REMARK ID 142574 DOMAINID 138915 MODEL 1 2021-10-23_00000171_1_11
MODEL     1
REMARK    Rerank model01.pdb score: 21.141
REMARK    CLUSTER 0001 t000_.out.valid.rescored.best_scoring.binary cluster_size: 23 cluster_threshold: 7.022263
REMARK    SCORE     hbond_bb_sc:         -15.958
REMARK    SCORE         fa_elec:         -83.988
REMARK    SCORE     hbond_sr_bb:         -20.874
REMARK    SCORE            time:           0.000
REMARK    SCORE           omega:          -0.812
REMARK    SCORE     lk_ball_wtd:         -10.291
REMARK    SCORE           score:        -104.553
REMARK    SCORE     rama_prepro:         -17.564
REMARK    SCORE        hbond_sc:         -11.028
REMARK    SCORE fa_intra_sol_xover4:          16.462
REMARK    SCORE     cart_bonded:          36.091
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE    fa_intra_rep:           0.520
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE          fa_sol:         209.610
REMARK    SCORE         p_aa_pp:         -17.958
REMARK    SCORE     total_score:        -104.553
REMARK    SCORE             ref:          13.118
REMARK    SCORE          fa_dun:          80.808
REMARK    SCORE          fa_rep:          34.563
REMARK    SCORE          fa_atr:        -313.981
REMARK    SCORE     hbond_lr_bb:          -3.271
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     description: cluster0001_0001
REMARK    SCORE       dslf_fa13:           0.000
ATOM      1  N   ASP A   1       0.561   0.167  -0.126  1.00 10.280          N  
ATOM      2  CA  ASP A   1       2.017   0.188  -0.015  1.00  9.840          C  
ATOM      3  C   ASP A   1       2.518   1.628   0.040  1.00  8.830          C  
ATOM      4  O   ASP A   1       2.492   2.358  -0.951  1.00  8.740          O  
ATOM      5  CB  ASP A   1       2.655  -0.590  -1.172  1.00 13.950          C  
ATOM      6  CG  ASP A   1       4.180  -0.704  -1.074  1.00 13.950          C  
ATOM      7  OD1 ASP A   1       4.804   0.106  -0.383  1.00 13.950          O  
ATOM      8  OD2 ASP A   1       4.711  -1.607  -1.667  1.00 13.950          O  
ATOM      9 1H   ASP A   1       0.201  -0.650   0.346  1.00 12.340          H  
ATOM     10 2H   ASP A   1       0.177   0.999   0.301  1.00 12.340          H  
ATOM     11 3H   ASP A   1       0.297   0.136  -1.100  1.00 12.340          H  
ATOM     12  HA  ASP A   1       2.298  -0.303   0.917  1.00 11.810          H  
ATOM     13 1HB  ASP A   1       2.233  -1.598  -1.209  1.00 16.740          H  
ATOM     14 2HB  ASP A   1       2.410  -0.099  -2.117  1.00 16.740          H  
ATOM     15  N   VAL A   2       2.964   2.038   1.216  1.00  8.300          N  
ATOM     16  CA  VAL A   2       3.417   3.412   1.456  1.00  7.490          C  
ATOM     17  C   VAL A   2       4.668   3.857   0.685  1.00  6.760          C  
ATOM     18  O   VAL A   2       5.027   5.048   0.698  1.00  6.720          O  
ATOM     19  CB  VAL A   2       3.623   3.646   2.962  1.00 10.810          C  
ATOM     20  CG1 VAL A   2       2.297   3.475   3.707  1.00 10.810          C  
ATOM     21  CG2 VAL A   2       4.666   2.680   3.507  1.00 10.810          C  
ATOM     22  H   VAL A   2       2.984   1.369   1.971  1.00  9.960          H  
ATOM     23  HA  VAL A   2       2.601   4.060   1.143  1.00  8.990          H  
ATOM     24  HB  VAL A   2       3.959   4.651   3.109  1.00 12.970          H  
ATOM     25 1HG1 VAL A   2       2.443   3.663   4.770  1.00 12.970          H  
ATOM     26 2HG1 VAL A   2       1.570   4.185   3.316  1.00 12.970          H  
ATOM     27 3HG1 VAL A   2       1.921   2.469   3.573  1.00 12.970          H  
ATOM     28 1HG2 VAL A   2       4.804   2.863   4.567  1.00 12.970          H  
ATOM     29 2HG2 VAL A   2       4.342   1.656   3.369  1.00 12.970          H  
ATOM     30 3HG2 VAL A   2       5.614   2.829   2.990  1.00 12.970          H  
ATOM     31  N   SER A   3       5.398   2.909   0.087  1.00  6.510          N  
ATOM     32  CA  SER A   3       6.579   3.272  -0.686  1.00  6.110          C  
ATOM     33  C   SER A   3       6.211   3.712  -2.110  1.00  5.520          C  
ATOM     34  O   SER A   3       7.055   4.229  -2.849  1.00  5.620          O  
ATOM     35  CB  SER A   3       7.568   2.120  -0.745  1.00  8.710          C  
ATOM     36  OG  SER A   3       7.092   1.067  -1.538  1.00  8.710          O  
ATOM     37  H   SER A   3       5.094   1.923   0.106  1.00  7.810          H  
ATOM     38  HA  SER A   3       7.066   4.111  -0.191  1.00  7.330          H  
ATOM     39 1HB  SER A   3       8.511   2.481  -1.149  1.00 10.460          H  
ATOM     40 2HB  SER A   3       7.760   1.757   0.263  1.00 10.460          H  
ATOM     41  HG  SER A   3       6.385   0.617  -1.023  1.00 10.460          H  
ATOM     42  N   GLU A   4       4.955   3.475  -2.509  1.00  5.320          N  
ATOM     43  CA  GLU A   4       4.475   3.806  -3.844  1.00  5.240          C  
ATOM     44  C   GLU A   4       4.534   5.292  -4.137  1.00  4.600          C  
ATOM     45  O   GLU A   4       3.996   6.098  -3.364  1.00  4.650          O  
ATOM     46  CB  GLU A   4       3.053   3.260  -4.039  1.00  7.370          C  
ATOM     47  CG  GLU A   4       2.365   3.662  -5.342  1.00  7.370          C  
ATOM     48  CD  GLU A   4       3.099   3.286  -6.576  1.00  7.370          C  
ATOM     49  OE1 GLU A   4       3.448   2.145  -6.743  1.00  7.370          O  
ATOM     50  OE2 GLU A   4       3.341   4.192  -7.358  1.00  7.370          O  
ATOM     51  H   GLU A   4       4.288   3.067  -1.849  1.00  6.380          H  
ATOM     52  HA  GLU A   4       5.119   3.300  -4.565  1.00  6.290          H  
ATOM     53 1HB  GLU A   4       3.072   2.171  -3.980  1.00  8.840          H  
ATOM     54 2HB  GLU A   4       2.427   3.614  -3.221  1.00  8.840          H  
ATOM     55 1HG  GLU A   4       1.389   3.178  -5.366  1.00  8.840          H  
ATOM     56 2HG  GLU A   4       2.194   4.713  -5.333  1.00  8.840          H  
ATOM     57  N   GLU A   5       5.177   5.656  -5.253  1.00  4.460          N  
ATOM     58  CA  GLU A   5       5.296   7.052  -5.628  1.00  4.450          C  
ATOM     59  C   GLU A   5       3.948   7.717  -5.816  1.00  4.080          C  
ATOM     60  O   GLU A   5       3.788   8.866  -5.415  1.00  4.170          O  
ATOM     61  CB  GLU A   5       6.119   7.249  -6.900  1.00  6.230          C  
ATOM     62  CG  GLU A   5       6.270   8.736  -7.269  1.00  6.230          C  
ATOM     63  CD  GLU A   5       7.121   9.012  -8.460  1.00  6.230          C  
ATOM     64  OE1 GLU A   5       7.771   8.117  -8.934  1.00  6.230          O  
ATOM     65  OE2 GLU A   5       7.079  10.142  -8.936  1.00  6.230          O  
ATOM     66  H   GLU A   5       5.593   4.940  -5.838  1.00  5.350          H  
ATOM     67  HA  GLU A   5       5.815   7.568  -4.821  1.00  5.340          H  
ATOM     68 1HB  GLU A   5       7.112   6.818  -6.768  1.00  7.480          H  
ATOM     69 2HB  GLU A   5       5.637   6.733  -7.733  1.00  7.480          H  
ATOM     70 1HG  GLU A   5       5.287   9.130  -7.477  1.00  7.480          H  
ATOM     71 2HG  GLU A   5       6.664   9.274  -6.407  1.00  7.480          H  
ATOM     72  N   GLU A   6       2.978   7.032  -6.427  1.00  4.180          N  
ATOM     73  CA  GLU A   6       1.701   7.696  -6.656  1.00  4.430          C  
ATOM     74  C   GLU A   6       1.029   8.044  -5.331  1.00  4.260          C  
ATOM     75  O   GLU A   6       0.429   9.107  -5.191  1.00  4.770          O  
ATOM     76  CB  GLU A   6       0.765   6.832  -7.502  1.00  6.100          C  
ATOM     77  CG  GLU A   6      -0.560   7.522  -7.940  1.00  6.100          C  
ATOM     78  CD  GLU A   6      -0.350   8.688  -8.919  1.00  6.100          C  
ATOM     79  OE1 GLU A   6       0.721   8.771  -9.485  1.00  6.100          O  
ATOM     80  OE2 GLU A   6      -1.262   9.455  -9.128  1.00  6.100          O  
ATOM     81  H   GLU A   6       3.137   6.064  -6.750  1.00  5.020          H  
ATOM     82  HA  GLU A   6       1.890   8.616  -7.195  1.00  5.320          H  
ATOM     83 1HB  GLU A   6       1.291   6.507  -8.398  1.00  7.320          H  
ATOM     84 2HB  GLU A   6       0.504   5.934  -6.940  1.00  7.320          H  
ATOM     85 1HG  GLU A   6      -1.192   6.775  -8.420  1.00  7.320          H  
ATOM     86 2HG  GLU A   6      -1.089   7.884  -7.059  1.00  7.320          H  
ATOM     87  N   ASP A   7       1.134   7.158  -4.345  1.00  3.950          N  
ATOM     88  CA  ASP A   7       0.487   7.399  -3.070  1.00  4.250          C  
ATOM     89  C   ASP A   7       1.212   8.590  -2.401  1.00  3.930          C  
ATOM     90  O   ASP A   7       0.568   9.524  -1.916  1.00  4.080          O  
ATOM     91  CB  ASP A   7       0.493   6.084  -2.256  1.00  5.830          C  
ATOM     92  CG  ASP A   7      -0.456   6.052  -1.046  1.00  5.830          C  
ATOM     93  OD1 ASP A   7      -1.646   6.174  -1.222  1.00  5.830          O  
ATOM     94  OD2 ASP A   7       0.018   5.839   0.046  1.00  5.830          O  
ATOM     95  H   ASP A   7       1.647   6.299  -4.497  1.00  4.740          H  
ATOM     96  HA  ASP A   7      -0.551   7.681  -3.250  1.00  5.100          H  
ATOM     97 1HB  ASP A   7       0.229   5.258  -2.919  1.00  7.000          H  
ATOM     98 2HB  ASP A   7       1.511   5.891  -1.908  1.00  7.000          H  
ATOM     99  N   PHE A   8       2.547   8.626  -2.500  1.00  3.920          N  
ATOM    100  CA  PHE A   8       3.333   9.747  -1.978  1.00  4.130          C  
ATOM    101  C   PHE A   8       2.834  11.060  -2.607  1.00  4.120          C  
ATOM    102  O   PHE A   8       2.559  12.047  -1.916  1.00  4.450          O  
ATOM    103  CB  PHE A   8       4.815   9.551  -2.288  1.00  5.700          C  
ATOM    104  CG  PHE A   8       5.723  10.634  -1.800  1.00  5.700          C  
ATOM    105  CD1 PHE A   8       6.214  10.610  -0.506  1.00  5.700          C  
ATOM    106  CD2 PHE A   8       6.094  11.687  -2.632  1.00  5.700          C  
ATOM    107  CE1 PHE A   8       7.055  11.595  -0.066  1.00  5.700          C  
ATOM    108  CE2 PHE A   8       6.938  12.677  -2.174  1.00  5.700          C  
ATOM    109  CZ  PHE A   8       7.417  12.624  -0.894  1.00  5.700          C  
ATOM    110  H   PHE A   8       3.040   7.823  -2.905  1.00  4.700          H  
ATOM    111  HA  PHE A   8       3.201   9.803  -0.900  1.00  4.960          H  
ATOM    112 1HB  PHE A   8       5.147   8.601  -1.864  1.00  6.840          H  
ATOM    113 2HB  PHE A   8       4.944   9.479  -3.356  1.00  6.840          H  
ATOM    114  HD1 PHE A   8       5.932   9.796   0.163  1.00  6.840          H  
ATOM    115  HD2 PHE A   8       5.714  11.725  -3.654  1.00  6.840          H  
ATOM    116  HE1 PHE A   8       7.436  11.562   0.954  1.00  6.840          H  
ATOM    117  HE2 PHE A   8       7.229  13.506  -2.826  1.00  6.840          H  
ATOM    118  HZ  PHE A   8       8.090  13.402  -0.533  1.00  6.840          H  
ATOM    119  N   ARG A   9       2.670  11.059  -3.940  1.00  4.160          N  
ATOM    120  CA  ARG A   9       2.207  12.243  -4.654  1.00  4.700          C  
ATOM    121  C   ARG A   9       0.875  12.726  -4.079  1.00  4.520          C  
ATOM    122  O   ARG A   9       0.640  13.932  -4.004  1.00  4.920          O  
ATOM    123  CB  ARG A   9       2.019  11.956  -6.143  1.00  6.360          C  
ATOM    124  CG  ARG A   9       3.295  11.734  -6.969  1.00  6.360          C  
ATOM    125  CD  ARG A   9       2.949  11.313  -8.367  1.00  6.360          C  
ATOM    126  NE  ARG A   9       4.124  10.957  -9.180  1.00  6.360          N  
ATOM    127  CZ  ARG A   9       4.084  10.345 -10.388  1.00  6.360          C  
ATOM    128  NH1 ARG A   9       2.942   9.982 -10.954  1.00  6.360          N  
ATOM    129  NH2 ARG A   9       5.226  10.099 -11.000  1.00  6.360          N  
ATOM    130  H   ARG A   9       2.919  10.218  -4.467  1.00  4.990          H  
ATOM    131  HA  ARG A   9       2.951  13.029  -4.537  1.00  5.640          H  
ATOM    132 1HB  ARG A   9       1.401  11.076  -6.268  1.00  7.640          H  
ATOM    133 2HB  ARG A   9       1.486  12.784  -6.600  1.00  7.640          H  
ATOM    134 1HG  ARG A   9       3.851  12.666  -7.024  1.00  7.640          H  
ATOM    135 2HG  ARG A   9       3.914  10.981  -6.519  1.00  7.640          H  
ATOM    136 1HD  ARG A   9       2.291  10.462  -8.333  1.00  7.640          H  
ATOM    137 2HD  ARG A   9       2.435  12.134  -8.862  1.00  7.640          H  
ATOM    138  HE  ARG A   9       5.071  11.155  -8.818  1.00  7.640          H  
ATOM    139 1HH1 ARG A   9       2.042  10.092 -10.465  1.00  7.640          H  
ATOM    140 2HH1 ARG A   9       2.949   9.519 -11.847  1.00  7.640          H  
ATOM    141 1HH2 ARG A   9       6.103  10.345 -10.519  1.00  7.640          H  
ATOM    142 2HH2 ARG A   9       5.245   9.636 -11.891  1.00  7.640          H  
ATOM    143  N   LEU A  10      -0.010  11.799  -3.675  1.00  4.300          N  
ATOM    144  CA  LEU A  10      -1.276  12.207  -3.072  1.00  4.570          C  
ATOM    145  C   LEU A  10      -1.030  12.926  -1.744  1.00  4.480          C  
ATOM    146  O   LEU A  10      -1.692  13.920  -1.449  1.00  4.840          O  
ATOM    147  CB  LEU A  10      -2.232  11.024  -2.842  1.00  6.290          C  
ATOM    148  CG  LEU A  10      -3.237  10.697  -3.979  1.00  6.290          C  
ATOM    149  CD1 LEU A  10      -2.489  10.217  -5.218  1.00  6.290          C  
ATOM    150  CD2 LEU A  10      -4.232   9.650  -3.493  1.00  6.290          C  
ATOM    151  H   LEU A  10       0.211  10.804  -3.805  1.00  5.160          H  
ATOM    152  HA  LEU A  10      -1.767  12.902  -3.748  1.00  5.480          H  
ATOM    153 1HB  LEU A  10      -1.626  10.137  -2.716  1.00  7.550          H  
ATOM    154 2HB  LEU A  10      -2.770  11.178  -1.927  1.00  7.550          H  
ATOM    155  HG  LEU A  10      -3.781  11.602  -4.244  1.00  7.550          H  
ATOM    156 1HD1 LEU A  10      -3.201  10.001  -6.013  1.00  7.550          H  
ATOM    157 2HD1 LEU A  10      -1.789  10.973  -5.566  1.00  7.550          H  
ATOM    158 3HD1 LEU A  10      -1.950   9.311  -4.973  1.00  7.550          H  
ATOM    159 1HD2 LEU A  10      -4.956   9.432  -4.284  1.00  7.550          H  
ATOM    160 2HD2 LEU A  10      -3.700   8.735  -3.225  1.00  7.550          H  
ATOM    161 3HD2 LEU A  10      -4.758  10.020  -2.632  1.00  7.550          H  
ATOM    162  N   ALA A  11      -0.041  12.479  -0.953  1.00  4.400          N  
ATOM    163  CA  ALA A  11       0.248  13.130   0.338  1.00  4.680          C  
ATOM    164  C   ALA A  11       0.581  14.591   0.127  1.00  4.840          C  
ATOM    165  O   ALA A  11       0.182  15.467   0.897  1.00  5.060          O  
ATOM    166  CB  ALA A  11       1.446  12.515   1.052  1.00  6.440          C  
ATOM    167  H   ALA A  11       0.489  11.650  -1.259  1.00  5.280          H  
ATOM    168  HA  ALA A  11      -0.639  13.047   0.966  1.00  5.620          H  
ATOM    169 1HB  ALA A  11       1.595  13.030   1.976  1.00  7.730          H  
ATOM    170 2HB  ALA A  11       1.318  11.504   1.263  1.00  7.730          H  
ATOM    171 3HB  ALA A  11       2.331  12.622   0.434  1.00  7.730          H  
ATOM    172  N   CYS A  12       1.291  14.851  -0.963  1.00  5.150          N  
ATOM    173  CA  CYS A  12       1.753  16.187  -1.316  1.00  5.790          C  
ATOM    174  C   CYS A  12       0.723  17.034  -2.081  1.00  5.970          C  
ATOM    175  O   CYS A  12       1.016  18.173  -2.459  1.00  6.500          O  
ATOM    176  CB  CYS A  12       3.038  16.053  -2.140  1.00  7.850          C  
ATOM    177  SG  CYS A  12       4.414  15.278  -1.214  1.00  7.850          S  
ATOM    178  H   CYS A  12       1.587  14.041  -1.527  1.00  6.180          H  
ATOM    179  HA  CYS A  12       1.988  16.716  -0.406  1.00  6.950          H  
ATOM    180 1HB  CYS A  12       2.845  15.458  -3.035  1.00  9.420          H  
ATOM    181 2HB  CYS A  12       3.365  17.041  -2.458  1.00  9.420          H  
ATOM    182  HG  CYS A  12       5.422  16.054  -1.708  1.00  9.420          H  
ATOM    183  N   ARG A  13      -0.465  16.477  -2.323  1.00  5.810          N  
ATOM    184  CA  ARG A  13      -1.533  17.131  -3.063  1.00  6.320          C  
ATOM    185  C   ARG A  13      -2.288  18.129  -2.180  1.00  6.030          C  
ATOM    186  O   ARG A  13      -2.433  17.925  -0.980  1.00  6.350          O  
ATOM    187  CB  ARG A  13      -2.494  16.088  -3.619  1.00  8.640          C  
ATOM    188  CG  ARG A  13      -3.512  16.601  -4.614  1.00  8.640          C  
ATOM    189  CD  ARG A  13      -4.380  15.547  -5.146  1.00  8.640          C  
ATOM    190  NE  ARG A  13      -3.690  14.599  -5.985  1.00  8.640          N  
ATOM    191  CZ  ARG A  13      -4.275  13.513  -6.531  1.00  8.640          C  
ATOM    192  NH1 ARG A  13      -5.561  13.271  -6.314  1.00  8.640          N  
ATOM    193  NH2 ARG A  13      -3.553  12.699  -7.289  1.00  8.640          N  
ATOM    194  H   ARG A  13      -0.655  15.538  -1.966  1.00  6.970          H  
ATOM    195  HA  ARG A  13      -1.091  17.674  -3.900  1.00  7.580          H  
ATOM    196 1HB  ARG A  13      -1.914  15.305  -4.099  1.00 10.370          H  
ATOM    197 2HB  ARG A  13      -3.042  15.631  -2.796  1.00 10.370          H  
ATOM    198 1HG  ARG A  13      -4.164  17.311  -4.146  1.00 10.370          H  
ATOM    199 2HG  ARG A  13      -2.997  17.070  -5.449  1.00 10.370          H  
ATOM    200 1HD  ARG A  13      -4.845  15.010  -4.316  1.00 10.370          H  
