222   9.258   7.951  1.00  0.00      A       
ATOM    444  C   THR A  32      -9.434  10.792  10.858  1.00  0.00      A       
ATOM    445  CA  THR A  32     -10.394  11.337   9.745  1.00  0.00      A       
ATOM    446  CB  THR A  32     -10.703  12.857   9.983  1.00  0.00      A       
ATOM    447  CG2 THR A  32     -11.512  13.482   8.828  1.00  0.00      A       
ATOM    448  HN  THR A  32     -12.274  10.531  10.588  1.00  0.00      A       
ATOM    449  HA  THR A  32      -9.887  11.233   8.765  1.00  0.00      A       
ATOM    450  HB  THR A  32      -9.739  13.393  10.070  1.00  0.00      A       
ATOM    451  HG1 THR A  32     -11.596  13.981  11.270  1.00  0.00      A       
ATOM    452 HG21 THR A  32     -10.988  13.373   7.860  1.00  0.00      A       
ATOM    453 HG22 THR A  32     -12.512  13.024   8.718  1.00  0.00      A       
ATOM    454 HG23 THR A  32     -11.667  14.564   8.991  1.00  0.00      A       
ATOM    455  N   THR A  32     -11.665  10.549   9.761  1.00  0.00      A       
ATOM    456  O   THR A  32      -9.836  10.008  11.726  1.00  0.00      A       
ATOM    457  OG1 THR A  32     -11.463  13.034  11.179  1.00  0.00      A       
ATOM    458  C   ASN A  33      -6.718   9.315  11.450  1.00  0.00      A       
ATOM    459  CA  ASN A  33      -7.049  10.801  11.755  1.00  0.00      A       
ATOM    460  CB  ASN A  33      -7.443  11.002  13.265  1.00  0.00      A       
ATOM    461  CG  ASN A  33      -7.344  12.459  13.754  1.00  0.00      A       
ATOM    462  HN  ASN A  33      -7.888  11.731   9.966  1.00  0.00      A       
ATOM    463  HA  ASN A  33      -6.148  11.407  11.537  1.00  0.00      A       
ATOM    464  HB2 ASN A  33      -8.436  10.587  13.509  1.00  0.00      A       
ATOM    465  HB1 ASN A  33      -6.791  10.378  13.906  1.00  0.00      A       
ATOM    466 HD21 ASN A  33      -9.323  12.702  13.532  1.00  0.00      A       
ATOM    467 HD22 ASN A  33      -8.364  14.142  14.144  1.00  0.00      A       
ATOM    468  N   ASN A  33      -8.146  11.221  10.818  1.00  0.00      A       
ATOM    469  ND2 ASN A  33      -8.458  13.174  13.816  1.00  0.00      A       
ATOM    470  O   ASN A  33      -7.044   8.417  12.233  1.00  0.00      A       
ATOM    471  OD1 ASN A  33      -6.263  12.951  14.079  1.00  0.00      A       
ATOM    472  C   CYS A  34      -4.898   6.825  10.646  1.00  0.00      A       
ATOM    473  CA  CYS A  34      -5.909   7.667   9.802  1.00  0.00      A       
ATOM    474  CB  CYS A  34      -5.360   7.629   8.337  1.00  0.00      A       
ATOM    475  HN  CYS A  34      -6.024   9.895   9.686  1.00  0.00      A       
ATOM    476  HA  CYS A  34      -6.913   7.259   9.849  1.00  0.00      A       
ATOM    477  HB2 CYS A  34      -4.550   8.336   8.271  1.00  0.00      A       
ATOM    478  HB1 CYS A  34      -4.944   6.635   8.087  1.00  0.00      A       
ATOM    479  N   CYS A  34      -6.067   9.063  10.291  1.00  0.00      A       
ATOM    480  O   CYS A  34      -4.106   7.363  11.427  1.00  0.00      A       
ATOM    481  SG  CYS A  34      -6.571   7.882   7.039  1.00  0.00      A       
ATOM    482  C   GLU A  35      -3.252   3.776   9.770  1.00  0.00      A       
ATOM    483  CA  GLU A  35      -3.866   4.579  10.966  1.00  0.00      A       
ATOM    484  CB  GLU A  35      -4.368   3.542  12.016  1.00  0.00      A       
ATOM    485  CD  GLU A  35      -5.678   2.911  14.119  1.00  0.00      A       