ATOM    201 2HD  ARG A  13      -5.145  16.024  -5.749  1.00 10.370          H  
ATOM    202  HE  ARG A  13      -2.708  14.753  -6.174  1.00 10.370          H  
ATOM    203 1HH1 ARG A  13      -6.126  13.918  -5.730  1.00 10.370          H  
ATOM    204 2HH1 ARG A  13      -6.003  12.461  -6.722  1.00 10.370          H  
ATOM    205 1HH2 ARG A  13      -2.574  12.894  -7.449  1.00 10.370          H  
ATOM    206 2HH2 ARG A  13      -3.966  11.872  -7.701  1.00 10.370          H  
ATOM    207  N   HIS A  14      -2.825  19.185  -2.788  1.00  5.720          N  
ATOM    208  CA  HIS A  14      -3.571  20.248  -2.115  1.00  5.670          C  
ATOM    209  C   HIS A  14      -4.980  19.899  -1.615  1.00  5.490          C  
ATOM    210  O   HIS A  14      -5.638  20.730  -0.983  1.00  5.560          O  
ATOM    211  CB  HIS A  14      -3.710  21.372  -3.119  1.00  7.960          C  
ATOM    212  CG  HIS A  14      -4.429  20.861  -4.308  1.00  7.960          C  
ATOM    213  ND1 HIS A  14      -3.829  19.996  -5.213  1.00  7.960          N  
ATOM    214  CD2 HIS A  14      -5.703  21.033  -4.737  1.00  7.960          C  
ATOM    215  CE1 HIS A  14      -4.711  19.674  -6.155  1.00  7.960          C  
ATOM    216  NE2 HIS A  14      -5.852  20.287  -5.886  1.00  7.960          N  
ATOM    217  H   HIS A  14      -2.713  19.302  -3.801  1.00  6.860          H  
ATOM    218  HA  HIS A  14      -2.990  20.599  -1.261  1.00  6.800          H  
ATOM    219 1HB  HIS A  14      -4.269  22.201  -2.685  1.00  9.550          H  
ATOM    220 2HB  HIS A  14      -2.729  21.736  -3.419  1.00  9.550          H  
ATOM    221  HD2 HIS A  14      -6.469  21.639  -4.253  1.00  9.550          H  
ATOM    222  HE1 HIS A  14      -4.533  19.007  -6.998  1.00  9.550          H  
ATOM    223  HE2 HIS A  14      -6.711  20.208  -6.426  1.00  9.550          H  
ATOM    224  N   GLU A  15      -5.463  18.715  -1.956  1.00  5.610          N  
ATOM    225  CA  GLU A  15      -6.804  18.281  -1.598  1.00  5.870          C  
ATOM    226  C   GLU A  15      -6.920  17.845  -0.145  1.00  5.800          C  
ATOM    227  O   GLU A  15      -6.026  17.197   0.390  1.00  6.190          O  
ATOM    228  CB  GLU A  15      -7.220  17.137  -2.523  1.00  8.110          C  
ATOM    229  CG  GLU A  15      -7.395  17.569  -3.971  1.00  8.110          C  
ATOM    230  CD  GLU A  15      -7.753  16.455  -4.902  1.00  8.110          C  
ATOM    231  OE1 GLU A  15      -7.427  15.327  -4.610  1.00  8.110          O  
ATOM    232  OE2 GLU A  15      -8.335  16.725  -5.925  1.00  8.110          O  
ATOM    233  H   GLU A  15      -4.858  18.095  -2.466  1.00  6.730          H  
ATOM    234  HA  GLU A  15      -7.483  19.119  -1.756  1.00  7.040          H  
ATOM    235 1HB  GLU A  15      -6.461  16.353  -2.491  1.00  9.740          H  
ATOM    236 2HB  GLU A  15      -8.157  16.699  -2.173  1.00  9.740          H  
ATOM    237 1HG  GLU A  15      -8.169  18.333  -4.019  1.00  9.740          H  
ATOM    238 2HG  GLU A  15      -6.471  18.019  -4.304  1.00  9.740          H  
ATOM    239  N   ARG A  16      -8.070  18.159   0.469  1.00  5.640          N  
ATOM    240  CA  ARG A  16      -8.371  17.753   1.847  1.00  5.950          C  
ATOM    241  C   ARG A  16      -8.499  16.241   1.951  1.00  5.730          C  
ATOM    242  O   ARG A  16      -8.122  15.636   2.952  1.00  6.180          O  
ATOM    243  CB  ARG A  16      -9.681  18.373   2.317  1.00  8.210          C  
ATOM    244  CG  ARG A  16      -9.754  19.904   2.351  1.00  8.210          C  
ATOM    245  CD  ARG A  16      -8.990  20.567   3.480  1.00  8.210          C  
ATOM    246  NE  ARG A  16      -7.549  20.662   3.237  1.00  8.210          N  
ATOM    247  CZ  ARG A  16      -6.930  21.506   2.379  1.00  8.210          C  
ATOM    248  NH1 ARG A  16      -7.602  22.339   1.610  1.00  8.210          N  
ATOM    249  NH2 ARG A  16      -5.620  21.470   2.330  1.00  8.210          N  
ATOM    250  H   ARG A  16      -8.741  18.712  -0.043  1.00  6.770          H  
ATOM    251  HA  ARG A  16      -7.556  18.069   2.494  1.00  7.140          H  
ATOM    252 1HB  ARG A  16     -10.474  18.047   1.661  1.00  9.850          H  
ATOM    253 2HB  ARG A  16      -9.914  18.004   3.312  1.00  9.850          H  
ATOM    254 1HG  ARG A  16      -9.374  20.281   1.412  1.00  9.850          H  
ATOM    255 2HG  ARG A  16     -10.800  20.195   2.452  1.00  9.850          H  
ATOM    256 1HD  ARG A  16      -9.378  21.571   3.646  1.00  9.850          H  
ATOM    257 2HD  ARG A  16      -9.132  19.981   4.384  1.00  9.850          H  
ATOM    258  HE  ARG A  16      -6.916  20.078   3.803  1.00  9.850          H  
ATOM    259 1HH1 ARG A  16      -8.605  22.368   1.647  1.00  9.850          H  
ATOM    260 2HH1 ARG A  16      -7.103  22.949   0.977  1.00  9.850          H  
ATOM    261 1HH2 ARG A  16      -5.138  20.821   2.965  1.00  9.850          H  
ATOM    262 2HH2 ARG A  16      -5.108  22.073   1.700  1.00  9.850          H  
ATOM    263  N   TYR A  17      -9.079  15.635   0.918  1.00  5.360          N  
ATOM    264  CA  TYR A  17      -9.275  14.201   0.895  1.00  5.390          C  
ATOM    265  C   TYR A  17      -8.670  13.628  -0.390  1.00  5.390          C  
ATOM    266  O   TYR A  17      -9.389  13.489  -1.377  1.00  5.480          O  
ATOM    267  CB  TYR A  17     -10.770  13.903   0.940  1.00  7.530          C  
ATOM    268  CG  TYR A  17     -11.463  14.608   2.085  1.00  7.530          C  
ATOM    269  CD1 TYR A  17     -12.167  15.767   1.809  1.00  7.530          C  
ATOM    270  CD2 TYR A  17     -11.387  14.147   3.381  1.00  7.530          C  
ATOM    271  CE1 TYR A  17     -12.796  16.458   2.812  1.00  7.530          C  
ATOM    272  CE2 TYR A  17     -12.024  14.848   4.384  1.00  7.530          C  
ATOM    273  CZ  TYR A  17     -12.725  15.995   4.102  1.00  7.530          C  
ATOM    274  OH  TYR A  17     -13.362  16.690   5.107  1.00  7.530          O  
ATOM    275  H   TYR A  17      -9.390  16.191   0.137  1.00  6.430          H  
ATOM    276  HA  TYR A  17      -8.797  13.750   1.761  1.00  6.470          H  
ATOM    277 1HB  TYR A  17     -11.241  14.214   0.006  1.00  9.040          H  
ATOM    278 2HB  TYR A  17     -10.927  12.828   1.049  1.00  9.040          H  
ATOM    279  HD1 TYR A  17     -12.220  16.135   0.786  1.00  9.040          H  
ATOM    280  HD2 TYR A  17     -10.834  13.243   3.611  1.00  9.040          H  
ATOM    281  HE1 TYR A  17     -13.347  17.369   2.587  1.00  9.040          H  
ATOM    282  HE2 TYR A  17     -11.975  14.493   5.404  1.00  9.040          H  
ATOM    283  HH  TYR A  17     -13.169  16.280   5.952  1.00  9.040          H  
ATOM    284  N   PRO A  18      -7.361  13.296  -0.429  1.00  5.730          N  
ATOM    285  CA  PRO A  18      -6.643  12.811  -1.609  1.00  6.060          C  
ATOM    286  C   PRO A  18      -7.350  11.631  -2.300  1.00  5.780          C  
ATOM    287  O   PRO A  18      -7.314  11.500  -3.522  1.00  5.880          O  
ATOM    288  CB  PRO A  18      -5.299  12.396  -1.005  1.00  9.090          C  
ATOM    289  CG  PRO A  18      -5.122  13.302   0.189  1.00  9.090          C  
ATOM    290  CD  PRO A  18      -6.504  13.449   0.776  1.00  9.090          C  
ATOM    291  HA  PRO A  18      -6.512  13.645  -2.317  1.00  7.270          H  
ATOM    292 1HB  PRO A  18      -5.297  11.329  -0.744  1.00 10.910          H  
ATOM    293 2HB  PRO A  18      -4.518  12.561  -1.749  1.00 10.910          H  
ATOM    294 1HG  PRO A  18      -4.401  12.860   0.898  1.00 10.910          H  
ATOM    295 2HG  PRO A  18      -4.696  14.275  -0.124  1.00 10.910          H  
ATOM    296 1HD  PRO A  18      -6.706  12.665   1.524  1.00 10.910          H  
ATOM    297 2HD  PRO A  18      -6.575  14.455   1.201  1.00 10.910          H  
ATOM    298  N   THR A  19      -8.029  10.795  -1.506  1.00  5.810          N  
ATOM    299  CA  THR A  19      -8.767   9.653  -2.024  1.00  5.930          C  
ATOM    300  C   THR A  19     -10.206   9.795  -1.529  1.00  5.700          C  
ATOM    301  O   THR A  19     -10.443  10.195  -0.389  1.00  5.480          O  
ATOM    302  CB  THR A  19      -8.128   8.316  -1.586  1.00  8.250          C  
ATOM    303  OG1 THR A  19      -6.792   8.245  -2.079  1.00  8.250          O  
ATOM    304  CG2 THR A  19      -8.907   7.136  -2.160  1.00  8.250          C  
ATOM    305  H   THR A  19      -8.027  10.919  -0.507  1.00  6.970          H  
ATOM    306  HA  THR A  19      -8.775   9.689  -3.111  1.00  7.120          H  
ATOM    307  HB  THR A  19      -8.101   8.269  -0.511  1.00  9.900          H  
ATOM    308  HG1 THR A  19      -6.254   8.885  -1.612  1.00  9.900          H  
ATOM    309 1HG2 THR A  19      -8.430   6.209  -1.847  1.00  9.900          H  
ATOM    310 2HG2 THR A  19      -9.929   7.141  -1.806  1.00  9.900          H  
ATOM    311 3HG2 THR A  19      -8.904   7.197  -3.246  1.00  9.900          H  
ATOM    312  N   ARG A  20     -11.162   9.482  -2.401  1.00  6.090          N  
ATOM    313  CA  ARG A  20     -12.578   9.621  -2.081  1.00  6.310          C  
ATOM    314  C   ARG A  20     -13.154   8.389  -1.392  1.00  5.960          C  
ATOM    315  O   ARG A  20     -12.667   7.271  -1.600  1.00  6.200          O  
ATOM    316  CB  ARG A  20     -13.354   9.909  -3.358  1.00  8.750          C  
ATOM    317  CG  ARG A  20     -13.367  11.386  -3.805  1.00  8.750          C  
ATOM    318  CD  ARG A  20     -11.989  11.894  -4.114  1.00  8.750          C  
ATOM    319  NE  ARG A  20     -12.002  13.183  -4.774  1.00  8.750          N  
ATOM    320  CZ  ARG A  20     -10.894  13.931  -5.010  1.00  8.750          C  
ATOM    321  NH1 ARG A  20      -9.709  13.506  -4.620  1.00  8.750          N  
ATOM    322  NH2 ARG A  20     -10.999  15.100  -5.634  1.00  8.750          N  
ATOM    323  H   ARG A  20     -10.885   9.141  -3.309  1.00  7.310          H  
ATOM    324  HA  ARG A  20     -12.692  10.473  -1.411  1.00  7.570          H  
ATOM    325 1HB  ARG A  20     -12.947   9.316  -4.174  1.00 10.500          H  
ATOM    326 2HB  ARG A  20     -14.390   9.607  -3.223  1.00 10.500          H  
ATOM    327 1HG  ARG A  20     -13.980  11.491  -4.699  1.00 10.500          H  
ATOM    328 2HG  ARG A  20     -13.780  12.002  -3.006  1.00 10.500          H  
ATOM    329 1HD  ARG A  20     -11.444  12.023  -3.177  1.00 10.500          H  
ATOM    330 2HD  ARG A  20     -11.464  11.186  -4.752  1.00 10.500          H  
ATOM    331  HE  ARG A  20     -12.893  13.545  -5.085  1.00 10.500          H  
ATOM    332 1HH1 ARG A  20      -9.597  12.630  -4.129  1.00 10.500          H  
ATOM    333 2HH1 ARG A  20      -8.877  14.088  -4.780  1.00 10.500          H  
ATOM    334 1HH2 ARG A  20     -11.898  15.437  -5.936  1.00 10.500          H  
ATOM    335 2HH2 ARG A  20     -10.146  15.666  -5.814  1.00 10.500          H  
ATOM    336  N   HIS A  21     -14.211   8.626  -0.595  1.00  5.750          N  
ATOM    337  CA  HIS A  21     -14.968   7.618   0.162  1.00  5.830          C  
ATOM    338  C   HIS A  21     -14.090   6.881   1.169  1.00  5.190          C  
ATOM    339  O   HIS A  21     -14.237   5.675   1.381  1.00  5.310          O  
ATOM    340  CB  HIS A  21     -15.627   6.613  -0.787  1.00  8.130          C  
ATOM    341  CG  HIS A  21     -16.513   7.258  -1.801  1.00  8.130          C  
ATOM    342  ND1 HIS A  21     -17.710   7.865  -1.473  1.00  8.130          N  
ATOM    343  CD2 HIS A  21     -16.373   7.398  -3.137  1.00  8.130          C  
ATOM    344  CE1 HIS A  21     -18.266   8.347  -2.570  1.00  8.130          C  
ATOM    345  NE2 HIS A  21     -17.474   8.077  -3.592  1.00  8.130          N  
ATOM    346  H   HIS A  21     -14.522   9.582  -0.509  1.00  6.900          H  
ATOM    347  HA  HIS A  21     -15.760   8.111   0.723  1.00  7.000          H  
ATOM    348 1HB  HIS A  21     -14.865   6.034  -1.308  1.00  9.760          H  
ATOM    349 2HB  HIS A  21     -16.228   5.913  -0.209  1.00  9.760          H  
ATOM    350  HD2 HIS A  21     -15.536   7.039  -3.738  1.00  9.760          H  
ATOM    351  HE1 HIS A  21     -19.217   8.878  -2.623  1.00  9.760          H  
ATOM    352  HE2 HIS A  21     -17.646   8.328  -4.555  1.00  9.760          H  
ATOM    353  N   GLN A  22     -13.173   7.621   1.780  1.00  4.900          N  
ATOM    354  CA  GLN A  22     -12.252   7.099   2.768  1.00  4.640          C  
ATOM    355  C   GLN A  22     -12.576   7.641   4.165  1.00  4.340          C  
ATOM    356  O   GLN A  22     -13.359   8.580   4.273  1.00  4.560          O  
ATOM    357  CB  GLN A  22     -10.834   7.456   2.367  1.00  6.600          C  
ATOM    358  CG  GLN A  22     -10.456   6.986   1.050  1.00  6.600          C  
ATOM    359  CD  GLN A  22     -10.534   5.515   0.922  1.00  6.600          C  
ATOM    360  OE1 GLN A  22      -9.941   4.770   1.713  1.00  6.600          O  
ATOM    361  NE2 GLN A  22     -11.277   5.066  -0.077  1.00  6.600          N  
ATOM    362  H   GLN A  22     -13.125   8.607   1.561  1.00  5.880          H  
ATOM    363  HA  GLN A  22     -12.358   6.022   2.760  1.00  5.570          H  
ATOM    364 1HB  GLN A  22     -10.706   8.539   2.383  1.00  7.920          H  
ATOM    365 2HB  GLN A  22     -10.137   7.029   3.034  1.00  7.920          H  
ATOM    366 1HG  GLN A  22     -11.079   7.446   0.308  1.00  7.920          H  
ATOM    367 2HG  GLN A  22      -9.434   7.267   0.909  1.00  7.920          H  
ATOM    368 1HE2 GLN A  22     -11.390   4.085  -0.227  1.00  7.920          H  
ATOM    369 2HE2 GLN A  22     -11.755   5.738  -0.693  1.00  7.920          H  
ATOM    370  N   PRO A  23     -12.040   7.037   5.257  1.00  4.410          N  
ATOM    371  CA  PRO A  23     -12.109   7.505   6.647  1.00  4.550          C  
ATOM    372  C   PRO A  23     -11.495   8.897   6.922  1.00  4.540          C  
ATOM    373  O   PRO A  23     -11.804   9.503   7.956  1.00  4.780          O  
ATOM    374  CB  PRO A  23     -11.309   6.434   7.404  1.00  6.820          C  
ATOM    375  CG  PRO A  23     -11.407   5.191   6.558  1.00  6.820          C  
ATOM    376  CD  PRO A  23     -11.406   5.680   5.134  1.00  6.820          C  
ATOM    377  HA  PRO A  23     -13.160   7.493   6.965  1.00  5.460          H  
ATOM    378 1HB  PRO A  23     -10.268   6.777   7.544  1.00  8.190          H  
ATOM    379 2HB  PRO A  23     -11.735   6.295   8.408  1.00  8.190          H  
ATOM    380 1HG  PRO A  23     -10.553   4.525   6.770  1.00  8.190          H  
ATOM    381 2HG  PRO A  23     -12.316   4.628   6.816  1.00  8.190          H  
ATOM    382 1HD  PRO A  23     -10.374   5.737   4.771  1.00  8.190          H  
ATOM    383 2HD  PRO A  23     -12.019   4.981   4.555  1.00  8.190          H  
ATOM    384  N   HIS A  24     -10.634   9.397   6.032  1.00  4.740          N  
ATOM    385  CA  HIS A  24      -9.989  10.685   6.221  1.00  5.180          C  
ATOM    386  C   HIS A  24     -11.066  11.751   6.426  1.00  5.110          C  
ATOM    387  O   HIS A  24     -12.128  11.662   5.812  1.00  5.310          O  
ATOM    388  CB  HIS A  24      -9.236  11.037   4.950  1.00  7.080          C  
ATOM    389  CG  HIS A  24      -8.252  10.043   4.583  1.00  7.080          C  
ATOM    390  ND1 HIS A  24      -8.623   8.763   4.258  1.00  7.080          N  
ATOM    391  CD2 HIS A  24      -6.916  10.103   4.389  1.00  7.080          C  
ATOM    392  CE1 HIS A  24      -7.564   8.071   3.909  1.00  7.080          C  
ATOM    393  NE2 HIS A  24      -6.527   8.854   3.963  1.00  7.080          N  
ATOM    394  H   HIS A  24     -10.355   8.884   5.197  1.00  5.690          H  
ATOM    395  HA  HIS A  24      -9.308  10.617   7.063  1.00  6.220          H  
ATOM    396 1HB  HIS A  24      -9.944  11.128   4.127  1.00  8.490          H  
ATOM    397 2HB  HIS A  24      -8.734  11.998   5.066  1.00  8.490          H  
ATOM    398  HD2 HIS A  24      -6.274  10.973   4.516  1.00  8.490          H  
ATOM    399  HE1 HIS A  24      -7.549   7.028   3.595  1.00  8.490          H  
ATOM    400  HE2 HIS A  24      -5.594   8.552   3.690  1.00  8.490          H  
ATOM    401  N   MET A  25     -10.849  12.759   7.286  1.00  5.240          N  
ATOM    402  CA  MET A  25      -9.658  13.047   8.090  1.00  5.470          C  
ATOM    403  C   MET A  25      -9.847  12.553   9.535  1.00  5.110          C  
ATOM    404  O   MET A  25      -9.295  13.115  10.481  1.00  5.280          O  
ATOM    405  CB  MET A  25      -9.340  14.547   8.010  1.00  7.570          C  
ATOM    406  CG  MET A  25      -8.894  15.008   6.582  1.00  7.570          C  
ATOM    407  SD  MET A  25      -8.385  16.747   6.466  1.00  7.570          S  
ATOM    408  CE  MET A  25      -9.938  17.609   6.428  1.00  7.570          C  
ATOM    409  H   MET A  25     -11.617  13.404   7.406  1.00  6.290          H  
ATOM    410  HA  MET A  25      -8.794  12.535   7.678  1.00  6.560          H  
ATOM    411 1HB  MET A  25     -10.206  15.124   8.314  1.00  9.080          H  
ATOM    412 2HB  MET A  25      -8.518  14.780   8.702  1.00  9.080          H  
ATOM    413 1HG  MET A  25      -8.071  14.399   6.252  1.00  9.080          H  
ATOM    414 2HG  MET A  25      -9.693  14.852   5.888  1.00  9.080          H  
ATOM    415 1HE  MET A  25      -9.759  18.677   6.355  1.00  9.080          H  
ATOM    416 2HE  MET A  25     -10.511  17.280   5.564  1.00  9.080          H  
ATOM    417 3HE  MET A  25     -10.500  17.398   7.335  1.00  9.080          H  
ATOM    418  N   GLY A  26     -10.645  11.489   9.716  1.00  5.060          N  
ATOM    419  CA  GLY A  26     -10.935  10.913  11.031  1.00  5.230          C  
ATOM    420  C   GLY A  26      -9.761  10.109  11.584  1.00  4.880          C  
ATOM    421  O   GLY A  26      -9.808   9.598  12.705  1.00  5.210          O  
ATOM    422  H   GLY A  26     -11.078  11.023   8.911  1.00  6.070          H  
ATOM    423 1HA  GLY A  26     -11.196  11.710  11.725  1.00  6.280          H  
ATOM    424 2HA  GLY A  26     -11.806  10.266  10.942  1.00  6.280          H  
ATOM    425  N   ASP A  27      -8.718   9.974  10.774  1.00  4.670          N  
ATOM    426  CA  ASP A  27      -7.471   9.310  11.068  1.00  4.800          C  
ATOM    427  C   ASP A  27      -6.411  10.340  11.434  1.00  4.510          C  
ATOM    428  O   ASP A  27      -5.223  10.011  11.539  1.00  5.010          O  
ATOM    429  CB  ASP A  27      -7.048   8.526   9.841  1.00  6.670          C  
ATOM    430  CG  ASP A  27      -6.927   9.470   8.637  1.00  6.670          C  
ATOM    431  OD1 ASP A  27      -7.341  10.650   8.772  1.00  6.670          O  
ATOM    432  OD2 ASP A  27      -6.459   9.044   7.606  1.00  6.670          O  
ATOM    433  H   ASP A  27      -8.746  10.424   9.858  1.00  5.600          H  
ATOM    434  HA  ASP A  27      -7.618   8.635  11.914  1.00  5.760          H  
ATOM    435 1HB  ASP A  27      -6.088   8.043  10.023  1.00  8.000          H  
ATOM    436 2HB  ASP A  27      -7.784   7.751   9.621  1.00  8.000          H  
ATOM    437  N   SER A  28      -6.867  11.578  11.636  1.00  4.160          N  
ATOM    438  CA  SER A  28      -6.078  12.751  11.951  1.00  4.240          C  
ATOM    439  C   SER A  28      -5.126  13.159  10.835  1.00  3.930          C  
ATOM    440  O   SER A  28      -4.080  13.754  11.108  1.00  4.100          O  
ATOM    441  CB  SER A  28      -5.288  12.574  13.247  1.00  5.900          C  
ATOM    442  OG  SER A  28      -6.132  12.361  14.355  1.00  5.900          O  
ATOM    443  H   SER A  28      -7.861  11.760  11.506  1.00  4.990          H  
ATOM    444  HA  SER A  28      -6.775  13.579  12.096  1.00  5.090          H  
ATOM    445 1HB  SER A  28      -4.592  11.749  13.151  1.00  7.080          H  
ATOM    446 2HB  SER A  28      -4.695  13.469  13.420  1.00  7.080          H  
ATOM    447  HG  SER A  28      -5.551  12.283  15.113  1.00  7.080          H  
ATOM    448  N   TRP A  29      -5.501  12.912   9.568  1.00  3.960          N  
ATOM    449  CA  TRP A  29      -4.700  13.415   8.471  1.00  3.900          C  
ATOM    450  C   TRP A  29      -4.852  14.942   8.671  1.00  3.810          C  
ATOM    451  O   TRP A  29      -5.939  15.379   9.051  1.00  4.080          O  
ATOM    452  CB  TRP A  29      -5.298  12.903   7.137  1.00  5.480          C  
ATOM    453  CG  TRP A  29      -4.481  13.119   5.862  1.00  5.480          C  
ATOM    454  CD1 TRP A  29      -3.575  12.252   5.376  1.00  5.480          C  
ATOM    455  CD2 TRP A  29      -4.515  14.209   4.916  1.00  5.480          C  
ATOM    456  NE1 TRP A  29      -3.033  12.722   4.213  1.00  5.480          N  
ATOM    457  CE2 TRP A  29      -3.582  13.918   3.922  1.00  5.480          C  
ATOM    458  CE3 TRP A  29      -5.230  15.362   4.835  1.00  5.480          C  
ATOM    459  CZ2 TRP A  29      -3.353  14.770   2.856  1.00  5.480          C  
ATOM    460  CZ3 TRP A  29      -5.010  16.226   3.777  1.00  5.480          C  
ATOM    461  CH2 TRP A  29      -4.097  15.943   2.814  1.00  5.480          C  
ATOM    462  H   TRP A  29      -6.340  12.352   9.343  1.00  4.750          H  
ATOM    463  HA  TRP A  29      -3.672  13.084   8.585  1.00  4.680          H  
ATOM    464 1HB  TRP A  29      -5.487  11.825   7.229  1.00  6.580          H  
ATOM    465 2HB  TRP A  29      -6.252  13.364   6.992  1.00  6.580          H  
ATOM    466  HD1 TRP A  29      -3.327  11.322   5.831  1.00  6.580          H  
ATOM    467  HE1 TRP A  29      -2.326  12.227   3.625  1.00  6.580          H  
ATOM    468  HE3 TRP A  29      -5.951  15.605   5.596  1.00  6.580          H  
ATOM    469  HZ2 TRP A  29      -2.621  14.551   2.068  1.00  6.580          H  
ATOM    470  HZ3 TRP A  29      -5.591  17.148   3.743  1.00  6.580          H  
ATOM    471  HH2 TRP A  29      -3.956  16.649   1.992  1.00  6.580          H  
ATOM    472  N   PRO A  30      -3.788  15.755   8.555  1.00  3.960          N  
ATOM    473  CA  PRO A  30      -3.795  17.197   8.765  1.00  4.340          C  
ATOM    474  C   PRO A  30      -4.566  17.904   7.693  1.00  4.530          C  
ATOM    475  O   PRO A  30      -4.623  17.431   6.582  1.00  4.820          O  
ATOM    476  CB  PRO A  30      -2.309  17.555   8.698  1.00  6.510          C  
ATOM    477  CG  PRO A  30      -1.706  16.484   7.844  1.00  6.510          C  
ATOM    478  CD  PRO A  30      -2.491  15.223   8.157  1.00  6.510          C  
ATOM    479  HA  PRO A  30      -4.214  17.415   9.759  1.00  5.210          H  
ATOM    480 1HB  PRO A  30      -2.186  18.556   8.249  1.00  7.810          H  
ATOM    481 2HB  PRO A  30      -1.882  17.594   9.707  1.00  7.810          H  
ATOM    482 1HG  PRO A  30      -1.773  16.772   6.771  1.00  7.810          H  
ATOM    483 2HG  PRO A  30      -0.639  16.383   8.080  1.00  7.810          H  
ATOM    484 1HD  PRO A  30      -2.569  14.632   7.244  1.00  7.810          H  
ATOM    485 2HD  PRO A  30      -2.018  14.665   8.985  1.00  7.810          H  
ATOM    486  N   ARG A  31      -5.102  19.077   7.971  1.00  4.800          N  
ATOM    487  CA  ARG A  31      -5.779  19.784   6.895  1.00  5.350          C  
ATOM    488  C   ARG A  31      -4.831  20.100   5.731  1.00  5.180          C  
ATOM    489  O   ARG A  31      -5.239  20.028   4.567  1.00  5.410          O  
ATOM    490  CB  ARG A  31      -6.424  21.068   7.394  1.00  7.270          C  
ATOM    491  CG  ARG A  31      -7.650  20.857   8.280  1.00  7.270          C  
ATOM    492  CD  ARG A  31      -8.432  22.123   8.491  1.00  7.270          C  
ATOM    493  NE  ARG A  31      -7.670  23.144   9.228  1.00  7.270          N  
ATOM    494  CZ  ARG A  31      -7.601  23.259  10.580  1.00  7.270          C  
ATOM    495  NH1 ARG A  31      -8.239  22.412  11.366  1.00  7.270          N  
ATOM    496  NH2 ARG A  31      -6.882  24.235  11.114  1.00  7.270          N  
ATOM    497  H   ARG A  31      -5.049  19.460   8.901  1.00  5.760          H  
ATOM    498  HA  ARG A  31      -6.570  19.142   6.514  1.00  6.420          H  
ATOM    499 1HB  ARG A  31      -5.694  21.644   7.959  1.00  8.720          H  
ATOM    500 2HB  ARG A  31      -6.728  21.672   6.538  1.00  8.720          H  
ATOM    501 1HG  ARG A  31      -8.307  20.125   7.812  1.00  8.720          H  
ATOM    502 2HG  ARG A  31      -7.330  20.480   9.249  1.00  8.720          H  
ATOM    503 1HD  ARG A  31      -8.693  22.538   7.518  1.00  8.720          H  
ATOM    504 2HD  ARG A  31      -9.348  21.905   9.036  1.00  8.720          H  
ATOM    505  HE  ARG A  31      -7.166  23.828   8.679  1.00  8.720          H  
ATOM    506 1HH1 ARG A  31      -8.790  21.667  10.971  1.00  8.720          H  
ATOM    507 2HH1 ARG A  31      -8.178  22.510  12.370  1.00  8.720          H  
ATOM    508 1HH2 ARG A  31      -6.391  24.888  10.517  1.00  8.720          H  
ATOM    509 2HH2 ARG A  31      -6.823  24.332  12.117  1.00  8.720          H  
ATOM    510  N   SER A  32      -3.595  20.504   6.050  1.00  5.130          N  
ATOM    511  CA  SER A  32      -2.586  20.858   5.054  1.00  5.230          C  
ATOM    512  C   SER A  32      -1.950  19.634   4.383  1.00  5.480          C  
ATOM    513  O   SER A  32      -1.987  18.521   4.904  1.00  5.750          O  
ATOM    514  CB  SER A  32      -1.513  21.710   5.711  1.00  7.280          C  
ATOM    515  OG  SER A  32      -0.797  20.981   6.676  1.00  7.280          O  
ATOM    516  H   SER A  32      -3.336  20.562   7.023  1.00  6.160          H  
ATOM    517  HA  SER A  32      -3.062  21.453   4.274  1.00  6.280          H  
ATOM    518 1HB  SER A  32      -0.832  22.072   4.950  1.00  8.740          H  
ATOM    519 2HB  SER A  32      -1.974  22.578   6.174  1.00  8.740          H  
ATOM    520  HG  SER A  32      -0.080  21.556   6.956  1.00  8.740          H  
ATOM    521  N   SER A  33      -1.323  19.860   3.228  1.00  5.700          N  
ATOM    522  CA  SER A  33      -0.642  18.796   2.482  1.00  6.150          C  
ATOM    523  C   SER A  33       0.733  18.506   3.037  1.00  5.720          C  
ATOM    524  O   SER A  33       1.263  19.272   3.839  1.00  5.400          O  
ATOM    525  CB  SER A  33      -0.493  19.176   1.020  1.00  8.430          C  
ATOM    526  OG  SER A  33       0.454  20.200   0.825  1.00  8.430          O  
ATOM    527  H   SER A  33      -1.326  20.811   2.834  1.00  6.840          H  
ATOM    528  HA  SER A  33      -1.244  17.886   2.553  1.00  7.380          H  
ATOM    529 1HB  SER A  33      -0.219  18.299   0.438  1.00 10.120          H  
ATOM    530 2HB  SER A  33      -1.458  19.518   0.658  1.00 10.120          H  
ATOM    531  HG  SER A  33       0.352  20.457  -0.108  1.00 10.120          H  
ATOM    532  N   ALA A  34       1.349  17.414   2.569  1.00  5.970          N  
ATOM    533  CA  ALA A  34       2.708  17.089   2.988  1.00  5.920          C  
ATOM    534  C   ALA A  34       3.660  18.191   2.629  1.00  5.560          C  
ATOM    535  O   ALA A  34       4.594  18.480   3.373  1.00  5.100          O  
ATOM    536  CB  ALA A  34       3.199  15.849   2.290  1.00  8.310          C  
ATOM    537  H   ALA A  34       0.855  16.790   1.928  1.00  7.160          H  
ATOM    538  HA  ALA A  34       2.718  16.953   4.061  1.00  7.100          H  
ATOM    539 1HB  ALA A  34       4.189  15.644   2.609  1.00  9.970          H  
ATOM    540 2HB  ALA A  34       2.585  15.032   2.495  1.00  9.970          H  
ATOM    541 3HB  ALA A  34       3.204  16.011   1.255  1.00  9.970          H  
ATOM    542  N   HIS A  35       3.436  18.787   1.464  1.00  6.010          N  
ATOM    543  CA  HIS A  35       4.295  19.821   0.935  1.00  5.950          C  
ATOM    544  C   HIS A  35       4.152  21.059   1.790  1.00  5.220          C  
ATOM    545  O   HIS A  35       5.146  21.651   2.225  1.00  4.970          O  
ATOM    546  CB  HIS A  35       3.949  20.094  -0.524  1.00  8.350          C  
ATOM    547  CG  HIS A  35       4.936  20.943  -1.199  1.00  8.350          C  
ATOM    548  ND1 HIS A  35       6.180  20.463  -1.574  1.00  8.350          N  
ATOM    549  CD2 HIS A  35       4.900  22.239  -1.576  1.00  8.350          C  
ATOM    550  CE1 HIS A  35       6.861  21.432  -2.154  1.00  8.350          C  
ATOM    551  NE2 HIS A  35       6.107  22.521  -2.171  1.00  8.350          N  
ATOM    552  H   HIS A  35       2.637  18.490   0.921  1.00  7.210          H  
ATOM    553  HA  HIS A  35       5.331  19.528   0.977  1.00  7.140          H  
ATOM    554 1HB  HIS A  35       3.880  19.147  -1.062  1.00 10.020          H  
ATOM    555 2HB  HIS A  35       2.977  20.579  -0.587  1.00 10.020          H  
ATOM    556  HD1 HIS A  35       6.460  19.462  -1.607  1.00 10.020          H  
ATOM    557  HD2 HIS A  35       4.138  23.013  -1.488  1.00 10.020          H  
ATOM    558  HE1 HIS A  35       7.871  21.248  -2.519  1.00 10.020          H  
ATOM    559  N   GLU A  36       2.904  21.448   2.032  1.00  5.200          N  
ATOM    560  CA  GLU A  36       2.607  22.620   2.829  1.00  4.920          C  
ATOM    561  C   GLU A  36       3.152  22.452   4.243  1.00  4.110          C  
ATOM    562  O   GLU A  36       3.606  23.418   4.850  1.00  4.060          O  
ATOM    563  CB  GLU A  36       1.099  22.854   2.833  1.00  7.000          C  
ATOM    564  CG  GLU A  36       0.540  23.346   1.487  1.00  7.000          C  
ATOM    565  CD  GLU A  36      -0.973  23.289   1.387  1.00  7.000          C  
ATOM    566  OE1 GLU A  36      -1.580  22.508   2.100  1.00  7.000          O  
ATOM    567  OE2 GLU A  36      -1.524  24.013   0.594  1.00  7.000          O  
ATOM    568  H   GLU A  36       2.131  20.912   1.642  1.00  6.240          H  
ATOM    569  HA  GLU A  36       3.097  23.483   2.374  1.00  5.900          H  
ATOM    570 1HB  GLU A  36       0.607  21.921   3.080  1.00  8.400          H  
ATOM    571 2HB  GLU A  36       0.842  23.580   3.603  1.00  8.400          H  
ATOM    572 1HG  GLU A  36       0.855  24.380   1.347  1.00  8.400          H  
ATOM    573 2HG  GLU A  36       0.979  22.760   0.685  1.00  8.400          H  
ATOM    574  N   ALA A  37       3.064  21.236   4.792  1.00  3.820          N  
ATOM    575  CA  ALA A  37       3.580  20.952   6.119  1.00  3.470          C  
ATOM    576  C   ALA A  37       5.110  20.973   6.169  1.00  3.430          C  
ATOM    577  O   ALA A  37       5.698  21.566   7.072  1.00  3.700          O  
ATOM    578  CB  ALA A  37       3.079  19.602   6.586  1.00  5.000          C  
ATOM    579  H   ALA A  37       2.603  20.485   4.271  1.00  4.580          H  
ATOM    580  HA  ALA A  37       3.211  21.727   6.790  1.00  4.160          H  
ATOM    581 1HB  ALA A  37       3.439  19.405   7.591  1.00  6.000          H  
ATOM    582 2HB  ALA A  37       1.987  19.594   6.577  1.00  6.000          H  
ATOM    583 3HB  ALA A  37       3.446  18.831   5.909  1.00  6.000          H  
ATOM    584  N   ALA A  38       5.776  20.361   5.182  1.00  3.690          N  
ATOM    585  CA  ALA A  38       7.236  20.306   5.161  1.00  4.210          C  
ATOM    586  C   ALA A  38       7.829  21.713   5.104  1.00  4.310          C  
ATOM    587  O   ALA A  38       8.834  22.005   5.763  1.00  4.780          O  
ATOM    588  CB  ALA A  38       7.705  19.476   3.979  1.00  5.690          C  
ATOM    589  H   ALA A  38       5.268  19.861   4.449  1.00  4.430          H  
ATOM    590  HA  ALA A  38       7.572  19.827   6.076  1.00  5.050          H  
ATOM    591 1HB  ALA A  38       8.789  19.412   3.978  1.00  6.820          H  
ATOM    592 2HB  ALA A  38       7.286  18.467   4.052  1.00  6.820          H  
ATOM    593 3HB  ALA A  38       7.368  19.935   3.050  1.00  6.820          H  
ATOM    594  N   GLU A  39       7.151  22.605   4.382  1.00  4.250          N  
ATOM    595  CA  GLU A  39       7.527  24.005   4.188  1.00  4.720          C  
ATOM    596  C   GLU A  39       7.579  24.792   5.501  1.00  4.750          C  
ATOM    597  O   GLU A  39       8.226  25.835   5.590  1.00  5.350          O  
ATOM    598  CB  GLU A  39       6.564  24.676   3.201  1.00  6.420          C  
ATOM    599  CG  GLU A  39       6.932  26.114   2.761  1.00  6.420          C  
ATOM    600  CD  GLU A  39       8.231  26.203   1.982  1.00  6.420          C  
ATOM    601  OE1 GLU A  39       8.704  25.190   1.522  1.00  6.420          O  
ATOM    602  OE2 GLU A  39       8.738  27.289   1.838  1.00  6.420          O  
ATOM    603  H   GLU A  39       6.336  22.267   3.857  1.00  5.100          H  
ATOM    604  HA  GLU A  39       8.524  24.023   3.748  1.00  5.660          H  
ATOM    605 1HB  GLU A  39       6.476  24.057   2.306  1.00  7.700          H  
ATOM    606 2HB  GLU A  39       5.573  24.721   3.655  1.00  7.700          H  
ATOM    607 1HG  GLU A  39       6.130  26.484   2.128  1.00  7.700          H  
ATOM    608 2HG  GLU A  39       6.985  26.764   3.630  1.00  7.700          H  
ATOM    609  N   LEU A  40       6.852  24.332   6.519  1.00  4.490          N  
ATOM    610  CA  LEU A  40       6.780  25.023   7.796  1.00  5.040          C  
ATOM    611  C   LEU A  40       7.936  24.625   8.705  1.00  5.420          C  
ATOM    612  O   LEU A  40       8.020  25.084   9.847  1.00  5.940          O  
ATOM    613  CB  LEU A  40       5.456  24.688   8.496  1.00  6.840          C  
ATOM    614  CG  LEU A  40       4.155  25.130   7.793  1.00  6.840          C  
ATOM    615  CD1 LEU A  40       2.975  24.549   8.548  1.00  6.840          C  
ATOM    616  CD2 LEU A  40       4.055  26.657   7.753  1.00  6.840          C  
ATOM    617  H   LEU A  40       6.370  23.432   6.437  1.00  5.390          H  
ATOM    618  HA  LEU A  40       6.852  26.090   7.614  1.00  6.050          H  
ATOM    619 1HB  LEU A  40       5.406  23.608   8.614  1.00  8.200          H  
ATOM    620 2HB  LEU A  40       5.466  25.141   9.483  1.00  8.200          H  
ATOM    621  HG  LEU A  40       4.143  24.741   6.785  1.00  8.200          H  
ATOM    622 1HD1 LEU A  40       2.050  24.838   8.050  1.00  8.200          H  
ATOM    623 2HD1 LEU A  40       3.056  23.462   8.562  1.00  8.200          H  
ATOM    624 3HD1 LEU A  40       2.975  24.926   9.557  1.00  8.200          H  
ATOM    625 1HD2 LEU A  40       3.124  26.941   7.260  1.00  8.200          H  
ATOM    626 2HD2 LEU A  40       4.061  27.047   8.771  1.00  8.200          H  
ATOM    627 3HD2 LEU A  40       4.888  27.076   7.198  1.00  8.200          H  
ATOM    628  N   ASN A  41       8.813  23.741   8.211  1.00  5.480          N  
ATOM    629  CA  ASN A  41       9.968  23.233   8.936  1.00  6.100          C  
ATOM    630  C   ASN A  41       9.589  22.572  10.253  1.00  6.110          C  
ATOM    631  O   ASN A  41      10.294  22.697  11.253  1.00  6.570          O  
ATOM    632  CB  ASN A  41      10.969  24.348   9.169  1.00  8.290          C  
ATOM    633  CG  ASN A  41      11.499  24.910   7.881  1.00  8.290          C  
ATOM    634  OD1 ASN A  41      11.823  24.172   6.940  1.00  8.290          O  
ATOM    635  ND2 ASN A  41      11.599  26.215   7.819  1.00  8.290          N  
ATOM    636  H   ASN A  41       8.685  23.385   7.258  1.00  6.580          H  