ATOM    486  CG  GLU A  35      -5.242   4.036  13.179  1.00  0.00      A       
ATOM    487  HN  GLU A  35      -5.620   5.213   9.707  1.00  0.00      A       
ATOM    488  HA  GLU A  35      -3.078   5.201  11.431  1.00  0.00      A       
ATOM    489  HB2 GLU A  35      -4.771   2.665  11.493  1.00  0.00      A       
ATOM    490  HB1 GLU A  35      -3.472   3.100  12.490  1.00  0.00      A       
ATOM    491  HE2 GLU A  35      -4.967   1.855  15.592  1.00  0.00      A       
ATOM    492  HG2 GLU A  35      -4.685   4.799  13.756  1.00  0.00      A       
ATOM    493  HG1 GLU A  35      -6.139   4.535  12.781  1.00  0.00      A       
ATOM    494  N   GLU A  35      -4.936   5.485  10.437  1.00  0.00      A       
ATOM    495  O   GLU A  35      -3.737   3.778   8.633  1.00  0.00      A       
ATOM    496  OE1 GLU A  35      -6.792   2.390  14.079  1.00  0.00      A       
ATOM    497  OE2 GLU A  35      -4.689   2.559  15.003  1.00  0.00      A       
ATOM    498  C   CYS A  36      -1.926   0.841   9.056  1.00  0.00      A       
ATOM    499  CA  CYS A  36      -1.361   2.285   9.089  1.00  0.00      A       
ATOM    500  CB  CYS A  36       0.167   2.334   9.449  1.00  0.00      A       
ATOM    501  HN  CYS A  36      -2.031   3.073  11.100  1.00  0.00      A       
ATOM    502  HA  CYS A  36      -1.472   2.730   8.075  1.00  0.00      A       
ATOM    503  HB2 CYS A  36       0.376   2.420  10.532  1.00  0.00      A       
ATOM    504  HB1 CYS A  36       0.712   1.403   9.232  1.00  0.00      A       
ATOM    505  N   CYS A  36      -2.146   3.078  10.080  1.00  0.00      A       
ATOM    506  O   CYS A  36      -2.645   0.371   9.947  1.00  0.00      A       
ATOM    507  SG  CYS A  36       0.895   3.618   8.436  1.00  0.00      A       
ATOM    508  C   THR A  37      -1.012  -1.964   6.894  1.00  0.00      A       
ATOM    509  CA  THR A  37      -2.170  -1.170   7.596  1.00  0.00      A       
ATOM    510  CB  THR A  37      -3.416  -1.108   6.648  1.00  0.00      A       
ATOM    511  CG2 THR A  37      -4.661  -0.541   7.357  1.00  0.00      A       
ATOM    512  HN  THR A  37      -1.060   0.705   7.261  1.00  0.00      A       
ATOM    513  HA  THR A  37      -2.466  -1.681   8.530  1.00  0.00      A       
ATOM    514  HB  THR A  37      -3.636  -2.138   6.308  1.00  0.00      A       
ATOM    515  HG1 THR A  37      -3.957  -0.304   4.983  1.00  0.00      A       
ATOM    516 HG21 THR A  37      -4.910  -1.115   8.268  1.00  0.00      A       
ATOM    517 HG22 THR A  37      -4.530   0.517   7.654  1.00  0.00      A       
ATOM    518 HG23 THR A  37      -5.545  -0.582   6.697  1.00  0.00      A       
ATOM    519  N   THR A  37      -1.646   0.183   7.922  1.00  0.00      A       
ATOM    520  O   THR A  37      -0.328  -1.389   6.035  1.00  0.00      A       
ATOM    521  OG1 THR A  37      -3.163  -0.272   5.521  1.00  0.00      A       
ATOM    522  C   PRO A  38       0.214  -4.285   5.026  1.00  0.00      A       
ATOM    523  CA  PRO A  38       0.351  -4.054   6.568  1.00  0.00      A       
ATOM    524  CB  PRO A  38       0.342  -5.358   7.400  1.00  0.00      A       
ATOM    525  CD  PRO A  38      -1.520  -4.054   8.189  1.00  0.00      A       
ATOM    526  CG  PRO A  38      -1.072  -5.496   7.967  1.00  0.00      A       
ATOM    527  HA  PRO A  38       1.308  -3.529   6.706  1.00  0.00      A       
ATOM    528  HB2 PRO A  38       0.648  -6.255   6.833  1.00  0.00      A       