ATOM    637  HA  ASN A  41      10.440  22.470   8.314  1.00  7.320          H  
ATOM    638 1HB  ASN A  41      10.517  25.151   9.749  1.00  9.950          H  
ATOM    639 2HB  ASN A  41      11.809  23.966   9.749  1.00  9.950          H  
ATOM    640 1HD2 ASN A  41      11.945  26.653   6.988  1.00  9.950          H  
ATOM    641 2HD2 ASN A  41      11.326  26.775   8.602  1.00  9.950          H  
ATOM    642  N   ARG A  42       8.491  21.818  10.238  1.00  5.950          N  
ATOM    643  CA  ARG A  42       8.010  21.116  11.423  1.00  6.330          C  
ATOM    644  C   ARG A  42       8.385  19.637  11.420  1.00  6.170          C  
ATOM    645  O   ARG A  42       7.908  18.870  12.254  1.00  6.250          O  
ATOM    646  CB  ARG A  42       6.507  21.277  11.557  1.00  8.710          C  
ATOM    647  CG  ARG A  42       6.065  22.714  11.794  1.00  8.710          C  
ATOM    648  CD  ARG A  42       4.602  22.838  11.934  1.00  8.710          C  
ATOM    649  NE  ARG A  42       4.199  24.223  12.155  1.00  8.710          N  
ATOM    650  CZ  ARG A  42       2.938  24.633  12.418  1.00  8.710          C  
ATOM    651  NH1 ARG A  42       1.956  23.756  12.496  1.00  8.710          N  
ATOM    652  NH2 ARG A  42       2.689  25.922  12.594  1.00  8.710          N  
ATOM    653  H   ARG A  42       7.966  21.747   9.375  1.00  7.140          H  
ATOM    654  HA  ARG A  42       8.469  21.578  12.298  1.00  7.600          H  
ATOM    655 1HB  ARG A  42       6.018  20.922  10.651  1.00 10.450          H  
ATOM    656 2HB  ARG A  42       6.146  20.672  12.388  1.00 10.450          H  
ATOM    657 1HG  ARG A  42       6.528  23.089  12.706  1.00 10.450          H  
ATOM    658 2HG  ARG A  42       6.381  23.326  10.960  1.00 10.450          H  
ATOM    659 1HD  ARG A  42       4.125  22.483  11.019  1.00 10.450          H  
ATOM    660 2HD  ARG A  42       4.271  22.241  12.780  1.00 10.450          H  
ATOM    661  HE  ARG A  42       4.922  24.934  12.098  1.00 10.450          H  
ATOM    662 1HH1 ARG A  42       2.138  22.772  12.363  1.00 10.450          H  
ATOM    663 2HH1 ARG A  42       1.014  24.066  12.691  1.00 10.450          H  
ATOM    664 1HH2 ARG A  42       3.439  26.595  12.531  1.00 10.450          H  
ATOM    665 2HH2 ARG A  42       1.748  26.234  12.790  1.00 10.450          H  
ATOM    666  N   GLN A  43       9.233  19.245  10.470  1.00  6.230          N  
ATOM    667  CA  GLN A  43       9.708  17.867  10.325  1.00  6.260          C  
ATOM    668  C   GLN A  43       8.577  16.851  10.214  1.00  5.640          C  
ATOM    669  O   GLN A  43       8.601  15.823  10.883  1.00  5.640          O  
ATOM    670  CB  GLN A  43      10.606  17.480  11.511  1.00  8.750          C  
ATOM    671  CG  GLN A  43      11.846  18.344  11.672  1.00  8.750          C  
ATOM    672  CD  GLN A  43      12.737  17.887  12.826  1.00  8.750          C  
ATOM    673  OE1 GLN A  43      13.005  16.693  12.996  1.00  8.750          O  
ATOM    674  NE2 GLN A  43      13.202  18.841  13.626  1.00  8.750          N  
ATOM    675  H   GLN A  43       9.568  19.949   9.830  1.00  7.480          H  
ATOM    676  HA  GLN A  43      10.296  17.805   9.409  1.00  7.510          H  
ATOM    677 1HB  GLN A  43      10.038  17.526  12.438  1.00 10.500          H  
ATOM    678 2HB  GLN A  43      10.937  16.448  11.388  1.00 10.500          H  
ATOM    679 1HG  GLN A  43      12.424  18.304  10.753  1.00 10.500          H  
ATOM    680 2HG  GLN A  43      11.531  19.369  11.872  1.00 10.500          H  
ATOM    681 1HE2 GLN A  43      13.792  18.603  14.400  1.00 10.500          H  
ATOM    682 2HE2 GLN A  43      12.962  19.799  13.457  1.00 10.500          H  
ATOM    683  N   CYS A  44       7.593  17.125   9.365  1.00  5.440          N  
ATOM    684  CA  CYS A  44       6.497  16.191   9.205  1.00  5.160          C  
ATOM    685  C   CYS A  44       6.963  14.934   8.514  1.00  5.080          C  
ATOM    686  O   CYS A  44       7.845  14.975   7.661  1.00  5.330          O  
ATOM    687  CB  CYS A  44       5.389  16.782   8.336  1.00  7.340          C  
ATOM    688  SG  CYS A  44       5.865  16.946   6.572  1.00  7.340          S  
ATOM    689  H   CYS A  44       7.617  17.984   8.839  1.00  6.530          H  
ATOM    690  HA  CYS A  44       6.103  15.936  10.190  1.00  6.190          H  
ATOM    691 1HB  CYS A  44       4.515  16.130   8.382  1.00  8.800          H  
ATOM    692 2HB  CYS A  44       5.097  17.761   8.710  1.00  8.800          H  
ATOM    693  HG  CYS A  44       6.727  15.891   6.540  1.00  8.800          H  
ATOM    694  N   TRP A  45       6.285  13.847   8.789  1.00  5.150          N  
ATOM    695  CA  TRP A  45       6.541  12.591   8.123  1.00  5.390          C  
ATOM    696  C   TRP A  45       5.659  12.523   6.897  1.00  5.220          C  
ATOM    697  O   TRP A  45       4.537  13.022   6.918  1.00  5.430          O  
ATOM    698  CB  TRP A  45       6.231  11.442   9.085  1.00  7.450          C  
ATOM    699  CG  TRP A  45       7.219  11.304  10.196  1.00  7.450          C  
ATOM    700  CD1 TRP A  45       8.263  10.422  10.254  1.00  7.450          C  
ATOM    701  CD2 TRP A  45       7.268  12.059  11.433  1.00  7.450          C  
ATOM    702  NE1 TRP A  45       8.950  10.579  11.426  1.00  7.450          N  
ATOM    703  CE2 TRP A  45       8.360  11.573  12.160  1.00  7.450          C  
ATOM    704  CE3 TRP A  45       6.481  13.080  11.982  1.00  7.450          C  
ATOM    705  CZ2 TRP A  45       8.690  12.076  13.400  1.00  7.450          C  
ATOM    706  CZ3 TRP A  45       6.815  13.582  13.220  1.00  7.450          C  
ATOM    707  CH2 TRP A  45       7.890  13.093  13.914  1.00  7.450          C  
ATOM    708  H   TRP A  45       5.604  13.897   9.527  1.00  6.180          H  
ATOM    709  HA  TRP A  45       7.588  12.549   7.817  1.00  6.470          H  
ATOM    710 1HB  TRP A  45       5.272  11.635   9.539  1.00  8.940          H  
ATOM    711 2HB  TRP A  45       6.137  10.508   8.567  1.00  8.940          H  
ATOM    712  HD1 TRP A  45       8.512   9.693   9.489  1.00  8.940          H  
ATOM    713  HE1 TRP A  45       9.760  10.041  11.710  1.00  8.940          H  
ATOM    714  HE3 TRP A  45       5.631  13.475  11.459  1.00  8.940          H  
ATOM    715  HZ2 TRP A  45       9.538  11.699  13.971  1.00  8.940          H  
ATOM    716  HZ3 TRP A  45       6.200  14.379  13.635  1.00  8.940          H  
ATOM    717  HH2 TRP A  45       8.123  13.514  14.889  1.00  8.940          H  
ATOM    718  N   VAL A  46       6.147  11.935   5.823  1.00  5.240          N  
ATOM    719  CA  VAL A  46       5.317  11.761   4.646  1.00  5.510          C  
ATOM    720  C   VAL A  46       5.436  10.283   4.283  1.00  5.630          C  
ATOM    721  O   VAL A  46       6.524   9.818   3.942  1.00  5.990          O  
ATOM    722  CB  VAL A  46       5.814  12.682   3.520  1.00  7.610          C  
ATOM    723  CG1 VAL A  46       4.898  12.560   2.308  1.00  7.610          C  
ATOM    724  CG2 VAL A  46       5.920  14.112   4.045  1.00  7.610          C  
ATOM    725  H   VAL A  46       7.076  11.541   5.840  1.00  6.290          H  
ATOM    726  HA  VAL A  46       4.274  11.989   4.877  1.00  6.610          H  
ATOM    727  HB  VAL A  46       6.803  12.357   3.201  1.00  9.130          H  
ATOM    728 1HG1 VAL A  46       5.259  13.201   1.504  1.00  9.130          H  
ATOM    729 2HG1 VAL A  46       4.867  11.529   1.963  1.00  9.130          H  
ATOM    730 3HG1 VAL A  46       3.902  12.869   2.592  1.00  9.130          H  
ATOM    731 1HG2 VAL A  46       6.295  14.746   3.261  1.00  9.130          H  
ATOM    732 2HG2 VAL A  46       4.942  14.452   4.377  1.00  9.130          H  
ATOM    733 3HG2 VAL A  46       6.613  14.165   4.880  1.00  9.130          H  
ATOM    734  N   LEU A  47       4.344   9.535   4.375  1.00  5.710          N  
ATOM    735  CA  LEU A  47       4.434   8.091   4.174  1.00  6.200          C  
ATOM    736  C   LEU A  47       3.212   7.609   3.404  1.00  6.390          C  
ATOM    737  O   LEU A  47       2.085   7.632   3.923  1.00  6.490          O  
ATOM    738  CB  LEU A  47       4.520   7.447   5.571  1.00  8.480          C  
ATOM    739  CG  LEU A  47       4.741   5.948   5.704  1.00  8.480          C  
ATOM    740  CD1 LEU A  47       6.105   5.567   5.085  1.00  8.480          C  
ATOM    741  CD2 LEU A  47       4.745   5.593   7.170  1.00  8.480          C  
ATOM    742  H   LEU A  47       3.450   9.981   4.608  1.00  6.850          H  
ATOM    743  HA  LEU A  47       5.326   7.874   3.590  1.00  7.440          H  
ATOM    744 1HB  LEU A  47       5.261   7.949   6.144  1.00 10.180          H  
ATOM    745 2HB  LEU A  47       3.569   7.646   6.047  1.00 10.180          H  
ATOM    746  HG  LEU A  47       3.957   5.415   5.214  1.00 10.180          H  
ATOM    747 1HD1 LEU A  47       6.287   4.506   5.202  1.00 10.180          H  
ATOM    748 2HD1 LEU A  47       6.127   5.808   4.026  1.00 10.180          H  
ATOM    749 3HD1 LEU A  47       6.892   6.110   5.590  1.00 10.180          H  
ATOM    750 1HD2 LEU A  47       4.912   4.522   7.283  1.00 10.180          H  
ATOM    751 2HD2 LEU A  47       5.548   6.143   7.659  1.00 10.180          H  
ATOM    752 3HD2 LEU A  47       3.788   5.859   7.613  1.00 10.180          H  
ATOM    753  N   GLY A  48       3.407   7.140   2.176  1.00  6.770          N  
ATOM    754  CA  GLY A  48       2.256   6.853   1.362  1.00  7.210          C  
ATOM    755  C   GLY A  48       1.540   8.178   1.240  1.00  6.690          C  
ATOM    756  O   GLY A  48       2.193   9.219   1.218  1.00  6.780          O  
ATOM    757  H   GLY A  48       4.331   6.991   1.773  1.00  8.120          H  
ATOM    758 1HA  GLY A  48       2.554   6.482   0.380  1.00  8.650          H  
ATOM    759 2HA  GLY A  48       1.615   6.115   1.838  1.00  8.650          H  
ATOM    760  N   HIS A  49       0.222   8.152   1.209  1.00  6.490          N  
ATOM    761  CA  HIS A  49      -0.535   9.390   1.097  1.00  6.350          C  
ATOM    762  C   HIS A  49      -0.751  10.092   2.446  1.00  5.590          C  
ATOM    763  O   HIS A  49      -1.491  11.086   2.503  1.00  5.880          O  
ATOM    764  CB  HIS A  49      -1.899   9.249   0.432  1.00  8.950          C  
ATOM    765  CG  HIS A  49      -2.872   8.489   1.167  1.00  8.950          C  
ATOM    766  ND1 HIS A  49      -3.017   7.138   1.037  1.00  8.950          N  
ATOM    767  CD2 HIS A  49      -3.762   8.892   2.090  1.00  8.950          C  
ATOM    768  CE1 HIS A  49      -3.984   6.739   1.834  1.00  8.950          C  
ATOM    769  NE2 HIS A  49      -4.451   7.799   2.489  1.00  8.950          N  
ATOM    770  H   HIS A  49      -0.224   7.231   1.173  1.00  7.790          H  
ATOM    771  HA  HIS A  49       0.016  10.053   0.454  1.00  7.620          H  
ATOM    772 1HB  HIS A  49      -2.310  10.240   0.257  1.00 10.740          H  
ATOM    773 2HB  HIS A  49      -1.766   8.775  -0.543  1.00 10.740          H  
ATOM    774  HD1 HIS A  49      -2.681   6.611   0.208  1.00 10.740          H  
ATOM    775  HD2 HIS A  49      -3.989   9.873   2.518  1.00 10.740          H  
ATOM    776  HE1 HIS A  49      -4.264   5.689   1.871  1.00 10.740          H  
ATOM    777  N   TRP A  50      -0.207   9.550   3.540  1.00  4.980          N  
ATOM    778  CA  TRP A  50      -0.426  10.149   4.846  1.00  4.620          C  
ATOM    779  C   TRP A  50       0.651  11.128   5.278  1.00  4.390          C  
ATOM    780  O   TRP A  50       1.847  10.980   5.007  1.00  4.580          O  
ATOM    781  CB  TRP A  50      -0.592   9.124   5.953  1.00  6.610          C  
ATOM    782  CG  TRP A  50      -1.858   8.371   5.955  1.00  6.610          C  
ATOM    783  CD1 TRP A  50      -2.994   8.736   6.621  1.00  6.610          C  
ATOM    784  CD2 TRP A  50      -2.135   7.102   5.348  1.00  6.610          C  
ATOM    785  NE1 TRP A  50      -3.965   7.813   6.451  1.00  6.610          N  
ATOM    786  CE2 TRP A  50      -3.460   6.780   5.679  1.00  6.610          C  
ATOM    787  CE3 TRP A  50      -1.377   6.216   4.571  1.00  6.610          C  
ATOM    788  CZ2 TRP A  50      -4.051   5.602   5.261  1.00  6.610          C  
ATOM    789  CZ3 TRP A  50      -1.966   5.034   4.153  1.00  6.610          C  
ATOM    790  CH2 TRP A  50      -3.271   4.732   4.490  1.00  6.610          C  
ATOM    791  H   TRP A  50       0.412   8.737   3.461  1.00  5.980          H  
ATOM    792  HA  TRP A  50      -1.355  10.689   4.797  1.00  5.540          H  
ATOM    793 1HB  TRP A  50       0.220   8.405   5.883  1.00  7.930          H  
ATOM    794 2HB  TRP A  50      -0.519   9.634   6.903  1.00  7.930          H  
ATOM    795  HD1 TRP A  50      -3.116   9.642   7.209  1.00  7.930          H  
ATOM    796  HE1 TRP A  50      -4.930   7.922   6.875  1.00  7.930          H  
ATOM    797  HE3 TRP A  50      -0.344   6.450   4.303  1.00  7.930          H  
ATOM    798  HZ2 TRP A  50      -5.080   5.352   5.516  1.00  7.930          H  
ATOM    799  HZ3 TRP A  50      -1.371   4.350   3.549  1.00  7.930          H  
ATOM    800  HH2 TRP A  50      -3.702   3.796   4.143  1.00  7.930          H  
ATOM    801  N   VAL A  51       0.220  12.127   6.030  1.00  4.440          N  
ATOM    802  CA  VAL A  51       1.136  13.140   6.510  1.00  4.760          C  
ATOM    803  C   VAL A  51       1.142  13.188   8.034  1.00  4.960          C  
ATOM    804  O   VAL A  51       0.089  13.216   8.664  1.00  5.310          O  
ATOM    805  CB  VAL A  51       0.736  14.497   5.915  1.00  6.540          C  
ATOM    806  CG1 VAL A  51       1.716  15.613   6.379  1.00  6.540          C  
ATOM    807  CG2 VAL A  51       0.679  14.354   4.428  1.00  6.540          C  
ATOM    808  H   VAL A  51      -0.765  12.187   6.251  1.00  5.330          H  
ATOM    809  HA  VAL A  51       2.142  12.899   6.166  1.00  5.710          H  
ATOM    810  HB  VAL A  51      -0.238  14.767   6.264  1.00  7.840          H  
ATOM    811 1HG1 VAL A  51       1.403  16.570   5.954  1.00  7.840          H  
ATOM    812 2HG1 VAL A  51       1.709  15.694   7.461  1.00  7.840          H  
ATOM    813 3HG1 VAL A  51       2.732  15.375   6.041  1.00  7.840          H  
ATOM    814 1HG2 VAL A  51       0.385  15.294   3.978  1.00  7.840          H  
ATOM    815 2HG2 VAL A  51       1.655  14.058   4.108  1.00  7.840          H  
ATOM    816 3HG2 VAL A  51      -0.041  13.596   4.136  1.00  7.840          H  
ATOM    817  N   GLY A  52       2.342  13.173   8.609  1.00  5.180          N  
ATOM    818  CA  GLY A  52       2.534  13.220  10.058  1.00  5.800          C  
ATOM    819  C   GLY A  52       2.328  11.878  10.773  1.00  5.770          C  
ATOM    820  O   GLY A  52       1.985  11.861  11.954  1.00  6.220          O  
ATOM    821  H   GLY A  52       3.137  13.148   7.978  1.00  6.220          H  
ATOM    822 1HA  GLY A  52       3.535  13.588  10.267  1.00  6.960          H  
ATOM    823 2HA  GLY A  52       1.847  13.954  10.476  1.00  6.960          H  
ATOM    824  N   THR A  53       2.541  10.760  10.063  1.00  5.670          N  
ATOM    825  CA  THR A  53       2.342   9.411  10.605  1.00  6.110          C  
ATOM    826  C   THR A  53       3.301   9.011  11.715  1.00  6.230          C  
ATOM    827  O   THR A  53       2.945   8.239  12.606  1.00  6.590          O  
ATOM    828  CB  THR A  53       2.562   8.358   9.510  1.00  8.380          C  
ATOM    829  OG1 THR A  53       3.932   8.441   9.044  1.00  8.380          O  
ATOM    830  CG2 THR A  53       1.639   8.619   8.361  1.00  8.380          C  
ATOM    831  H   THR A  53       2.842  10.833   9.102  1.00  6.800          H  
ATOM    832  HA  THR A  53       1.324   9.343  10.990  1.00  7.330          H  
ATOM    833  HB  THR A  53       2.376   7.362   9.915  1.00 10.050          H  
ATOM    834  HG1 THR A  53       4.078   7.739   8.391  1.00 10.050          H  
ATOM    835 1HG2 THR A  53       1.803   7.869   7.592  1.00 10.050          H  
ATOM    836 2HG2 THR A  53       0.613   8.558   8.717  1.00 10.050          H  
ATOM    837 3HG2 THR A  53       1.821   9.607   7.942  1.00 10.050          H  
ATOM    838  N   GLY A  54       4.530   9.503  11.653  1.00  6.290          N  
ATOM    839  CA  GLY A  54       5.546   9.130  12.635  1.00  6.770          C  
ATOM    840  C   GLY A  54       6.219   7.801  12.280  1.00  6.390          C  
ATOM    841  O   GLY A  54       6.969   7.242  13.083  1.00  6.710          O  
ATOM    842  H   GLY A  54       4.754  10.117  10.885  1.00  7.550          H  
ATOM    843 1HA  GLY A  54       6.289   9.905  12.719  1.00  8.120          H  
ATOM    844 2HA  GLY A  54       5.079   9.047  13.614  1.00  8.120          H  
ATOM    845  N   GLY A  55       5.927   7.288  11.080  1.00  6.030          N  
ATOM    846  CA  GLY A  55       6.435   5.998  10.628  1.00  6.050          C  
ATOM    847  C   GLY A  55       7.759   6.006   9.861  1.00  5.690          C  
ATOM    848  O   GLY A  55       8.570   6.937   9.928  1.00  6.110          O  
ATOM    849  H   GLY A  55       5.299   7.814  10.479  1.00  7.240          H  
ATOM    850 1HA  GLY A  55       6.543   5.350  11.499  1.00  7.260          H  
ATOM    851 2HA  GLY A  55       5.673   5.529  10.010  1.00  7.260          H  
ATOM    852  N   LEU A  56       7.966   4.936   9.098  1.00  5.280          N  
ATOM    853  CA  LEU A  56       9.215   4.699   8.381  1.00  5.300          C  
ATOM    854  C   LEU A  56       9.372   5.495   7.099  1.00  4.810          C  
ATOM    855  O   LEU A  56       9.252   4.959   5.996  1.00  5.210          O  