ATOM    529  HB1 PRO A  38       1.064  -5.267   8.235  1.00  0.00      A       
ATOM    530  HD2 PRO A  38      -2.609  -3.934   8.073  1.00  0.00      A       
ATOM    531  HD1 PRO A  38      -1.274  -3.720   9.212  1.00  0.00      A       
ATOM    532  HG2 PRO A  38      -1.732  -5.995   7.232  1.00  0.00      A       
ATOM    533  HG1 PRO A  38      -1.101  -6.096   8.895  1.00  0.00      A       
ATOM    534  N   PRO A  38      -0.764  -3.277   7.185  1.00  0.00      A       
ATOM    535  O   PRO A  38       1.145  -3.962   4.284  1.00  0.00      A       
ATOM    536  C   ARG A  39      -2.726  -5.040   2.879  1.00  0.00      A       
ATOM    537  CA  ARG A  39      -1.188  -5.013   3.098  1.00  0.00      A       
ATOM    538  CB  ARG A  39      -0.532  -6.332   2.585  1.00  0.00      A       
ATOM    539  CD  ARG A  39       0.006  -8.858   2.805  1.00  0.00      A       
ATOM    540  CG  ARG A  39      -0.879  -7.683   3.266  1.00  0.00      A       
ATOM    541  CZ  ARG A  39       2.448  -9.444   2.863  1.00  0.00      A       
ATOM    542  HN  ARG A  39      -1.613  -5.018   5.281  1.00  0.00      A       
ATOM    543  HA  ARG A  39      -0.751  -4.165   2.529  1.00  0.00      A       
ATOM    544  HB2 ARG A  39      -0.730  -6.426   1.500  1.00  0.00      A       
ATOM    545  HB1 ARG A  39       0.561  -6.187   2.640  1.00  0.00      A       
ATOM    546  HD2 ARG A  39      -0.439  -9.807   3.159  1.00  0.00      A       
ATOM    547  HD1 ARG A  39       0.001  -8.916   1.699  1.00  0.00      A       
ATOM    548  HG2 ARG A  39      -0.827  -7.589   4.367  1.00  0.00      A       
ATOM    549  HG1 ARG A  39      -1.934  -7.931   3.048  1.00  0.00      A       
ATOM    550 HH11 ARG A  39       1.459 -10.454   1.432  1.00  0.00      A       
ATOM    551 HH12 ARG A  39       3.259 -10.775   1.590  1.00  0.00      A       
ATOM    552 HH21 ARG A  39       3.649  -8.564   4.203  1.00  0.00      A       
ATOM    553 HH22 ARG A  39       4.413  -9.775   3.055  1.00  0.00      A       
ATOM    554  N   ARG A  39      -0.924  -4.820   4.550  1.00  0.00      A       
ATOM    555  NE  ARG A  39       1.391  -8.755   3.333  1.00  0.00      A       
ATOM    556  NH1 ARG A  39       2.382 -10.315   1.858  1.00  0.00      A       
ATOM    557  NH2 ARG A  39       3.623  -9.240   3.432  1.00  0.00      A       
ATOM    558  O   ARG A  39      -3.461  -5.788   3.535  1.00  0.00      A       
ATOM    559  C   LEU A  40      -4.765  -4.702   0.106  1.00  0.00      A       
ATOM    560  CA  LEU A  40      -4.619  -4.126   1.540  1.00  0.00      A       
ATOM    561  CB  LEU A  40      -5.104  -2.646   1.579  1.00  0.00      A       
ATOM    562  CD1 LEU A  40      -5.452  -0.435   2.795  1.00  0.00      A       
ATOM    563  CD2 LEU A  40      -6.072  -2.576   3.978  1.00  0.00      A       
ATOM    564  CG  LEU A  40      -5.111  -1.929   2.960  1.00  0.00      A       
ATOM    565  HN  LEU A  40      -2.466  -3.651   1.458  1.00  0.00      A       
ATOM    566  HA  LEU A  40      -5.255  -4.704   2.241  1.00  0.00      A       
ATOM    567  HB2 LEU A  40      -4.484  -2.054   0.878  1.00  0.00      A       
ATOM    568  HB1 LEU A  40      -6.126  -2.594   1.155  1.00  0.00      A       
ATOM    569 HD11 LEU A  40      -4.802   0.056   2.048  1.00  0.00      A       
ATOM    570 HD12 LEU A  40      -6.497  -0.281   2.467  1.00  0.00      A       
ATOM    571 HD13 LEU A  40      -5.317   0.118   3.742  1.00  0.00      A       
ATOM    572 HD21 LEU A  40      -7.115  -2.597   3.610  1.00  0.00      A       
ATOM    573 HD22 LEU A  40      -5.784  -3.617   4.210  1.00  0.00      A       
ATOM    574 HD23 LEU A  40      -6.077  -2.033   4.940  1.00  0.00      A       
ATOM    575  HG  LEU A  40      -4.090  -1.980   3.382  1.00  0.00      A       
ATOM    576  N   LEU A  40      -3.187  -4.212   1.927  1.00  0.00      A       
ATOM    577  O   LEU A  40      -4.138  -4.218  -0.844  1.00  0.00      A       
ATOM    578  C   ILE A  41      -6.787  -5.486  -2.236  1.00  0.00      A       
ATOM    579  CA  ILE A  41      -5.864  -6.405  -1.354  1.00  0.00      A       
ATOM    580  CB  ILE A  41      -6.464  -7.840  -1.062  1.00  0.00      A       
ATOM    581  CD1 ILE A  41      -6.711 -10.174  -2.222  1.00  0.00      A       
ATOM    582  CG1 ILE A  41      -6.491  -8.661  -2.389  1.00  0.00      A       
ATOM    583  CG2 ILE A  41      -7.906  -7.786  -0.471  1.00  0.00      A       
ATOM    584  HN  ILE A  41      -6.082  -6.040   0.820  1.00  0.00      A       
ATOM    585  HA  ILE A  41      -4.894  -6.522  -1.879  1.00  0.00      A       
ATOM    586  HB  ILE A  41      -5.803  -8.360  -0.341  1.00  0.00      A       
ATOM    587 HD11 ILE A  41      -5.949 -10.627  -1.562  1.00  0.00      A       
ATOM    588 HD12 ILE A  41      -7.704 -10.405  -1.796  1.00  0.00      A       
ATOM    589 HD13 ILE A  41      -6.649 -10.692  -3.197  1.00  0.00      A       
ATOM    590 HG12 ILE A  41      -7.249  -8.258  -3.087  1.00  0.00      A       
ATOM    591 HG11 ILE A  41      -5.525  -8.537  -2.916  1.00  0.00      A       
ATOM    592 HG21 ILE A  41      -7.957  -7.157   0.437  1.00  0.00      A       
ATOM    593 HG22 ILE A  41      -8.649  -7.387  -1.186  1.00  0.00      A       
ATOM    594 HG23 ILE A  41      -8.259  -8.788  -0.168  1.00  0.00      A       
ATOM    595  N   ILE A  41      -5.619  -5.734  -0.043  1.00  0.00      A       
ATOM    596  O   ILE A  41      -7.790  -4.942  -1.761  1.00  0.00      A       
ATOM    597  C   MET A  42      -6.740  -2.884  -3.996  1.00  0.00      A       
ATOM    598  CA  MET A  42      -6.976  -4.347  -4.505  1.00  0.00      A       
ATOM    599  CB  MET A  42      -8.493  -4.655  -4.724  1.00  0.00      A       
ATOM    600  CE  MET A  42      -8.910  -5.899  -7.918  1.00  0.00      A       
ATOM    601  CG  MET A  42      -9.139  -3.933  -5.921  1.00  0.00      A       
ATOM    602  HN  MET A  42      -5.527  -5.823  -3.748  1.00  0.00      A       
ATOM    603  HA  MET A  42      -6.439  -4.480  -5.465  1.00  0.00      A       
ATOM    604  HB2 MET A  42      -8.627  -5.742  -4.880  1.00  0.00      A       
ATOM    605  HB1 MET A  42      -9.086  -4.422  -3.821  1.00  0.00      A       
ATOM    606  HE1 MET A  42     -10.010  -5.869  -8.021  1.00  0.00      A       
ATOM    607  HE2 MET A  42      -8.485  -6.230  -8.883  1.00  0.00      A       
ATOM    608  HE3 MET A  42      -8.654  -6.657  -7.155  1.00  0.00      A       
ATOM    609  HG2 MET A  42     -10.200  -4.224  -6.023  1.00  0.00      A       
ATOM    610  HG1 MET A  42      -9.142  -2.842  -5.750  1.00  0.00      A       
ATOM    611  N   MET A  42      -6.379  -5.300  -3.514  1.00  0.00      A       
ATOM    612  O   MET A  42      -7.474  -2.378  -3.142  1.00  0.00      A       
ATOM    613  SD  MET A  42      -8.259  -4.278  -7.465  1.00  0.00      A       