ATOM    856  CB  LEU A  56       9.331   3.208   8.046  1.00  7.410          C  
ATOM    857  CG  LEU A  56       9.330   2.206   9.248  1.00  7.410          C  
ATOM    858  CD1 LEU A  56       9.352   0.787   8.696  1.00  7.410          C  
ATOM    859  CD2 LEU A  56      10.542   2.448  10.155  1.00  7.410          C  
ATOM    860  H   LEU A  56       7.244   4.233   9.052  1.00  6.340          H  
ATOM    861  HA  LEU A  56      10.036   4.991   9.032  1.00  6.360          H  
ATOM    862 1HB  LEU A  56       8.498   2.942   7.394  1.00  8.890          H  
ATOM    863 2HB  LEU A  56      10.255   3.054   7.490  1.00  8.890          H  
ATOM    864  HG  LEU A  56       8.419   2.329   9.828  1.00  8.890          H  
ATOM    865 1HD1 LEU A  56       9.337   0.073   9.520  1.00  8.890          H  
ATOM    866 2HD1 LEU A  56       8.478   0.628   8.065  1.00  8.890          H  
ATOM    867 3HD1 LEU A  56      10.256   0.640   8.107  1.00  8.890          H  
ATOM    868 1HD2 LEU A  56      10.523   1.732  10.978  1.00  8.890          H  
ATOM    869 2HD2 LEU A  56      11.460   2.315   9.582  1.00  8.890          H  
ATOM    870 3HD2 LEU A  56      10.515   3.452  10.566  1.00  8.890          H  
ATOM    871  N   VAL A  57       9.659   6.776   7.264  1.00  4.360          N  
ATOM    872  CA  VAL A  57       9.812   7.692   6.145  1.00  4.220          C  
ATOM    873  C   VAL A  57      11.280   7.890   5.760  1.00  4.510          C  
ATOM    874  O   VAL A  57      12.064   8.341   6.593  1.00  4.710          O  
ATOM    875  CB  VAL A  57       9.212   9.045   6.497  1.00  5.960          C  
ATOM    876  CG1 VAL A  57       9.408  10.039   5.362  1.00  5.960          C  
ATOM    877  CG2 VAL A  57       7.793   8.838   6.734  1.00  5.960          C  
ATOM    878  H   VAL A  57       9.710   7.094   8.238  1.00  5.230          H  
ATOM    879  HA  VAL A  57       9.220   7.305   5.329  1.00  5.060          H  
ATOM    880  HB  VAL A  57       9.694   9.447   7.385  1.00  7.160          H  
ATOM    881 1HG1 VAL A  57       8.956  10.976   5.636  1.00  7.160          H  
ATOM    882 2HG1 VAL A  57      10.470  10.197   5.174  1.00  7.160          H  
ATOM    883 3HG1 VAL A  57       8.938   9.662   4.456  1.00  7.160          H  
ATOM    884 1HG2 VAL A  57       7.344   9.756   6.966  1.00  7.160          H  
ATOM    885 2HG2 VAL A  57       7.373   8.443   5.826  1.00  7.160          H  
ATOM    886 3HG2 VAL A  57       7.634   8.135   7.549  1.00  7.160          H  
ATOM    887  N   PRO A  58      11.683   7.584   4.516  1.00  5.030          N  
ATOM    888  CA  PRO A  58      13.032   7.734   4.004  1.00  5.730          C  
ATOM    889  C   PRO A  58      13.544   9.170   4.043  1.00  5.670          C  
ATOM    890  O   PRO A  58      12.782  10.137   3.850  1.00  5.720          O  
ATOM    891  CB  PRO A  58      12.898   7.266   2.548  1.00  8.600          C  
ATOM    892  CG  PRO A  58      11.697   6.363   2.532  1.00  8.600          C  
ATOM    893  CD  PRO A  58      10.753   6.934   3.556  1.00  8.600          C  
ATOM    894  HA  PRO A  58      13.703   7.070   4.571  1.00  6.880          H  
ATOM    895 1HB  PRO A  58      12.800   8.140   1.885  1.00 10.310          H  
ATOM    896 2HB  PRO A  58      13.818   6.746   2.240  1.00 10.310          H  
ATOM    897 1HG  PRO A  58      11.259   6.333   1.523  1.00 10.310          H  
ATOM    898 2HG  PRO A  58      11.996   5.331   2.773  1.00 10.310          H  
ATOM    899 1HD  PRO A  58      10.053   7.658   3.115  1.00 10.310          H  
ATOM    900 2HD  PRO A  58      10.248   6.065   4.001  1.00 10.310          H  
ATOM    901  N   ARG A  59      14.848   9.309   4.239  1.00  6.020          N  
ATOM    902  CA  ARG A  59      15.450  10.623   4.219  1.00  6.430          C  
ATOM    903  C   ARG A  59      15.254  11.194   2.832  1.00  6.490          C  
ATOM    904  O   ARG A  59      15.542  10.538   1.834  1.00  6.890          O  
ATOM    905  CB  ARG A  59      16.933  10.555   4.555  1.00  8.840          C  
ATOM    906  CG  ARG A  59      17.637  11.903   4.663  1.00  8.840          C  
ATOM    907  CD  ARG A  59      19.048  11.750   5.088  1.00  8.840          C  
ATOM    908  NE  ARG A  59      19.728  13.038   5.179  1.00  8.840          N  
ATOM    909  CZ  ARG A  59      21.008  13.219   5.576  1.00  8.840          C  
ATOM    910  NH1 ARG A  59      21.755  12.188   5.920  1.00  8.840          N  
ATOM    911  NH2 ARG A  59      21.512  14.443   5.618  1.00  8.840          N  
ATOM    912  H   ARG A  59      15.422   8.494   4.401  1.00  7.220          H  
ATOM    913  HA  ARG A  59      14.946  11.260   4.947  1.00  7.720          H  
ATOM    914 1HB  ARG A  59      17.065  10.038   5.504  1.00 10.610          H  
ATOM    915 2HB  ARG A  59      17.450   9.975   3.791  1.00 10.610          H  
ATOM    916 1HG  ARG A  59      17.634  12.399   3.692  1.00 10.610          H  
ATOM    917 2HG  ARG A  59      17.125  12.528   5.394  1.00 10.610          H  
ATOM    918 1HD  ARG A  59      19.079  11.273   6.067  1.00 10.610          H  
ATOM    919 2HD  ARG A  59      19.574  11.133   4.359  1.00 10.610          H  
ATOM    920  HE  ARG A  59      19.198  13.863   4.924  1.00 10.610          H  
ATOM    921 1HH1 ARG A  59      21.377  11.253   5.891  1.00 10.610          H  
ATOM    922 2HH1 ARG A  59      22.710  12.332   6.217  1.00 10.610          H  
ATOM    923 1HH2 ARG A  59      20.940  15.235   5.355  1.00 10.610          H  
ATOM    924 2HH2 ARG A  59      22.466  14.589   5.914  1.00 10.610          H  
ATOM    925  N   GLY A  60      14.747  12.414   2.776  1.00  6.440          N  
ATOM    926  CA  GLY A  60      14.470  13.094   1.520  1.00  6.910          C  
ATOM    927  C   GLY A  60      13.011  12.940   1.080  1.00  6.580          C  
ATOM    928  O   GLY A  60      12.541  13.702   0.237  1.00  7.020          O  
ATOM    929  H   GLY A  60      14.545  12.891   3.643  1.00  7.730          H  
ATOM    930 1HA  GLY A  60      14.708  14.153   1.624  1.00  8.290          H  
ATOM    931 2HA  GLY A  60      15.126  12.698   0.745  1.00  8.290          H  
ATOM    932  N   SER A  61      12.273  11.985   1.668  1.00  6.190          N  
ATOM    933  CA  SER A  61      10.863  11.798   1.322  1.00  6.310          C  
ATOM    934  C   SER A  61      10.045  12.612   2.298  1.00  6.360          C  
ATOM    935  O   SER A  61       9.026  13.209   1.958  1.00  6.610          O  
ATOM    936  CB  SER A  61      10.466  10.330   1.351  1.00  8.790          C  
ATOM    937  OG  SER A  61      11.116   9.612   0.332  1.00  8.790          O  
ATOM    938  H   SER A  61      12.683  11.363   2.367  1.00  7.430          H  
ATOM    939  HA  SER A  61      10.686  12.179   0.316  1.00  7.570          H  
ATOM    940 1HB  SER A  61      10.728   9.908   2.319  1.00 10.540          H  
ATOM    941 2HB  SER A  61       9.393  10.235   1.239  1.00 10.540          H  
ATOM    942  HG  SER A  61      10.805   8.709   0.399  1.00 10.540          H  
ATOM    943  N   ALA A  62      10.577  12.769   3.509  1.00  6.500          N  
ATOM    944  CA  ALA A  62       9.901  13.583   4.538  1.00  6.890          C  
ATOM    945  C   ALA A  62       9.744  15.027   4.043  1.00  7.010          C  
ATOM    946  O   ALA A  62       8.868  15.767   4.475  1.00  7.480          O  
ATOM    947  CB  ALA A  62      10.667  13.571   5.847  1.00  9.490          C  
ATOM    948  H   ALA A  62      11.416  12.218   3.722  1.00  7.800          H  
ATOM    949  HA  ALA A  62       8.905  13.172   4.701  1.00  8.270          H  
ATOM    950 1HB  ALA A  62      10.122  14.175   6.583  1.00 11.390          H  
ATOM    951 2HB  ALA A  62      10.763  12.555   6.213  1.00 11.390          H  
ATOM    952 3HB  ALA A  62      11.655  13.994   5.691  1.00 11.390          H  
ATOM    953  N   ALA A  63      10.649  15.410   3.141  1.00  6.950          N  
ATOM    954  CA  ALA A  63      10.737  16.725   2.527  1.00  7.460          C  
ATOM    955  C   ALA A  63       9.474  17.094   1.754  1.00  7.930          C  
ATOM    956  O   ALA A  63       9.232  18.286   1.541  1.00  8.310          O  
ATOM    957  CB  ALA A  63      11.925  16.769   1.589  1.00 10.240          C  
ATOM    958  H   ALA A  63      11.320  14.711   2.857  1.00  8.340          H  
ATOM    959  HA  ALA A  63      10.876  17.457   3.318  1.00  8.950          H  
ATOM    960 1HB  ALA A  63      12.003  17.764   1.156  1.00 12.290          H  
ATOM    961 2HB  ALA A  63      12.835  16.536   2.137  1.00 12.290          H  
ATOM    962 3HB  ALA A  63      11.780  16.039   0.793  1.00 12.290          H  
ATOM    963  N   ALA A  64       8.729  16.082   1.288  1.00  8.220          N  
ATOM    964  CA  ALA A  64       7.489  16.206   0.528  1.00  8.980          C  
ATOM    965  C   ALA A  64       7.693  16.717  -0.902  1.00  9.470          C  
ATOM    966  O   ALA A  64       8.534  16.204  -1.641  1.00  9.970          O  
ATOM    967  OXT ALA A  64       6.836  17.462  -1.393  1.00 13.470          O  
ATOM    968  CB  ALA A  64       6.531  17.110   1.252  1.00 11.670          C  
ATOM    969  H   ALA A  64       9.012  15.131   1.536  1.00  9.860          H  
ATOM    970  HA  ALA A  64       7.041  15.215   0.479  1.00 10.780          H  
ATOM    971 1HB  ALA A  64       5.609  17.140   0.707  1.00 14.000          H  
ATOM    972 2HB  ALA A  64       6.351  16.739   2.249  1.00 14.000          H  
ATOM    973 3HB  ALA A  64       6.931  18.095   1.319  1.00 14.000          H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -313.981 34.488 248.9 -21.8088 4.60922 18.9097 117.948 -133.051 -0.46285 -2.80033 -91.9548 -23.4056 -23.6533 -3.7046 -15.8111 -10.9746 0 -0.95463 4.88065 28.6455 61.1038 -18.2609 8.96492 -10.2486 -19.5189 36.4726 -125.669
ASP:NtermProteinFull_1 -2.54452 0.17079 4.14479 -0.23085 0.07884 0.73311 2.48892 -1.76212 -0.01417 -0.12092 -3.79075 -0.49555 0 0 -0.6948 -0.61505 0 -0.05911 0.01375 0 2.10704 0 0 -2.3716 0 0.08117 -2.88103
VAL_2 -4.35871 0.56143 2.02866 -0.29558 0.16846 0.05401 1.32041 -1.53284 -0 -0 -0.79686 0.27721 0 0 0 0 0 -0.13607 0.01915 0.40441 0 0.58102 0 1.9342 0.01003 0.39525 0.63418
SER_3 -2.06089 0.18267 3.23106 -0.03989 0.00051 0.05538 1.53017 -1.41023 -0 -0 -2.63686 -0.29165 0 0 -0.6948 -0.61505 0 -0.04738 0.03943 0.31746 0 -0.27513 1.81554 -0.77834 -0.33935 0.43172 -1.58563
GLU_4 -5.00814 0.347 6.82394 -0.5912 0.06872 0.86824 3.5153 -2.8295 -0.01417 -0.12092 -3.34993 -1.26938 0 0 -1.13709 0 0 -0.07244 0.50117 0 3.5896 0.03402 0 -2.7348 -0.53732 0.2548 -1.66211
GLU_5 -4.77073 0.46385 6.36261 -0.37377 0.17851 0.4655 2.55361 -2.61995 -0 -0 -3.1 -0.62786 0 0 0 -0.64846 0 -0.04837 0.00604 0 3.43014 -0.21782 0 -2.7348 -0.46559 0.3947 -1.75239
GLU_6 -5.28381 0.56866 6.30583 -0.58159 0.11156 1.05521 2.73479 -2.74797 -0.02092 -0.11827 -2.67219 -0.71438 0 0 -1.13709 -0.39319 0 -0.05424 0.07256 0 3.54501 -0.28534 0 -2.7348 -0.56858 0.38176 -2.53697
ASP_7 -7.32264 0.95066 9.19089 -0.15912 0.00084 0.53276 4.1029 -4.21624 -0.00656 -0.06349 -5.61765 -0.26839 0 0 -0.21995 -0.85814 0 0.2626 0.18728 0 3.26997 0.17564 0 -2.3716 -0.38044 0.54075 -2.26995
PHE_8 -8.41603 0.91558 5.83186 -0.83012 0.04652 0.2676 3.27655 -3.4892 -0.01286 -0.07008 -2.65168 -0.05106 0 0 0 0 0 -0.00535 0.02114 0 1.88461 -0.42295 0 1.0402 -0.09062 0.53976 -2.21614
ARG_9 -7.05601 0.58988 8.60894 -0.42189 0.04419 0.20544 3.46098 -3.69157 -0 -0 -4.46693 0.36185 0 0 0 -1.04166 0 0.07872 0.14498 2.09996 0 -0.19465 0 -1.2888 -0.20134 0.4806 -2.28733
LEU_10 -8.24249 0.93611 5.95742 -0.49795 0.16757 0.11478 2.84857 -3.22088 -0.01295 -0.06231 -1.48861 -0.0076 0 0 0 0 0 -0.01199 0.20278 3.3117 0 -0.29767 0 0.18072 -0.37556 0.56806 0.06968
ALA_11 -6.69049 0.92304 3.58394 -0.02282 0 0 3.28025 -3.06049 -0.01553 -0.09158 -3.08839 -0.37285 0 0 0 0 0 -0.06562 0 0 0 -0.37159 0 1.8394 -0.46381 0.57513 -4.04143
CYS_12 -6.38094 0.57678 3.28248 -0.04892 0.00807 0.02061 1.47879 -2.0254 -0 -0 -1.70985 -0.40198 0 0 0 0 0 -0.0791 0.0423 0.38103 0 0.26885 0 3.6196 -0.52428 0.71651 -0.77545
ARG_13 -7.19441 0.70736 7.78478 -0.62274 0.08344 0.36818 2.62543 -3.22331 -0.06423 -0.33863 -2.21574 0.81406 0 0 0 -0.52287 0 0.09088 0.21511 2.49851 0 -0.11836 0 -1.2888 -0.40505 0.55675 -0.24965
HIS_14 -3.48357 0.20537 3.51894 -0.88713 0.0478 1.03663 0.40189 -1.51166 -0.00852 -0.05539 -0.91864 -2.61921 0 0 0 0 0 -0.02209 0.14979 0 1.61372 -0.0815 0 -0.45461 -0.30824 0.77503 -2.60138
GLU_15 -6.26211 0.40318 7.49083 -0.21941 0.04467 0.33151 2.33151 -2.98129 -0.00927 -0.05887 -2.37408 -0.40874 0 0 0 -1.58144 0 -0.01378 0.03154 0 3.44442 -0.04124 0 -2.7348 -0.32652 0.65681 -2.27708
ARG_16 -6.03136 0.40123 4.11629 -1.52297 0.32606 1.39612 2.08272 -2.1047 -0.00108 -0.01593 -1.78066 0.25109 0 0 -1.05004 0 0 -0.03298 0.087 3.05278 0 -0.12841 0 -1.2888 -0.40953 0.40672 -2.24647
TYR_17 -5.55683 0.71416 3.21938 -0.70398 0.08708 0.4538 0.59169 -1.85565 -0.00237 -0.03827 0.48919 -0.22049 0 0 0 0 0 -0.00318 0.31562 0 2.09676 -0.39344 0.00987 1.2797 -0.37858 1.02529 1.12975
PRO_18 -5.57983 0.561 3.08525 -0.06611 0 0.04151 0.66531 -1.2664 -0.00075 -0.00348 -0.46405 0.60409 0 0 0 0 0 -0.10893 0.00912 0.21421 0 -0.36683 0 -2.4119 -0.12431 0.88115 -4.33096
THR_19 -4.06995 0.49332 2.90602 -0.14721 0.04833 0.05178 0.52174 -1.51332 -0.03015 -0.12733 0.21877 -0.31202 0 0 0 0 0 0.10321 0.00047 0.37162 0 -0.22561 2.29218 -1.0874 0.06864 0.3576 -0.0793
ARG_20 -4.5157 0.33905 5.21988 -0.77271 0.30551 0.61122 1.97908 -2.31661 -0.03022 -0.15618 -2.69974 0.36234 0 0 -0.63288 -1.05857 0 0.0149 0.14136 2.70484 0 -0.13472 0 -1.2888 -0.06857 0.40893 -1.58758
HIS_21 -2.05805 0.11821 1.75545 -0.44933 0.02014 0.56866 0.18461 -0.83742 -0 -0 0.24888 -0.46586 0 0 0 0 0 -0.09012 0.02732 0 1.59219 -0.41387 0 -0.45461 -0.30757 0.28778 -0.27358
GLN_22 -5.29922 1.14359 4.42365 -0.65367 0.13403 0.72174 1.17015 -2.02689 -0.03015 -0.12733 -0.08346 -0.66697 0 0 -0.63288 0 0 0.18372 0.10634 0 2.17732 0.00244 0 -0.18838 -0.23282 0.91657 1.03778
PRO_23 -2.56581 0.45876 2.40095 -0.07425 0 0.04501 1.0556 -1.04028 -0 -0 -1.30537 0.56446 0 0 0 0 0 -0.17662 0.01647 0.43688 0 -0.56596 0 -2.4119 -0.1938 1.205 -2.15086
HIS_24 -7.03715 0.88147 5.52261 -0.51084 0.01411 0.6901 2.72197 -2.61083 -0 -0 -0.26532 -1.8281 0 0 0 -0.87378 0 0.01827 0.35444 0 4.37904 -0.00992 0 -0.45461 -0.3386 1.19168 1.84457
MET_25 -7.40956 0.87073 4.01042 -0.33372 0.05408 0.13916 1.78434 -1.98077 -0.00238 -0.03831 -0.05105 -0.37546 0 0 0 0 0 -0.02085 0.12934 1.62348 0 0.18901 0 0.60916 0.09223 1.09323 0.38306
GLY_26 -1.67925 0.14558 2.45505 -5e-05 0 0 1.53065 -1.17519 -0 -0 -0.75689 -0.41209 0 0 0 0 0 0.03803 0 0 0 0.23401 0 0.83697 0.32885 0.43486 1.98052
ASP_27 -4.2181 0.41512 6.89286 -0.25496 0.1153 0.86052 2.64164 -2.90308 -0.03277 -0.11609 -3.27499 -3.72916 0 0 -0.39696 -0.51724 0 -0.03952 0.19761 0 2.51947 -0.37737 0 -2.3716 -0.30367 0.59998 -4.293
SER_28 -2.17999 0.24398 2.87698 -0.02957 0.03694 0.03057 1.1592 -1.32111 -0 -0 -0.79129 0.06452 0 0 0 0 0 0.16392 0.00292 0.05389 0 0.40498 0.601 -0.77834 -0.14587 0.70995 1.10267
TRP_29 -10.998 1.33701 6.71736 -0.85371 0.00634 0.0472 3.62774 -3.48782 -0.03278 -0.11613 -2.5823 -0.37995 0 0 -1.12232 0 0 0.04129 0.23324 0 2.32724 -0.06009 0 1.6906 -0.07626 1.9183 -1.76304
PRO_30 -5.1085 1.00167 3.43474 -0.19656 0.00427 0.1429 1.56748 -1.47677 -0 -0 0.30298 0.02513 0 0 0 0 0 -0.0219 0.0003 0.5726 0 -1.00033 0 -2.4119 -0.57181 1.90974 -1.82596
ARG_31 -3.07384 0.1925 2.77488 -0.76279 0.1021 0.5042 1.2722 -1.25862 -0.00146 -0.02261 -1.36644 0.31306 0 0 -1.05004 0 0 -0.0399 0.00425 1.44095 0 -0.11345 0 -1.2888 -0.50117 0.39993 -2.47503
SER_32 -3.53191 0.16925 3.75063 -0.0281 0 0.06419 1.34789 -1.71993 -0 -0 -0.06594 -0.45695 0 0 0 0 0 0.00027 0.0204 0.23914 0 -0.34412 0.62729 -0.77834 -0.5386 0.17597 -1.06887
SER_33 -6.18246 0.40597 6.89757 -0.02743 0 0.06422 3.84434 -3.21044 -0 -0 -3.60469 -0.54733 0 0 -1.72423 0 0 -0.01071 0.06628 0.16715 0 -0.47087 0.64992 -0.77834 -0.55369 0.18488 -4.82986
ALA_34 -6.7299 1.16541 1.56285 -0.02426 0 0 2.19152 -2.47168 -0.00014 -0.00186 -1.96386 -0.37454 0 0 0 0 0 -0.05004 0 0 0 -0.34851 0 1.8394 -0.53042 0.38113 -5.35491
HIS_D_35 -5.34539 0.56513 5.20334 -0.63463 0.01172 0.63087 2.67465 -2.70074 -0.01821 -0.13354 -1.60744 -0.35618 0 0 -0.48342 0 0 0.00477 0.30672 0 1.67717 -0.19065 0 -0.45461 -0.23265 0.40073 -0.68236
GLU_36 -5.39731 0.2982 6.70712 -0.21307 0.04093 0.32409 3.05506 -2.91139 -0.00254 -0.03854 -2.43529 -0.60311 0 0 -1.72423 0 0 0.04619 0.23895 0 3.13449 -0.28488 0 -2.7348 -0.26228 0.27148 -2.49095
ALA_37 -5.11603 0.31342 4.16334 -0.02121 0 0 2.42171 -2.56853 -0.0104 -0.04001 -2.30679 -0.32068 0 0 0 0 0 -0.02635 0 0 0 0.07923 0 1.8394 -0.25573 0.25414 -1.59451
ALA_38 -4.56655 0.27614 3.4802 -0.02156 0 0 2.5041 -2.35833 -0 -0 -2.61711 -0.36081 0 0 0 0 0 -0.03364 0 0 0 -0.33623 0 1.8394 -0.26338 0.29521 -2.16258
GLU_39 -2.95838 0.28194 3.4867 -0.63634 0.21487 1.18844 1.28164 -1.65984 -0.00268 -0.04195 -0.73973 -0.73987 0 0 0 0 0 -0.08888 0.00918 0 4.36507 -0.29784 0 -2.7348 -0.68185 0.35074 0.59642
LEU_40 -4.99315 0.54872 4.26468 -0.51082 0.20853 0.14793 1.59573 -2.07737 -0.01486 -0.15535 -0.97439 0.09197 0 0 0 0 0 -0.08113 0.04834 0.08004 0 -0.11598 0 0.18072 -0.64086 0.29272 -2.10453
ASN_41 -2.42363 0.26941 3.14086 -0.1952 0.03357 0.33017 1.39361 -1.50117 -0 -0 -0.30611 -1.02239 0 0 0 0 0 -0.10685 0.0177 0 1.88729 -1.00622 0 -0.93687 -0.77206 0.18934 -1.00856
ARG_42 -3.43722 0.31555 3.10517 -0.46436 0.07428 0.27276 0.39556 -1.37388 -0.02526 -0.19537 0.6072 0.05799 0 0 0 0 0 -0.05229 0.00917 2.00109 0 -0.1022 0 -1.2888 -0.70559 0.144 -0.6622