ATOM    614  C   GLU A  43      -4.453  -1.079  -2.679  1.00  0.00      A       
ATOM    615  CA  GLU A  43      -5.095  -0.930  -4.099  1.00  0.00      A       
ATOM    616  CB  GLU A  43      -6.145   0.226  -4.025  1.00  0.00      A       
ATOM    617  CD  GLU A  43      -7.877  -0.146  -5.928  1.00  0.00      A       
ATOM    618  CG  GLU A  43      -6.748   0.719  -5.360  1.00  0.00      A       
ATOM    619  HN  GLU A  43      -5.169  -2.821  -5.221  1.00  0.00      A       
ATOM    620  HA  GLU A  43      -4.317  -0.656  -4.839  1.00  0.00      A       
ATOM    621  HB2 GLU A  43      -6.936   0.014  -3.287  1.00  0.00      A       
ATOM    622  HB1 GLU A  43      -5.631   1.108  -3.597  1.00  0.00      A       
ATOM    623  HE2 GLU A  43      -8.175  -1.451  -7.342  1.00  0.00      A       
ATOM    624  HG2 GLU A  43      -7.159   1.734  -5.206  1.00  0.00      A       
ATOM    625  HG1 GLU A  43      -5.947   0.853  -6.112  1.00  0.00      A       
ATOM    626  N   GLU A  43      -5.663  -2.254  -4.523  1.00  0.00      A       
ATOM    627  O   GLU A  43      -5.066  -1.567  -1.723  1.00  0.00      A       
ATOM    628  OE1 GLU A  43      -9.020  -0.150  -5.473  1.00  0.00      A       
ATOM    629  OE2 GLU A  43      -7.464  -0.910  -6.990  1.00  0.00      A       
ATOM    630  C   GLY A  44      -1.225  -1.626  -1.466  1.00  0.00      A       
ATOM    631  CA  GLY A  44      -2.404  -0.647  -1.339  1.00  0.00      A       
ATOM    632  HN  GLY A  44      -2.882  -0.133  -3.433  1.00  0.00      A       
ATOM    633  HA2 GLY A  44      -1.998   0.366  -1.168  1.00  0.00      A       
ATOM    634  HA1 GLY A  44      -3.024  -0.853  -0.445  1.00  0.00      A       
ATOM    635  N   GLY A  44      -3.202  -0.608  -2.584  1.00  0.00      A       
ATOM    636  O   GLY A  44      -0.276  -1.340  -2.200  1.00  0.00      A       
ATOM    637  C   LEU A  45       1.061  -3.510  -0.187  1.00  0.00      A       
ATOM    638  CA  LEU A  45      -0.334  -3.914  -0.779  1.00  0.00      A       
ATOM    639  CB  LEU A  45      -0.132  -4.445  -2.242  1.00  0.00      A       
ATOM    640  CD1 LEU A  45      -1.103  -5.288  -4.443  1.00  0.00      A       
ATOM    641  CD2 LEU A  45      -1.856  -6.367  -2.288  1.00  0.00      A       
ATOM    642  CG  LEU A  45      -1.380  -5.054  -2.945  1.00  0.00      A       
ATOM    643  HN  LEU A  45      -2.161  -2.832  -0.182  1.00  0.00      A       
ATOM    644  HA  LEU A  45      -0.753  -4.717  -0.142  1.00  0.00      A       
ATOM    645  HB2 LEU A  45       0.295  -3.644  -2.875  1.00  0.00      A       
ATOM    646  HB1 LEU A  45       0.660  -5.220  -2.235  1.00  0.00      A       
ATOM    647 HD11 LEU A  45      -0.817  -4.350  -4.955  1.00  0.00      A       
ATOM    648 HD12 LEU A  45      -0.285  -6.014  -4.608  1.00  0.00      A       
ATOM    649 HD13 LEU A  45      -1.997  -5.674  -4.969  1.00  0.00      A       
ATOM    650 HD21 LEU A  45      -1.067  -7.142  -2.286  1.00  0.00      A       
ATOM    651 HD22 LEU A  45      -2.167  -6.212  -1.239  1.00  0.00      A       
ATOM    652 HD23 LEU A  45      -2.731  -6.793  -2.815  1.00  0.00      A       
ATOM    653  HG  LEU A  45      -2.210  -4.325  -2.887  1.00  0.00      A       
ATOM    654  N   LEU A  45      -1.306  -2.767  -0.745  1.00  0.00      A       
ATOM    655  O   LEU A  45       1.506  -2.358  -0.249  1.00  0.00      A       
ATOM    656  C   SER A  46       4.199  -4.034  -0.048  1.00  0.00      A       
ATOM    657  CA  SER A  46       3.095  -4.330   1.013  1.00  0.00      A       
ATOM    658  CB  SER A  46       3.463  -5.614   1.797  1.00  0.00      A       
ATOM    659  HN  SER A  46       1.296  -5.429   0.356  1.00  0.00      A       
ATOM    660  HA  SER A  46       3.035  -3.484   1.726  1.00  0.00      A       
ATOM    661  HB2 SER A  46       4.455  -5.499   2.270  1.00  0.00      A       
ATOM    662  HB1 SER A  46       2.764  -5.764   2.639  1.00  0.00      A       
ATOM    663  HG  SER A  46       2.587  -6.871   0.629  1.00  0.00      A       
ATOM    664  N   SER A  46       1.765  -4.517   0.371  1.00  0.00      A       
ATOM    665  O   SER A  46       4.361  -4.772  -1.026  1.00  0.00      A       
ATOM    666  OG  SER A  46       3.474  -6.787   0.986  1.00  0.00      A       
ATOM    667  C   PHE A  47       5.319  -1.984  -2.124  1.00  0.00      A       
ATOM    668  CA  PHE A  47       5.966  -2.342  -0.744  1.00  0.00      A       
ATOM    669  CB  PHE A  47       7.156  -3.348  -0.893  1.00  0.00      A       
ATOM    670  CD1 PHE A  47       9.312  -2.014  -0.632  1.00  0.00      A       
ATOM    671  CD2 PHE A  47       8.733  -2.823  -2.833  1.00  0.00      A       
ATOM    672  CE1 PHE A  47      10.462  -1.424  -1.151  1.00  0.00      A       
ATOM    673  CE2 PHE A  47       9.884  -2.232  -3.350  1.00  0.00      A       
ATOM    674  CG  PHE A  47       8.437  -2.716  -1.469  1.00  0.00      A       
ATOM    675  CZ  PHE A  47      10.746  -1.533  -2.509  1.00  0.00      A       
ATOM    676  HN  PHE A  47       4.669  -2.424   1.033  1.00  0.00      A       
ATOM    677  HA  PHE A  47       6.338  -1.404  -0.290  1.00  0.00      A       
ATOM    678  HB2 PHE A  47       7.406  -3.776   0.098  1.00  0.00      A       
ATOM    679  HB1 PHE A  47       6.859  -4.230  -1.493  1.00  0.00      A       
ATOM    680  HD1 PHE A  47       9.104  -1.919   0.423  1.00  0.00      A       
ATOM    681  HD2 PHE A  47       8.070  -3.357  -3.498  1.00  0.00      A       
ATOM    682  HE1 PHE A  47      11.132  -0.883  -0.499  1.00  0.00      A       
ATOM    683  HE2 PHE A  47      10.105  -2.313  -4.404  1.00  0.00      A       
ATOM    684  HZ  PHE A  47      11.637  -1.074  -2.912  1.00  0.00      A       
ATOM    685  N   PHE A  47       4.930  -2.917   0.172  1.00  0.00      A       
ATOM    686  O   PHE A  47       5.227  -2.815  -3.035  1.00  0.00      A       
ATOM    687  C   ALA A  48       4.401   1.311  -3.532  1.00  0.00      A       
ATOM    688  CA  ALA A  48       4.173  -0.212  -3.447  1.00  0.00      A       
ATOM    689  CB  ALA A  48       2.666  -0.543  -3.379  1.00  0.00      A       
ATOM    690  HN  ALA A  48       4.992  -0.142  -1.404  1.00  0.00      A       
ATOM    691  H'' ALA A  48       4.012   2.952  -2.549  1.00  0.00      A       
ATOM    692  HA  ALA A  48       4.598  -0.680  -4.356  1.00  0.00      A       
ATOM    693  HB1 ALA A  48       2.177  -0.112  -2.484  1.00  0.00      A       
ATOM    694  HB2 ALA A  48       2.125  -0.159  -4.264  1.00  0.00      A       
ATOM    695  HB3 ALA A  48       2.489  -1.635  -3.350  1.00  0.00      A       
ATOM    696  N   ALA A  48       4.856  -0.726  -2.237  1.00  0.00      A       
ATOM    697  OT1 ALA A  48       5.009   1.840  -4.462  1.00  0.00      A       
ATOM    698  OT2 ALA A  48       3.861   2.007  -2.473  1.00  0.00      A       
END


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