GLN_43 -1.74241 0.13667 1.96889 -0.30246 0.06094 0.28708 0.84603 -0.9394 -0 -0 0.20789 -0.83834 0 0 0 0 0 -0.0893 0.0108 0 2.71569 -0.2209 0 -0.18838 -0.36573 0.12367 1.67073
CYS_44 -5.02188 0.11142 1.551 -0.17205 0.0724 0.08182 0.71099 -1.29763 -0.00111 -0.00515 0.2031 -1.2628 0 0 0 0 0 0.02986 0.0002 1.39618 0 0.33649 0 3.6196 -0.41398 0.36784 0.30631
TRP_45 -7.93903 0.70299 3.91339 -0.9577 0.19969 0.67533 2.69705 -2.74061 -0 -0 -1.31691 0.01907 0 0 0 0 0 -0.01634 0.03525 0 3.2449 -0.35797 0 1.6906 -0.32741 0.53783 0.06012
VAL_46 -7.59417 0.96424 0.60317 -0.27224 0.15969 0.05824 1.71715 -2.01776 -0 -0 -0.61291 -0.57968 0 0 0 0 0 0.08369 0.1842 0.2213 0 -0.51125 0 1.9342 -0.09678 0.57133 -5.18758
LEU_47 -7.34634 0.7359 2.98143 -0.5672 0.1849 0.16093 2.22251 -2.43491 -0.00656 -0.06349 -1.81145 0.15391 0 0 0 0 0 0.23995 0.2548 0.71056 0 -0.0465 0 0.18072 0.36659 0.93312 -3.15112
GLY_48 -4.60548 0.83 3.95796 -0.00032 0 0 1.52039 -2.31666 -0.01286 -0.07008 -1.87597 -0.23613 0 0 0 0 0 -0.09097 0 0 0 -1.41903 0 0.83697 0.4971 0.96474 -2.02033
HIS_D_49 -8.77012 1.02447 7.41017 -0.83161 0.12691 1.01377 2.98195 -3.88559 -0 -0 -4.72411 -0.67518 0 0 -0.94531 -1.73192 0 -0.0561 0.07289 0 2.88043 -0.09137 0 -0.45461 -0.11315 0.91964 -5.84884
TRP_50 -8.37581 0.94564 5.84907 -0.84634 0.01959 0.50085 3.1549 -3.5058 -0.00805 -0.03144 -3.3418 -0.02879 0 0 0 -0.51724 0 0.05157 0.07238 0 3.22225 -0.38817 0 1.6906 -0.20981 1.05177 -0.69463
VAL_51 -6.7158 0.84721 1.18582 -0.26632 0.21924 0.05281 1.18219 -1.81083 -0 -0 0.08454 -0.31571 0 0 0 0 0 -0.07533 0.1205 0.34898 0 -0.80808 0 1.9342 -0.22215 0.7209 -3.51783
GLY_52 -2.50157 0.09878 2.12607 -5e-05 0 0 1.04506 -1.19153 -0.00805 -0.03144 -0.1954 -0.37953 0 0 0 0 0 -0.14759 0 0 0 -1.34557 0 0.83697 -0.47979 0.32251 -1.85112
THR_53 -4.00168 0.41202 2.71734 -0.1231 0.09547 0.06001 1.27028 -1.56152 -0 -0 0.13485 -1.14393 0 0 -0.84083 0 0 -0.05455 0.05748 0.55528 0 0.13756 2.36812 -1.0874 -0.3102 0.39165 -0.92315
GLY_54 -2.30538 0.33534 1.58811 -5e-05 0 0 0.48347 -0.97386 -0 -0 0.37148 -0.40152 0 0 0 0 0 -0.12538 0 0 0 -1.43951 0 0.83697 -0.57267 0.32982 -1.87318
GLY_55 -2.61378 0.20853 2.43594 -0.00019 0 0 1.4536 -1.35656 -0 -0 -0.78416 -0.17689 0 0 -0.84083 0 0 -0.01042 0 0 0 -1.14455 0 0.83697 -0.45052 0.30162 -2.14121
LEU_56 -1.88456 0.11266 0.88051 -0.52545 0.22794 0.15257 0.18781 -0.67563 -0 -0 -0.02155 0.13057 0 0 0 0 0 0.0117 0.01372 0.6135 0 0.02014 0 0.18072 0.28755 0.45143 0.16363
VAL_57 -6.29588 1.19129 1.12242 -0.29832 0.28339 0.06706 1.60083 -1.76421 -0 -0 -0.84349 -0.16539 0 0 0 0 0 0.01208 0.0025 0.13877 0 -0.51048 0 1.9342 -0.02504 1.0565 -2.49378
PRO_58 -3.49499 0.52782 2.97806 -0.11659 0.00096 0.08581 1.80025 -1.34818 -0 -0 -2.81297 0.27808 0 0 0 0 0 -0.02743 0.02593 0.19025 0 -1.09222 0 -2.4119 -0.64823 1.06993 -4.99544
ARG_59 -1.20332 0.1043 1.46294 -0.493 0.05257 0.25577 0.49189 -0.67513 -0 -0 0.43346 0.58561 0 0 0 0 0 -0.05848 0.00052 2.03192 0 0.00286 0 -1.2888 -0.64433 0.31422 1.37301
GLY_60 -1.76358 0.09966 1.83878 -7e-05 0 0 0.5907 -1.04471 -0.00386 -0.06242 0.31936 -0.38638 0 0 0 0 0 -0.11604 0 0 0 -1.51563 0 0.83697 -0.57531 0.16862 -1.61391
SER_61 -4.87643 0.58993 4.22504 -0.02309 0 0.02158 2.76059 -2.26158 -0 -0 -1.49812 -0.05831 0 0 0 0 0 0.22562 0.03993 0.46704 0 0.12741 0.601 -0.77834 -0.22609 0.36562 -0.2982
ALA_62 -3.96814 0.36143 2.5314 -0.02386 4e-05 0 1.82704 -1.8744 -0.00111 -0.00515 0.32795 -0.42352 0 0 0 0 0 -0.10189 0 0 0 -0.18739 0 1.8394 -0.27183 0.49949 0.52949
ALA_63 -2.46444 0.64098 1.75 -0.02523 0.00045 0 0.70136 -1.32251 -0 -0 -0.44686 -0.39117 0 0 0 0 0 -0.08662 0 0 0 -0.18224 0 1.8394 -0.76317 0.41733 -0.33274
ALA:CtermProteinFull_64 -5.35801 1.07785 2.10174 -0.03114 0.01719 0 1.48999 -2.00062 -0.00386 -0.06242 -2.69765 -0.19678 0 0 -0.48342 0 0 0 0 0 0 0 0 1.8394 -0.37737 0.55709 -4.12801
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 142574 DOMAINID 138915 MODEL 2 2021-10-23_00000171_1_11
MODEL     2
REMARK    Rerank model02.pdb score: 17.064
REMARK    CLUSTER 0002 t000_.out.valid.rescored.best_scoring.binary cluster_size: 20 cluster_threshold: 7.022263
REMARK    SCORE            time:           0.000
REMARK    SCORE     hbond_sr_bb:         -21.717
REMARK    SCORE     hbond_bb_sc:         -13.889
REMARK    SCORE         fa_elec:         -82.393
REMARK    SCORE           omega:           1.083
REMARK    SCORE     rama_prepro:          -6.594
REMARK    SCORE        hbond_sc:         -11.525
REMARK    SCORE           score:        -110.098
REMARK    SCORE     lk_ball_wtd:         -14.747
REMARK    SCORE fa_intra_sol_xover4:          12.291
REMARK    SCORE          fa_sol:         186.519
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE     cart_bonded:          39.130
REMARK    SCORE    fa_intra_rep:           0.530
REMARK    SCORE             ref:          13.118
REMARK    SCORE     total_score:        -110.098
REMARK    SCORE         p_aa_pp:         -16.242
REMARK    SCORE          fa_atr:        -311.280
REMARK    SCORE     hbond_lr_bb:          -3.641
REMARK    SCORE          fa_dun:          80.263
REMARK    SCORE          fa_rep:          38.997
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     description: cluster0002_0001
ATOM      1  N   ASP A   1      -0.567   0.303   0.556  1.00  8.830          N  
ATOM      2  CA  ASP A   1       0.877   0.144   0.504  1.00  8.850          C  
ATOM      3  C   ASP A   1       1.563   1.502   0.458  1.00  8.200          C  
ATOM      4  O   ASP A   1       2.583   1.739   1.121  1.00  8.050          O  
ATOM      5  CB  ASP A   1       1.263  -0.711  -0.694  1.00 12.380          C  
ATOM      6  CG  ASP A   1       0.664  -2.091  -0.563  1.00 12.380          C  
ATOM      7  OD1 ASP A   1       0.139  -2.369   0.498  1.00 12.380          O  
ATOM      8  OD2 ASP A   1       0.705  -2.837  -1.492  1.00 12.380          O  
ATOM      9 1H   ASP A   1      -0.981  -0.601   0.744  1.00 10.600          H  
ATOM     10 2H   ASP A   1      -0.792   0.951   1.297  1.00 10.600          H  
ATOM     11 3H   ASP A   1      -0.916   0.666  -0.335  1.00 10.600          H  
ATOM     12  HA  ASP A   1       1.201  -0.368   1.414  1.00 10.620          H  
ATOM     13 1HB  ASP A   1       0.892  -0.246  -1.610  1.00 14.860          H  
ATOM     14 2HB  ASP A   1       2.338  -0.793  -0.775  1.00 14.860          H  
ATOM     15  N   VAL A   2       0.982   2.412  -0.309  1.00  8.090          N  
ATOM     16  CA  VAL A   2       1.511   3.751  -0.425  1.00  7.770          C  
ATOM     17  C   VAL A   2       0.542   4.781   0.168  1.00  7.380          C  
ATOM     18  O   VAL A   2      -0.608   4.861  -0.252  1.00  7.280          O  
ATOM     19  CB  VAL A   2       1.785   4.001  -1.919  1.00 11.010          C  
ATOM     20  CG1 VAL A   2       2.264   5.372  -2.138  1.00 11.010          C  
ATOM     21  CG2 VAL A   2       2.811   2.955  -2.408  1.00 11.010          C  
ATOM     22  H   VAL A   2       0.146   2.188  -0.863  1.00  9.710          H  
ATOM     23  HA  VAL A   2       2.453   3.806   0.118  1.00  9.320          H  
ATOM     24  HB  VAL A   2       0.877   3.889  -2.482  1.00 13.210          H  
ATOM     25 1HG1 VAL A   2       2.445   5.528  -3.206  1.00 13.210          H  
ATOM     26 2HG1 VAL A   2       1.499   6.039  -1.811  1.00 13.210          H  
ATOM     27 3HG1 VAL A   2       3.156   5.552  -1.592  1.00 13.210          H  
ATOM     28 1HG2 VAL A   2       3.017   3.108  -3.472  1.00 13.210          H  
ATOM     29 2HG2 VAL A   2       3.716   3.044  -1.853  1.00 13.210          H  
ATOM     30 3HG2 VAL A   2       2.415   1.956  -2.273  1.00 13.210          H  
ATOM     31  N   SER A   3       1.017   5.575   1.146  1.00  7.470          N  
ATOM     32  CA  SER A   3       0.162   6.599   1.755  1.00  7.430          C  
ATOM     33  C   SER A   3       0.008   7.814   0.844  1.00  6.860          C  
ATOM     34  O   SER A   3      -0.971   8.558   0.922  1.00  6.880          O  
ATOM     35  CB  SER A   3       0.749   7.037   3.081  1.00 10.420          C  
ATOM     36  OG  SER A   3       1.980   7.709   2.906  1.00 10.420          O  
ATOM     37  H   SER A   3       1.965   5.451   1.478  1.00  8.960          H  
ATOM     38  HA  SER A   3      -0.822   6.167   1.935  1.00  8.920          H  
ATOM     39 1HB  SER A   3       0.050   7.692   3.579  1.00 12.500          H  
ATOM     40 2HB  SER A   3       0.889   6.164   3.718  1.00 12.500          H  
ATOM     41  HG  SER A   3       1.759   8.610   2.635  1.00 12.500          H  
ATOM     42  N   GLU A   4       0.979   8.018  -0.039  1.00  6.710          N  
ATOM     43  CA  GLU A   4       0.942   9.111  -0.991  1.00  6.580          C  
ATOM     44  C   GLU A   4       1.713   8.711  -2.259  1.00  6.080          C  
ATOM     45  O   GLU A   4       2.943   8.755  -2.255  1.00  6.050          O  
ATOM     46  CB  GLU A   4       1.546  10.372  -0.362  1.00  9.260          C  
ATOM     47  CG  GLU A   4       1.495  11.610  -1.241  1.00  9.260          C  
ATOM     48  CD  GLU A   4       1.939  12.863  -0.527  1.00  9.260          C  
ATOM     49  OE1 GLU A   4       2.115  12.825   0.670  1.00  9.260          O  
ATOM     50  OE2 GLU A   4       2.098  13.864  -1.186  1.00  9.260          O  
ATOM     51  H   GLU A   4       1.792   7.415  -0.029  1.00  8.050          H  
ATOM     52  HA  GLU A   4      -0.089   9.347  -1.219  1.00  7.900          H  
ATOM     53 1HB  GLU A   4       1.015  10.601   0.562  1.00 11.120          H  
ATOM     54 2HB  GLU A   4       2.587  10.184  -0.102  1.00 11.120          H  
ATOM     55 1HG  GLU A   4       2.136  11.454  -2.109  1.00 11.120          H  
ATOM     56 2HG  GLU A   4       0.474  11.742  -1.602  1.00 11.120          H  
ATOM     57  N   GLU A   5       1.024   8.307  -3.345  1.00  6.050          N  
ATOM     58  CA  GLU A   5      -0.432   8.142  -3.436  1.00  5.890          C  
ATOM     59  C   GLU A   5      -0.764   7.014  -4.402  1.00  5.160          C  
ATOM     60  O   GLU A   5       0.062   6.622  -5.224  1.00  5.160          O  
ATOM     61  CB  GLU A   5      -1.114   9.424  -3.920  1.00  8.310          C  
ATOM     62  CG  GLU A   5      -0.751   9.843  -5.342  1.00  8.310          C  
ATOM     63  CD  GLU A   5      -1.383  11.135  -5.748  1.00  8.310          C  
ATOM     64  OE1 GLU A   5      -1.816  11.853  -4.885  1.00  8.310          O  
ATOM     65  OE2 GLU A   5      -1.453  11.401  -6.923  1.00  8.310          O  
ATOM     66  H   GLU A   5       1.559   8.070  -4.169  1.00  7.260          H  
ATOM     67  HA  GLU A   5      -0.840   7.836  -2.473  1.00  7.070          H  
ATOM     68 1HB  GLU A   5      -2.193   9.283  -3.884  1.00  9.970          H  
ATOM     69 2HB  GLU A   5      -0.874  10.252  -3.258  1.00  9.970          H  
ATOM     70 1HG  GLU A   5       0.332   9.938  -5.416  1.00  9.970          H  
ATOM     71 2HG  GLU A   5      -1.068   9.066  -6.039  1.00  9.970          H  
ATOM     72  N   GLU A   6      -1.987   6.506  -4.291  1.00  4.960          N  
ATOM     73  CA  GLU A   6      -2.517   5.464  -5.166  1.00  4.770          C  
ATOM     74  C   GLU A   6      -3.829   6.028  -5.683  1.00  4.340          C  
ATOM     75  O   GLU A   6      -4.515   6.715  -4.937  1.00  4.600          O  
ATOM     76  CB  GLU A   6      -2.845   4.168  -4.379  1.00  6.750          C  
ATOM     77  CG  GLU A   6      -1.697   3.547  -3.535  1.00  6.750          C  
ATOM     78  CD  GLU A   6      -2.112   2.242  -2.718  1.00  6.750          C  
ATOM     79  OE1 GLU A   6      -3.237   1.802  -2.876  1.00  6.750          O  
ATOM     80  OE2 GLU A   6      -1.298   1.745  -1.916  1.00  6.750          O  
ATOM     81  H   GLU A   6      -2.597   6.890  -3.586  1.00  5.950          H  
ATOM     82  HA  GLU A   6      -1.839   5.273  -5.998  1.00  5.720          H  
ATOM     83 1HB  GLU A   6      -3.694   4.335  -3.748  1.00  8.100          H  
ATOM     84 2HB  GLU A   6      -3.149   3.401  -5.094  1.00  8.100          H  
ATOM     85 1HG  GLU A   6      -0.863   3.309  -4.193  1.00  8.100          H  
ATOM     86 2HG  GLU A   6      -1.360   4.304  -2.829  1.00  8.100          H  
ATOM     87  N   ASP A   7      -4.217   5.721  -6.914  1.00  4.250          N  
ATOM     88  CA  ASP A   7      -5.519   6.184  -7.403  1.00  4.480          C  
ATOM     89  C   ASP A   7      -6.641   5.566  -6.581  1.00  4.290          C  
ATOM     90  O   ASP A   7      -6.495   4.479  -6.025  1.00  4.400          O  
ATOM     91  CB  ASP A   7      -5.673   5.859  -8.903  1.00  6.180          C  
ATOM     92  CG  ASP A   7      -7.009   6.327  -9.598  1.00  6.180          C  
ATOM     93  OD1 ASP A   7      -7.924   6.785  -8.921  1.00  6.180          O  
ATOM     94  OD2 ASP A   7      -7.099   6.176 -10.796  1.00  6.180          O  
ATOM     95  H   ASP A   7      -3.615   5.173  -7.508  1.00  5.100          H  
ATOM     96  HA  ASP A   7      -5.570   7.267  -7.282  1.00  5.380          H  
ATOM     97 1HB  ASP A   7      -4.840   6.306  -9.448  1.00  7.420          H  
ATOM     98 2HB  ASP A   7      -5.593   4.804  -9.036  1.00  7.420          H  
ATOM     99  N   PHE A   8      -7.788   6.233  -6.543  1.00  4.440          N  
ATOM    100  CA  PHE A   8      -8.948   5.752  -5.802  1.00  4.740          C  
ATOM    101  C   PHE A   8      -9.389   4.443  -6.378  1.00  4.750          C  
ATOM    102  O   PHE A   8      -9.729   3.502  -5.660  1.00  4.870          O  
ATOM    103  CB  PHE A   8     -10.129   6.714  -5.908  1.00  6.520          C  
ATOM    104  CG  PHE A   8     -10.126   7.914  -4.999  1.00  6.520          C  
ATOM    105  CD1 PHE A   8      -9.741   9.172  -5.448  1.00  6.520          C  
ATOM    106  CD2 PHE A   8     -10.564   7.784  -3.695  1.00  6.520          C  
ATOM    107  CE1 PHE A   8      -9.798  10.264  -4.596  1.00  6.520          C  
ATOM    108  CE2 PHE A   8     -10.618   8.857  -2.854  1.00  6.520          C  
ATOM    109  CZ  PHE A   8     -10.238  10.102  -3.303  1.00  6.520          C  
ATOM    110  H   PHE A   8      -7.857   7.067  -7.118  1.00  5.330          H  
ATOM    111  HA  PHE A   8      -8.670   5.612  -4.756  1.00  5.690          H  
ATOM    112 1HB  PHE A   8     -10.189   7.076  -6.936  1.00  7.820          H  
ATOM    113 2HB  PHE A   8     -11.048   6.156  -5.724  1.00  7.820          H  
ATOM    114  HD1 PHE A   8      -9.407   9.299  -6.477  1.00  7.820          H  
ATOM    115  HD2 PHE A   8     -10.886   6.812  -3.340  1.00  7.820          H  
ATOM    116  HE1 PHE A   8      -9.503  11.249  -4.949  1.00  7.820          H  
ATOM    117  HE2 PHE A   8     -10.973   8.734  -1.823  1.00  7.820          H  
ATOM    118  HZ  PHE A   8     -10.298  10.949  -2.626  1.00  7.820          H  
ATOM    119  N   ARG A   9      -9.324   4.374  -7.700  1.00  4.990          N  
ATOM    120  CA  ARG A   9      -9.766   3.208  -8.442  1.00  5.460          C  
ATOM    121  C   ARG A   9      -8.930   1.960  -8.169  1.00  4.970          C  
ATOM    122  O   ARG A   9      -9.395   0.839  -8.369  1.00  5.240          O  
ATOM    123  CB  ARG A   9      -9.768   3.508  -9.933  1.00  7.460          C  
ATOM    124  CG  ARG A   9     -10.829   4.532 -10.350  1.00  7.460          C  
ATOM    125  CD  ARG A   9     -10.805   4.846 -11.809  1.00  7.460          C  
ATOM    126  NE  ARG A   9      -9.592   5.559 -12.204  1.00  7.460          N  
ATOM    127  CZ  ARG A   9      -9.284   5.968 -13.441  1.00  7.460          C  
ATOM    128  NH1 ARG A   9     -10.095   5.769 -14.467  1.00  7.460          N  
ATOM    129  NH2 ARG A   9      -8.133   6.580 -13.586  1.00  7.460          N  
ATOM    130  H   ARG A   9      -8.978   5.208  -8.201  1.00  5.990          H  
ATOM    131  HA  ARG A   9     -10.793   2.994  -8.147  1.00  6.550          H  
ATOM    132 1HB  ARG A   9      -8.794   3.897 -10.224  1.00  8.950          H  
ATOM    133 2HB  ARG A   9      -9.944   2.593 -10.493  1.00  8.950          H  
ATOM    134 1HG  ARG A   9     -11.817   4.151 -10.090  1.00  8.950          H  
ATOM    135 2HG  ARG A   9     -10.650   5.463  -9.808  1.00  8.950          H  
ATOM    136 1HD  ARG A   9     -10.855   3.915 -12.374  1.00  8.950          H  
ATOM    137 2HD  ARG A   9     -11.664   5.469 -12.052  1.00  8.950          H  
ATOM    138  HE  ARG A   9      -8.879   5.772 -11.484  1.00  8.950          H  
ATOM    139 1HH1 ARG A   9     -10.976   5.296 -14.333  1.00  8.950          H  
ATOM    140 2HH1 ARG A   9      -9.834   6.090 -15.388  1.00  8.950          H  
ATOM    141 1HH2 ARG A   9      -7.551   6.689 -12.736  1.00  8.950          H  
ATOM    142 2HH2 ARG A   9      -7.829   6.918 -14.484  1.00  8.950          H  
ATOM    143  N   LEU A  10      -7.711   2.111  -7.654  1.00  4.550          N  
ATOM    144  CA  LEU A  10      -6.879   0.948  -7.415  1.00  4.470          C  
ATOM    145  C   LEU A  10      -7.224   0.351  -6.087  1.00  4.170          C  
ATOM    146  O   LEU A  10      -6.767  -0.734  -5.735  1.00  4.310          O  
ATOM    147  CB  LEU A  10      -5.397   1.324  -7.423  1.00  6.290          C  
ATOM    148  CG  LEU A  10      -4.810   1.816  -8.746  1.00  6.290          C  
ATOM    149  CD1 LEU A  10      -3.390   2.311  -8.476  1.00  6.290          C  
ATOM    150  CD2 LEU A  10      -4.789   0.682  -9.783  1.00  6.290          C  
ATOM    151  H   LEU A  10      -7.356   3.029  -7.382  1.00  5.460          H  
ATOM    152  HA  LEU A  10      -7.082   0.202  -8.177  1.00  5.360          H  
ATOM    153 1HB  LEU A  10      -5.257   2.122  -6.684  1.00  7.550          H  
ATOM    154 2HB  LEU A  10      -4.818   0.460  -7.098  1.00  7.550          H  
ATOM    155  HG  LEU A  10      -5.403   2.628  -9.127  1.00  7.550          H  
ATOM    156 1HD1 LEU A  10      -2.949   2.679  -9.403  1.00  7.550          H  
ATOM    157 2HD1 LEU A  10      -3.417   3.109  -7.745  1.00  7.550          H  
ATOM    158 3HD1 LEU A  10      -2.789   1.490  -8.089  1.00  7.550          H  
ATOM    159 1HD2 LEU A  10      -4.354   1.050 -10.713  1.00  7.550          H  
ATOM    160 2HD2 LEU A  10      -4.186  -0.143  -9.405  1.00  7.550          H  
ATOM    161 3HD2 LEU A  10      -5.795   0.327  -9.985  1.00  7.550          H  
ATOM    162  N   ALA A  11      -8.114   1.008  -5.352  1.00  4.190          N  
ATOM    163  CA  ALA A  11      -8.468   0.486  -4.072  1.00  4.500          C  
ATOM    164  C   ALA A  11      -9.443  -0.652  -4.241  1.00  4.520          C  
ATOM    165  O   ALA A  11      -9.708  -1.400  -3.302  1.00  4.870          O  
ATOM    166  CB  ALA A  11      -9.020   1.560  -3.188  1.00  6.180          C  
ATOM    167  H   ALA A  11      -8.529   1.891  -5.658  1.00  5.030          H  
ATOM    168  HA  ALA A  11      -7.571   0.089  -3.630  1.00  5.400          H  
ATOM    169 1HB  ALA A  11      -9.217   1.124  -2.251  1.00  7.410          H  
ATOM    170 2HB  ALA A  11      -8.278   2.345  -3.080  1.00  7.410          H  
ATOM    171 3HB  ALA A  11      -9.915   1.969  -3.604  1.00  7.410          H  
ATOM    172  N   CYS A  12      -9.915  -0.863  -5.473  1.00  4.570          N  
ATOM    173  CA  CYS A  12     -10.816  -1.960  -5.748  1.00  5.110          C  
ATOM    174  C   CYS A  12     -10.043  -3.280  -5.659  1.00  5.050          C  
ATOM    175  O   CYS A  12     -10.639  -4.353  -5.613  1.00  5.500          O  
ATOM    176  CB  CYS A  12     -11.427  -1.837  -7.141  1.00  6.940          C  
ATOM    177  SG  CYS A  12     -10.242  -2.084  -8.492  1.00  6.940          S  
ATOM    178  H   CYS A  12      -9.657  -0.238  -6.242  1.00  5.480          H  
ATOM    179  HA  CYS A  12     -11.615  -1.959  -5.006  1.00  6.130          H  
ATOM    180 1HB  CYS A  12     -12.222  -2.574  -7.251  1.00  8.330          H  
ATOM    181 2HB  CYS A  12     -11.871  -0.848  -7.261  1.00  8.330          H  
ATOM    182  HG  CYS A  12      -9.752  -0.823  -8.488  1.00  8.330          H  
ATOM    183  N   ARG A  13      -8.702  -3.196  -5.651  1.00  4.840          N  
ATOM    184  CA  ARG A  13      -7.839  -4.355  -5.577  1.00  5.090          C  
ATOM    185  C   ARG A  13      -7.468  -4.699  -4.129  1.00  4.790          C  
ATOM    186  O   ARG A  13      -6.813  -5.716  -3.876  1.00  5.100          O  
ATOM    187  CB  ARG A  13      -6.556  -4.079  -6.346  1.00  7.030          C  
ATOM    188  CG  ARG A  13      -6.736  -3.837  -7.838  1.00  7.030          C  
ATOM    189  CD  ARG A  13      -5.448  -3.531  -8.502  1.00  7.030          C  
ATOM    190  NE  ARG A  13      -5.620  -3.272  -9.929  1.00  7.030          N  
ATOM    191  CZ  ARG A  13      -4.622  -2.981 -10.795  1.00  7.030          C  
ATOM    192  NH1 ARG A  13      -3.372  -2.913 -10.378  1.00  7.030          N  
ATOM    193  NH2 ARG A  13      -4.906  -2.762 -12.069  1.00  7.030          N  
ATOM    194  H   ARG A  13      -8.248  -2.280  -5.689  1.00  5.810          H  
ATOM    195  HA  ARG A  13      -8.357  -5.205  -6.022  1.00  6.110          H  
ATOM    196 1HB  ARG A  13      -6.070  -3.201  -5.923  1.00  8.430          H  
ATOM    197 2HB  ARG A  13      -5.873  -4.918  -6.227  1.00  8.430          H  
ATOM    198 1HG  ARG A  13      -7.180  -4.713  -8.305  1.00  8.430          H  
ATOM    199 2HG  ARG A  13      -7.386  -2.977  -7.980  1.00  8.430          H  
ATOM    200 1HD  ARG A  13      -5.017  -2.639  -8.041  1.00  8.430          H  
ATOM    201 2HD  ARG A  13      -4.770  -4.375  -8.380  1.00  8.430          H  
ATOM    202  HE  ARG A  13      -6.564  -3.313 -10.295  1.00  8.430          H  
ATOM    203 1HH1 ARG A  13      -3.147  -3.079  -9.410  1.00  8.430          H  
ATOM    204 2HH1 ARG A  13      -2.632  -2.695 -11.032  1.00  8.430          H  
ATOM    205 1HH2 ARG A  13      -5.863  -2.815 -12.391  1.00  8.430          H  
ATOM    206 2HH2 ARG A  13      -4.168  -2.545 -12.723  1.00  8.430          H  
ATOM    207  N   HIS A  14      -7.888  -3.882  -3.153  1.00  4.580          N  
ATOM    208  CA  HIS A  14      -7.503  -4.131  -1.766  1.00  4.700          C  
ATOM    209  C   HIS A  14      -8.384  -5.154  -1.067  1.00  4.560          C  
ATOM    210  O   HIS A  14      -9.117  -4.869  -0.118  1.00  4.920          O  
ATOM    211  CB  HIS A  14      -7.381  -2.820  -0.979  1.00  6.530          C  
ATOM    212  CG  HIS A  14      -6.133  -2.036  -1.356  1.00  6.530          C  
ATOM    213  ND1 HIS A  14      -4.881  -2.631  -1.397  1.00  6.530          N  
ATOM    214  CD2 HIS A  14      -5.929  -0.732  -1.647  1.00  6.530          C  
ATOM    215  CE1 HIS A  14      -3.978  -1.731  -1.743  1.00  6.530          C  
ATOM    216  NE2 HIS A  14      -4.584  -0.573  -1.905  1.00  6.530          N  
ATOM    217  H   HIS A  14      -8.473  -3.069  -3.361  1.00  5.500          H  
ATOM    218  HA  HIS A  14      -6.503  -4.561  -1.766  1.00  5.640          H  
ATOM    219 1HB  HIS A  14      -8.240  -2.188  -1.220  1.00  7.840          H  
ATOM    220 2HB  HIS A  14      -7.424  -2.997   0.056  1.00  7.840          H  
ATOM    221  HD2 HIS A  14      -6.677   0.048  -1.670  1.00  7.840          H  
ATOM    222  HE1 HIS A  14      -2.907  -1.911  -1.867  1.00  7.840          H  
ATOM    223  HE2 HIS A  14      -4.113   0.320  -2.174  1.00  7.840          H  
ATOM    224  N   GLU A  15      -8.226  -6.394  -1.517  1.00  4.540          N  
ATOM    225  CA  GLU A  15      -8.995  -7.547  -1.060  1.00  4.970          C  
ATOM    226  C   GLU A  15      -8.810  -7.836   0.423  1.00  5.050          C  
ATOM    227  O   GLU A  15      -9.731  -8.303   1.090  1.00  5.550          O  
ATOM    228  CB  GLU A  15      -8.615  -8.796  -1.860  1.00  6.790          C  
ATOM    229  CG  GLU A  15      -9.062  -8.785  -3.320  1.00  6.790          C  
ATOM    230  CD  GLU A  15      -8.655 -10.033  -4.068  1.00  6.790          C  
ATOM    231  OE1 GLU A  15      -7.933 -10.829  -3.509  1.00  6.790          O  
ATOM    232  OE2 GLU A  15      -9.069 -10.193  -5.192  1.00  6.790          O  
ATOM    233  H   GLU A  15      -7.566  -6.492  -2.296  1.00  5.450          H  
ATOM    234  HA  GLU A  15     -10.053  -7.337  -1.232  1.00  5.960          H  
ATOM    235 1HB  GLU A  15      -7.532  -8.914  -1.845  1.00  8.140          H  
ATOM    236 2HB  GLU A  15      -9.045  -9.678  -1.381  1.00  8.140          H  
ATOM    237 1HG  GLU A  15     -10.146  -8.690  -3.355  1.00  8.140          H  
ATOM    238 2HG  GLU A  15      -8.633  -7.913  -3.813  1.00  8.140          H  
ATOM    239  N   ARG A  16      -7.616  -7.563   0.950  1.00  5.010          N  
ATOM    240  CA  ARG A  16      -7.340  -7.863   2.347  1.00  5.580          C  
ATOM    241  C   ARG A  16      -7.756  -6.764   3.320  1.00  5.630          C  
ATOM    242  O   ARG A  16      -7.527  -6.906   4.523  1.00  6.310          O  
ATOM    243  CB  ARG A  16      -5.857  -8.129   2.582  1.00  7.580          C  
ATOM    244  CG  ARG A  16      -4.928  -6.911   2.472  1.00  7.580          C  
ATOM    245  CD  ARG A  16      -3.521  -7.275   2.797  1.00  7.580          C  
ATOM    246  NE  ARG A  16      -2.647  -6.104   2.809  1.00  7.580          N  
ATOM    247  CZ  ARG A  16      -1.928  -5.604   1.773  1.00  7.580          C  
ATOM    248  NH1 ARG A  16      -1.933  -6.183   0.588  1.00  7.580          N  
ATOM    249  NH2 ARG A  16      -1.221  -4.499   1.984  1.00  7.580          N  
ATOM    250  H   ARG A  16      -6.883  -7.192   0.363  1.00  6.010          H  
ATOM    251  HA  ARG A  16      -7.889  -8.768   2.607  1.00  6.700          H  
ATOM    252 1HB  ARG A  16      -5.720  -8.552   3.575  1.00  9.100          H  
ATOM    253 2HB  ARG A  16      -5.506  -8.869   1.863  1.00  9.100          H  
ATOM    254 1HG  ARG A  16      -4.962  -6.494   1.467  1.00  9.100          H  
ATOM    255 2HG  ARG A  16      -5.233  -6.150   3.189  1.00  9.100          H  
ATOM    256 1HD  ARG A  16      -3.500  -7.718   3.792  1.00  9.100          H  
ATOM    257 2HD  ARG A  16      -3.143  -7.994   2.077  1.00  9.100          H  
ATOM    258  HE  ARG A  16      -2.590  -5.594   3.688  1.00  9.100          H  
ATOM    259 1HH1 ARG A  16      -2.474  -7.017   0.429  1.00  9.100          H  
ATOM    260 2HH1 ARG A  16      -1.391  -5.783  -0.171  1.00  9.100          H  
ATOM    261 1HH2 ARG A  16      -1.266  -4.042   2.895  1.00  9.100          H  
ATOM    262 2HH2 ARG A  16      -0.668  -4.042   1.235  1.00  9.100          H  
ATOM    263  N   TYR A  17      -8.293  -5.643   2.833  1.00  5.150          N  
ATOM    264  CA  TYR A  17      -8.631  -4.572   3.755  1.00  5.370          C  
ATOM    265  C   TYR A  17     -10.139  -4.445   4.083  1.00  5.730          C  
ATOM    266  O   TYR A  17     -10.984  -4.637   3.211  1.00  5.580          O  
ATOM    267  CB  TYR A  17      -8.080  -3.248   3.231  1.00  7.430          C  
ATOM    268  CG  TYR A  17      -6.548  -3.099   3.398  1.00  7.430          C  
ATOM    269  CD1 TYR A  17      -5.637  -3.269   2.368  1.00  7.430          C  
ATOM    270  CD2 TYR A  17      -6.075  -2.810   4.641  1.00  7.430          C  
ATOM    271  CE1 TYR A  17      -4.290  -3.125   2.619  1.00  7.430          C  
ATOM    272  CE2 TYR A  17      -4.757  -2.683   4.888  1.00  7.430          C  
ATOM    273  CZ  TYR A  17      -3.850  -2.834   3.915  1.00  7.430          C  
ATOM    274  OH  TYR A  17      -2.482  -2.722   4.230  1.00  7.430          O  
ATOM    275  H   TYR A  17      -8.510  -5.550   1.834  1.00  6.180          H  
ATOM    276  HA  TYR A  17      -8.085  -4.786   4.660  1.00  6.440          H  
ATOM    277 1HB  TYR A  17      -8.321  -3.160   2.175  1.00  8.920          H  
ATOM    278 2HB  TYR A  17      -8.574  -2.448   3.730  1.00  8.920          H  
ATOM    279  HD1 TYR A  17      -5.948  -3.516   1.382  1.00  8.920          H  
ATOM    280  HD2 TYR A  17      -6.760  -2.687   5.457  1.00  8.920          H  
ATOM    281  HE1 TYR A  17      -3.590  -3.256   1.808  1.00  8.920          H  
ATOM    282  HE2 TYR A  17      -4.434  -2.462   5.879  1.00  8.920          H  
ATOM    283  HH  TYR A  17      -2.370  -2.549   5.215  1.00  8.920          H  
ATOM    284  N   PRO A  18     -10.505  -4.142   5.356  1.00  6.500          N  
ATOM    285  CA  PRO A  18     -11.853  -3.866   5.842  1.00  7.110          C  
ATOM    286  C   PRO A  18     -12.260  -2.466   5.421  1.00  7.180          C  
ATOM    287  O   PRO A  18     -11.383  -1.643   5.183  1.00  7.450          O  
ATOM    288  CB  PRO A  18     -11.696  -3.989   7.357  1.00 10.670          C  
ATOM    289  CG  PRO A  18     -10.273  -3.565   7.618  1.00 10.670          C  
ATOM    290  CD  PRO A  18      -9.481  -4.076   6.427  1.00 10.670          C  
ATOM    291  HA  PRO A  18     -12.549  -4.618   5.441  1.00  8.530          H  
ATOM    292 1HB  PRO A  18     -12.434  -3.350   7.863  1.00 12.800          H  
ATOM    293 2HB  PRO A  18     -11.899  -5.024   7.676  1.00 12.800          H  
ATOM    294 1HG  PRO A  18     -10.222  -2.470   7.703  1.00 12.800          H  
ATOM    295 2HG  PRO A  18      -9.918  -3.978   8.573  1.00 12.800          H  
ATOM    296 1HD  PRO A  18      -8.720  -3.330   6.202  1.00 12.800          H  
ATOM    297 2HD  PRO A  18      -9.060  -5.076   6.641  1.00 12.800          H  
ATOM    298  N   THR A  19     -13.562  -2.162   5.394  1.00  7.250          N  
ATOM    299  CA  THR A  19     -13.974  -0.804   5.051  1.00  7.600          C  
ATOM    300  C   THR A  19     -15.019  -0.190   6.004  1.00  7.630          C  
ATOM    301  O   THR A  19     -15.920   0.522   5.563  1.00  7.840          O  
ATOM    302  CB  THR A  19     -14.626  -0.847   3.656  1.00 10.500          C  
ATOM    303  OG1 THR A  19     -15.739  -1.751   3.686  1.00 10.500          O  
ATOM    304  CG2 THR A  19     -13.641  -1.373   2.642  1.00 10.500          C  
ATOM    305  H   THR A  19     -14.270  -2.859   5.576  1.00  8.700          H  
ATOM    306  HA  THR A  19     -13.094  -0.162   5.040  1.00  9.120          H  
ATOM    307  HB  THR A  19     -14.957   0.141   3.375  1.00 12.600          H  
ATOM    308  HG1 THR A  19     -16.266  -1.636   2.891  1.00 12.600          H  
ATOM    309 1HG2 THR A  19     -14.119  -1.408   1.673  1.00 12.600          H  
ATOM    310 2HG2 THR A  19     -12.792  -0.731   2.610  1.00 12.600          H  
ATOM    311 3HG2 THR A  19     -13.319  -2.373   2.904  1.00 12.600          H  
ATOM    312  N   ARG A  20     -14.848  -0.324   7.325  1.00  7.700          N  
ATOM    313  CA  ARG A  20     -15.877   0.193   8.247  1.00  7.980          C  
ATOM    314  C   ARG A  20     -16.162   1.681   8.108  1.00  7.670          C  
ATOM    315  O   ARG A  20     -17.312   2.119   8.193  1.00  7.730          O  
ATOM    316  CB  ARG A  20     -15.521  -0.073   9.702  1.00 11.060          C  
ATOM    317  CG  ARG A  20     -16.632   0.358  10.675  1.00 11.060          C  
ATOM    318  CD  ARG A  20     -16.395  -0.030  12.084  1.00 11.060          C  
ATOM    319  NE  ARG A  20     -15.203   0.600  12.649  1.00 11.060          N  
ATOM    320  CZ  ARG A  20     -14.034  -0.015  12.958  1.00 11.060          C  
ATOM    321  NH1 ARG A  20     -13.854  -1.312  12.760  1.00 11.060          N  
ATOM    322  NH2 ARG A  20     -13.066   0.706  13.475  1.00 11.060          N  
ATOM    323  H   ARG A  20     -14.065  -0.847   7.685  1.00  9.240          H  
ATOM    324  HA  ARG A  20     -16.802  -0.343   8.035  1.00  9.580          H  
ATOM    325 1HB  ARG A  20     -15.326  -1.132   9.849  1.00 13.270          H  
ATOM    326 2HB  ARG A  20     -14.617   0.475   9.963  1.00 13.270          H  
ATOM    327 1HG  ARG A  20     -16.717   1.446  10.665  1.00 13.270          H  
ATOM    328 2HG  ARG A  20     -17.579  -0.075  10.355  1.00 13.270          H  
ATOM    329 1HD  ARG A  20     -17.251   0.292  12.676  1.00 13.270          H  
ATOM    330 2HD  ARG A  20     -16.305  -1.107  12.156  1.00 13.270          H  
ATOM    331  HE  ARG A  20     -15.250   1.622  12.805  1.00 13.270          H  
ATOM    332 1HH1 ARG A  20     -14.588  -1.877  12.370  1.00 13.270          H  
ATOM    333 2HH1 ARG A  20     -12.971  -1.740  13.003  1.00 13.270          H  
ATOM    334 1HH2 ARG A  20     -13.234   1.695  13.646  1.00 13.270          H  
ATOM    335 2HH2 ARG A  20     -12.187   0.274  13.725  1.00 13.270          H  
ATOM    336  N   HIS A  21     -15.112   2.461   7.937  1.00  7.610          N  
ATOM    337  CA  HIS A  21     -15.230   3.907   7.817  1.00  7.580          C  
ATOM    338  C   HIS A  21     -14.841   4.369   6.411  1.00  6.950          C  
ATOM    339  O   HIS A  21     -14.491   5.530   6.197  1.00  7.230          O  
ATOM    340  CB  HIS A  21     -14.390   4.597   8.906  1.00 10.620          C  
ATOM    341  CG  HIS A  21     -14.872   4.329  10.317  1.00 10.620          C  
ATOM    342  ND1 HIS A  21     -16.061   4.826  10.796  1.00 10.620          N  
ATOM    343  CD2 HIS A  21     -14.314   3.630  11.336  1.00 10.620          C  
ATOM    344  CE1 HIS A  21     -16.221   4.444  12.052  1.00 10.620          C  
ATOM    345  NE2 HIS A  21     -15.177   3.708  12.417  1.00 10.620          N  
ATOM    346  H   HIS A  21     -14.203   2.015   7.885  1.00  9.130          H  
ATOM    347  HA  HIS A  21     -16.269   4.196   7.971  1.00  9.100          H  
ATOM    348 1HB  HIS A  21     -13.375   4.237   8.852  1.00 12.750          H  
ATOM    349 2HB  HIS A  21     -14.355   5.654   8.745  1.00 12.750          H  
ATOM    350  HD1 HIS A  21     -16.839   5.071  10.215  1.00 12.750          H  
ATOM    351  HD2 HIS A  21     -13.382   3.073  11.419  1.00 12.750          H  
ATOM    352  HE1 HIS A  21     -17.110   4.744  12.606  1.00 12.750          H  
ATOM    353  N   GLN A  22     -14.858   3.436   5.459  1.00  6.360          N  
ATOM    354  CA  GLN A  22     -14.484   3.674   4.070  1.00  5.960          C  
ATOM    355  C   GLN A  22     -15.529   3.057   3.141  1.00  5.570          C  
ATOM    356  O   GLN A  22     -15.154   2.322   2.231  1.00  5.500          O  
ATOM    357  CB  GLN A  22     -13.116   3.073   3.766  1.00  8.500          C  
ATOM    358  CG  GLN A  22     -11.944   3.718   4.504  1.00  8.500          C  
ATOM    359  CD  GLN A  22     -11.776   3.163   5.893  1.00  8.500          C  
ATOM    360  OE1 GLN A  22     -11.797   1.932   6.095  1.00  8.500          O  
ATOM    361  NE2 GLN A  22     -11.586   4.025   6.861  1.00  8.500          N  
ATOM    362  H   GLN A  22     -15.193   2.496   5.701  1.00  7.630          H  
ATOM    363  HA  GLN A  22     -14.422   4.745   3.895  1.00  7.150          H  
ATOM    364 1HB  GLN A  22     -13.127   2.025   4.029  1.00 10.200          H  
ATOM    365 2HB  GLN A  22     -12.932   3.129   2.712  1.00 10.200          H  
ATOM    366 1HG  GLN A  22     -11.024   3.547   3.951  1.00 10.200          H  
ATOM    367 2HG  GLN A  22     -12.129   4.791   4.600  1.00 10.200          H  
ATOM    368 1HE2 GLN A  22     -11.464   3.706   7.799  1.00 10.200          H  
ATOM    369 2HE2 GLN A  22     -11.503   5.025   6.662  1.00 10.200          H  
ATOM    370  N   PRO A  23     -16.810   3.455   3.242  1.00  5.710          N  
ATOM    371  CA  PRO A  23     -17.999   2.768   2.731  1.00  5.760          C  
ATOM    372  C   PRO A  23     -18.066   2.469   1.233  1.00  5.430          C  
ATOM    373  O   PRO A  23     -18.831   1.592   0.829  1.00  5.430          O  
ATOM    374  CB  PRO A  23     -19.124   3.748   3.107  1.00  8.640          C  
ATOM    375  CG  PRO A  23     -18.450   5.095   3.246  1.00  8.640          C  
ATOM    376  CD  PRO A  23     -17.103   4.793   3.816  1.00  8.640          C  
ATOM    377  HA  PRO A  23     -18.116   1.831   3.299  1.00  6.910          H  
ATOM    378 1HB  PRO A  23     -19.899   3.743   2.321  1.00 10.370          H  
ATOM    379 2HB  PRO A  23     -19.608   3.418   4.037  1.00 10.370          H  
ATOM    380 1HG  PRO A  23     -18.391   5.592   2.270  1.00 10.370          H  
ATOM    381 2HG  PRO A  23     -19.048   5.753   3.894  1.00 10.370          H  
ATOM    382 1HD  PRO A  23     -16.394   5.559   3.471  1.00 10.370          H  
ATOM    383 2HD  PRO A  23     -17.176   4.750   4.907  1.00 10.370          H  
ATOM    384  N   HIS A  24     -17.304   3.170   0.404  1.00  5.500          N  
ATOM    385  CA  HIS A  24     -17.371   2.900  -1.024  1.00  5.480          C  
ATOM    386  C   HIS A  24     -15.979   2.708  -1.604  1.00  5.020          C  
ATOM    387  O   HIS A  24     -15.572   3.440  -2.514  1.00  5.160          O  
ATOM    388  CB  HIS A  24     -18.074   4.058  -1.729  1.00  7.680          C  
ATOM    389  CG  HIS A  24     -19.445   4.309  -1.190  1.00  7.680          C  
ATOM    390  ND1 HIS A  24     -20.518   3.487  -1.466  1.00  7.680          N  
ATOM    391  CD2 HIS A  24     -19.910   5.279  -0.380  1.00  7.680          C  
ATOM    392  CE1 HIS A  24     -21.586   3.955  -0.844  1.00  7.680          C  
ATOM    393  NE2 HIS A  24     -21.242   5.042  -0.180  1.00  7.680          N  
ATOM    394  H   HIS A  24     -16.673   3.881   0.747  1.00  6.600          H  
ATOM    395  HA  HIS A  24     -17.934   1.984  -1.206  1.00  6.580          H  
ATOM    396 1HB  HIS A  24     -17.486   4.971  -1.609  1.00  9.220          H  
ATOM    397 2HB  HIS A  24     -18.153   3.850  -2.796  1.00  9.220          H  
ATOM    398  HD1 HIS A  24     -20.433   2.520  -1.708  1.00  9.220          H  
ATOM    399  HD2 HIS A  24     -19.435   6.125   0.087  1.00  9.220          H  
ATOM    400  HE1 HIS A  24     -22.546   3.447  -0.933  1.00  9.220          H  
ATOM    401  N   MET A  25     -15.263   1.709  -1.092  1.00  4.940          N  
ATOM    402  CA  MET A  25     -13.875   1.468  -1.453  1.00  5.050          C  
ATOM    403  C   MET A  25     -13.749   1.266  -2.956  1.00  5.220          C  
ATOM    404  O   MET A  25     -14.448   0.442  -3.544  1.00  5.320          O  
ATOM    405  CB  MET A  25     -13.359   0.268  -0.666  1.00  7.030          C  
ATOM    406  CG  MET A  25     -11.865  -0.041  -0.790  1.00  7.030          C  
ATOM    407  SD  MET A  25     -10.795   1.244  -0.074  1.00  7.030          S  
ATOM    408  CE  MET A  25     -10.892   1.087   1.683  1.00  7.030          C  
ATOM    409  H   MET A  25     -15.681   1.123  -0.375  1.00  5.930          H  
ATOM    410  HA  MET A  25     -13.284   2.324  -1.170  1.00  6.060          H  
ATOM    411 1HB  MET A  25     -13.575   0.445   0.378  1.00  8.430          H  
ATOM    412 2HB  MET A  25     -13.908  -0.624  -0.968  1.00  8.430          H  
ATOM    413 1HG  MET A  25     -11.656  -0.985  -0.286  1.00  8.430          H  
ATOM    414 2HG  MET A  25     -11.601  -0.166  -1.843  1.00  8.430          H  
ATOM    415 1HE  MET A  25     -10.265   1.840   2.154  1.00  8.430          H  
ATOM    416 2HE  MET A  25     -11.909   1.228   1.992  1.00  8.430          H  
ATOM    417 3HE  MET A  25     -10.549   0.096   1.988  1.00  8.430          H  
ATOM    418  N   GLY A  26     -12.835   2.013  -3.563  1.00  5.690          N  
ATOM    419  CA  GLY A  26     -12.577   1.989  -4.994  1.00  6.280          C  
ATOM    420  C   GLY A  26     -13.218   3.180  -5.722  1.00  6.360          C  
ATOM    421  O   GLY A  26     -12.820   3.516  -6.837  1.00  6.730          O  
ATOM    422  H   GLY A  26     -12.311   2.674  -3.003  1.00  6.830          H  
ATOM    423 1HA  GLY A  26     -11.509   1.978  -5.178  1.00  7.540          H  
ATOM    424 2HA  GLY A  26     -12.971   1.061  -5.408  1.00  7.540          H  
ATOM    425  N   ASP A  27     -14.208   3.843  -5.114  1.00  6.250          N  
ATOM    426  CA  ASP A  27     -14.828   4.987  -5.784  1.00  6.520          C  
ATOM    427  C   ASP A  27     -14.140   6.313  -5.441  1.00  6.260          C  
ATOM    428  O   ASP A  27     -13.283   6.378  -4.553  1.00  6.370          O  
ATOM    429  CB  ASP A  27     -16.319   5.060  -5.384  1.00  9.020          C  
ATOM    430  CG  ASP A  27     -17.216   5.813  -6.391  1.00  9.020          C  
ATOM    431  OD1 ASP A  27     -16.672   6.326  -7.342  1.00  9.020          O  
ATOM    432  OD2 ASP A  27     -18.406   5.874  -6.201  1.00  9.020          O  
ATOM    433  H   ASP A  27     -14.565   3.540  -4.201  1.00  7.500          H  
ATOM    434  HA  ASP A  27     -14.762   4.836  -6.863  1.00  7.820          H  
ATOM    435 1HB  ASP A  27     -16.704   4.046  -5.256  1.00 10.820          H  
ATOM    436 2HB  ASP A  27     -16.397   5.553  -4.412  1.00 10.820          H  
ATOM    437  N   SER A  28     -14.627   7.404  -6.029  1.00  6.200          N  
ATOM    438  CA  SER A  28     -14.101   8.758  -5.811  1.00  6.170          C  
ATOM    439  C   SER A  28     -14.682   9.419  -4.566  1.00  5.520          C  
ATOM    440  O   SER A  28     -15.389  10.429  -4.637  1.00  5.830          O  
ATOM    441  CB  SER A  28     -14.388   9.634  -7.018  1.00  8.650          C  
ATOM    442  OG  SER A  28     -13.717   9.178  -8.168  1.00  8.650          O  
ATOM    443  H   SER A  28     -15.354   7.260  -6.734  1.00  7.440          H  
ATOM    444  HA  SER A  28     -13.020   8.685  -5.680  1.00  7.400          H  
ATOM    445 1HB  SER A  28     -15.463   9.642  -7.204  1.00 10.380          H  
ATOM    446 2HB  SER A  28     -14.086  10.657  -6.801  1.00 10.380          H  
ATOM    447  HG  SER A  28     -14.005   9.750  -8.885  1.00 10.380          H  
ATOM    448  N   TRP A  29     -14.377   8.835  -3.428  1.00  4.960          N  
ATOM    449  CA  TRP A  29     -14.838   9.282  -2.124  1.00  4.610          C  
ATOM    450  C   TRP A  29     -14.028  10.507  -1.703  1.00  4.470          C  
ATOM    451  O   TRP A  29     -12.809  10.427  -1.657  1.00  4.440          O  
ATOM    452  CB  TRP A  29     -14.665   8.117  -1.183  1.00  6.590          C  
ATOM    453  CG  TRP A  29     -15.047   8.275   0.233  1.00  6.590          C  
ATOM    454  CD1 TRP A  29     -14.199   8.275   1.282  1.00  6.590          C  
ATOM    455  CD2 TRP A  29     -16.362   8.434   0.786  1.00  6.590          C  
ATOM    456  NE1 TRP A  29     -14.896   8.387   2.454  1.00  6.590          N  
ATOM    457  CE2 TRP A  29     -16.213   8.495   2.172  1.00  6.590          C  
ATOM    458  CE3 TRP A  29     -17.637   8.514   0.233  1.00  6.590          C  
ATOM    459  CZ2 TRP A  29     -17.287   8.635   3.017  1.00  6.590          C  
ATOM    460  CZ3 TRP A  29     -18.719   8.666   1.084  1.00  6.590          C  
ATOM    461  CH2 TRP A  29     -18.549   8.722   2.439  1.00  6.590          C  
ATOM    462  H   TRP A  29     -13.802   7.989  -3.524  1.00  5.950          H  
ATOM    463  HA  TRP A  29     -15.892   9.495  -2.196  1.00  5.530          H  
ATOM    464 1HB  TRP A  29     -15.234   7.287  -1.585  1.00  7.910          H  
ATOM    465 2HB  TRP A  29     -13.615   7.830  -1.205  1.00  7.910          H  
ATOM    466  HD1 TRP A  29     -13.122   8.163   1.193  1.00  7.910          H  
ATOM    467  HE1 TRP A  29     -14.516   8.373   3.389  1.00  7.910          H  
ATOM    468  HE3 TRP A  29     -17.786   8.466  -0.843  1.00  7.910          H  
ATOM    469  HZ2 TRP A  29     -17.167   8.679   4.100  1.00  7.910          H  
ATOM    470  HZ3 TRP A  29     -19.715   8.731   0.646  1.00  7.910          H  
ATOM    471  HH2 TRP A  29     -19.422   8.835   3.080  1.00  7.910          H  
ATOM    472  N   PRO A  30     -14.638  11.653  -1.362  1.00  4.810          N  
ATOM    473  CA  PRO A  30     -13.921  12.867  -1.024  1.00  5.040          C  
ATOM    474  C   PRO A  30     -12.883  12.617   0.049  1.00  4.710          C  
ATOM    475  O   PRO A  30     -13.203  12.080   1.110  1.00  4.900          O  
ATOM    476  CB  PRO A  30     -15.049  13.770  -0.505  1.00  7.560          C  
ATOM    477  CG  PRO A  30     -16.282  13.287  -1.240  1.00  7.560          C  
ATOM    478  CD  PRO A  30     -16.112  11.784  -1.337  1.00  7.560          C  
ATOM    479  HA  PRO A  30     -13.458  13.279  -1.935  1.00  6.050          H  
ATOM    480 1HB  PRO A  30     -15.142  13.677   0.582  1.00  9.070          H  
ATOM    481 2HB  PRO A  30     -14.816  14.823  -0.715  1.00  9.070          H  
ATOM    482 1HG  PRO A  30     -17.191  13.579  -0.688  1.00  9.070          H  
ATOM    483 2HG  PRO A  30     -16.345  13.768  -2.229  1.00  9.070          H  
ATOM    484 1HD  PRO A  30     -16.543  11.266  -0.466  1.00  9.070          H  
ATOM    485 2HD  PRO A  30     -16.564  11.480  -2.293  1.00  9.070          H  
ATOM    486  N   ARG A  31     -11.688  13.161  -0.160  1.00  4.660          N  
ATOM    487  CA  ARG A  31     -10.585  12.995   0.783  1.00  4.740          C  
ATOM    488  C   ARG A  31     -10.957  13.539   2.154  1.00  4.220          C  
ATOM    489  O   ARG A  31     -10.593  12.957   3.179  1.00  4.370          O  
ATOM    490  CB  ARG A  31      -9.346  13.692   0.255  1.00  6.600          C  
ATOM    491  CG  ARG A  31      -8.777  13.029  -0.985  1.00  6.600          C  
ATOM    492  CD  ARG A  31      -7.541  13.656  -1.466  1.00  6.600          C  
ATOM    493  NE  ARG A  31      -7.157  13.105  -2.754  1.00  6.600          N  
ATOM    494  CZ  ARG A  31      -7.514  13.608  -3.968  1.00  6.600          C  
ATOM    495  NH1 ARG A  31      -8.270  14.690  -4.061  1.00  6.600          N  
ATOM    496  NH2 ARG A  31      -7.106  13.008  -5.070  1.00  6.600          N  
ATOM    497  H   ARG A  31     -11.522  13.634  -1.036  1.00  5.590          H  
ATOM    498  HA  ARG A  31     -10.369  11.929   0.874  1.00  5.690          H  
ATOM    499 1HB  ARG A  31      -9.574  14.729   0.017  1.00  7.920          H  
ATOM    500 2HB  ARG A  31      -8.570  13.691   1.023  1.00  7.920          H  
ATOM    501 1HG  ARG A  31      -8.555  11.984  -0.758  1.00  7.920          H  
ATOM    502 2HG  ARG A  31      -9.508  13.068  -1.787  1.00  7.920          H  
ATOM    503 1HD  ARG A  31      -7.660  14.732  -1.555  1.00  7.920          H  
ATOM    504 2HD  ARG A  31      -6.738  13.441  -0.759  1.00  7.920          H  
ATOM    505  HE  ARG A  31      -6.570  12.262  -2.738  1.00  7.920          H  
ATOM    506 1HH1 ARG A  31      -8.591  15.161  -3.230  1.00  7.920          H  
ATOM    507 2HH1 ARG A  31      -8.524  15.053  -4.971  1.00  7.920          H  
ATOM    508 1HH2 ARG A  31      -6.530  12.176  -5.005  1.00  7.920          H  
ATOM    509 2HH2 ARG A  31      -7.365  13.373  -5.974  1.00  7.920          H  
ATOM    510  N   SER A  32     -11.708  14.641   2.156  1.00  4.130          N  
ATOM    511  CA  SER A  32     -12.156  15.280   3.379  1.00  4.230          C  
ATOM    512  C   SER A  32     -13.058  14.360   4.189  1.00  4.170          C  
ATOM    513  O   SER A  32     -13.011  14.388   5.428  1.00  4.460          O  
ATOM    514  CB  SER A  32     -12.924  16.550   3.049  1.00  5.880          C  
ATOM    515  OG  SER A  32     -12.092  17.512   2.453  1.00  5.880          O  
ATOM    516  H   SER A  32     -11.951  15.070   1.277  1.00  4.960          H  
ATOM    517  HA  SER A  32     -11.284  15.533   3.980  1.00  5.080          H  
ATOM    518 1HB  SER A  32     -13.748  16.310   2.377  1.00  7.060          H  
ATOM    519 2HB  SER A  32     -13.355  16.955   3.962  1.00  7.060          H  
ATOM    520  HG  SER A  32     -12.640  18.293   2.326  1.00  7.060          H  
ATOM    521  N   SER A  33     -13.907  13.573   3.503  1.00  4.330          N  
ATOM    522  CA  SER A  33     -14.839  12.673   4.154  1.00  4.850          C  
ATOM    523  C   SER A  33     -14.057  11.520   4.719  1.00  4.800          C  
ATOM    524  O   SER A  33     -14.339  11.047   5.824  1.00  4.980          O  
ATOM    525  CB  SER A  33     -15.892  12.158   3.181  1.00  6.580          C  
ATOM    526  OG  SER A  33     -16.731  13.195   2.735  1.00  6.580          O  
ATOM    527  H   SER A  33     -13.881  13.541   2.489  1.00  5.200          H  
ATOM    528  HA  SER A  33     -15.333  13.200   4.972  1.00  5.820          H  
ATOM    529 1HB  SER A  33     -15.405  11.686   2.326  1.00  7.900          H  
ATOM    530 2HB  SER A  33     -16.487  11.397   3.671  1.00  7.900          H  
ATOM    531  HG  SER A  33     -17.371  12.778   2.152  1.00  7.900          H  
ATOM    532  N   ALA A  34     -13.050  11.068   3.959  1.00  4.950          N  
ATOM    533  CA  ALA A  34     -12.228   9.965   4.415  1.00  5.250          C  
ATOM    534  C   ALA A  34     -11.537  10.333   5.714  1.00  5.180          C  
ATOM    535  O   ALA A  34     -11.613   9.580   6.683  1.00  5.230          O  
ATOM    536  CB  ALA A  34     -11.190   9.610   3.363  1.00  7.230          C  
ATOM    537  H   ALA A  34     -12.911  11.480   3.029  1.00  5.940          H  
ATOM    538  HA  ALA A  34     -12.871   9.107   4.597  1.00  6.300          H  
ATOM    539 1HB  ALA A  34     -10.606   8.787   3.707  1.00  8.680          H  
ATOM    540 2HB  ALA A  34     -11.677   9.345   2.439  1.00  8.680          H  
ATOM    541 3HB  ALA A  34     -10.540  10.460   3.188  1.00  8.680          H  
ATOM    542  N   HIS A  35     -10.995  11.550   5.800  1.00  5.430          N  
ATOM    543  CA  HIS A  35     -10.348  11.953   7.037  1.00  5.770          C  
ATOM    544  C   HIS A  35     -11.336  12.131   8.186  1.00  5.430          C  
ATOM    545  O   HIS A  35     -11.080  11.642   9.287  1.00  5.750          O  
ATOM    546  CB  HIS A  35      -9.524  13.235   6.839  1.00  7.940          C  
ATOM    547  CG  HIS A  35      -8.125  13.019   6.280  1.00  7.940          C  
ATOM    548  ND1 HIS A  35      -7.068  12.662   7.100  1.00  7.940          N  
ATOM    549  CD2 HIS A  35      -7.613  13.098   5.024  1.00  7.940          C  
ATOM    550  CE1 HIS A  35      -5.969  12.517   6.373  1.00  7.940          C  
ATOM    551  NE2 HIS A  35      -6.258  12.778   5.112  1.00  7.940          N  
ATOM    552  H   HIS A  35     -10.960  12.152   4.970  1.00  6.520          H  
ATOM    553  HA  HIS A  35      -9.647  11.174   7.330  1.00  6.920          H  
ATOM    554 1HB  HIS A  35     -10.063  13.895   6.154  1.00  9.530          H  
ATOM    555 2HB  HIS A  35      -9.435  13.756   7.792  1.00  9.530          H  
ATOM    556  HD1 HIS A  35      -7.010  13.005   8.044  1.00  9.530          H  
ATOM    557  HD2 HIS A  35      -8.059  13.343   4.060  1.00  9.530          H  
ATOM    558  HE1 HIS A  35      -5.030  12.225   6.848  1.00  9.530          H  
ATOM    559  N   GLU A  36     -12.492  12.765   7.958  1.00  5.100          N  
ATOM    560  CA  GLU A  36     -13.406  12.918   9.083  1.00  5.160          C  
ATOM    561  C   GLU A  36     -13.812  11.559   9.637  1.00  4.820          C  
ATOM    562  O   GLU A  36     -13.854  11.358  10.850  1.00  4.970          O  
ATOM    563  CB  GLU A  36     -14.668  13.692   8.691  1.00  7.200          C  
ATOM    564  CG  GLU A  36     -15.640  13.927   9.874  1.00  7.200          C  
ATOM    565  CD  GLU A  36     -16.865  14.720   9.516  1.00  7.200          C  
ATOM    566  OE1 GLU A  36     -17.027  15.055   8.371  1.00  7.200          O  
ATOM    567  OE2 GLU A  36     -17.643  14.992  10.399  1.00  7.200          O  
ATOM    568  H   GLU A  36     -12.708  13.171   7.040  1.00  6.120          H  
ATOM    569  HA  GLU A  36     -12.892  13.469   9.872  1.00  6.190          H  
ATOM    570 1HB  GLU A  36     -14.388  14.659   8.273  1.00  8.640          H  
ATOM    571 2HB  GLU A  36     -15.201  13.142   7.911  1.00  8.640          H  
ATOM    572 1HG  GLU A  36     -15.963  12.961  10.263  1.00  8.640          H  
ATOM    573 2HG  GLU A  36     -15.100  14.439  10.670  1.00  8.640          H  
ATOM    574  N   ALA A  37     -14.147  10.620   8.748  1.00  4.750          N  
ATOM    575  CA  ALA A  37     -14.553   9.292   9.175  1.00  4.830          C  
ATOM    576  C   ALA A  37     -13.415   8.562   9.880  1.00  4.870          C  
ATOM    577  O   ALA A  37     -13.608   7.936  10.916  1.00  5.130          O  
ATOM    578  CB  ALA A  37     -15.026   8.501   7.971  1.00  6.730          C  
ATOM    579  H   ALA A  37     -14.119  10.836   7.748  1.00  5.700          H  
ATOM    580  HA  ALA A  37     -15.373   9.402   9.881  1.00  5.800          H  
ATOM    581 1HB  ALA A  37     -15.368   7.531   8.279  1.00  8.080          H  
ATOM    582 2HB  ALA A  37     -15.843   9.034   7.492  1.00  8.080          H  
ATOM    583 3HB  ALA A  37     -14.198   8.392   7.259  1.00  8.080          H  
ATOM    584  N   ALA A  38     -12.201   8.707   9.355  1.00  5.010          N  
ATOM    585  CA  ALA A  38     -11.007   8.068   9.877  1.00  5.440          C  
ATOM    586  C   ALA A  38     -10.687   8.448  11.296  1.00  5.350          C  
ATOM    587  O   ALA A  38     -10.213   7.623  12.077  1.00  5.720          O  
ATOM    588  CB  ALA A  38      -9.861   8.447   9.033  1.00  7.440          C  
ATOM    589  H   ALA A  38     -12.093   9.228   8.481  1.00  6.010          H  
ATOM    590  HA  ALA A  38     -11.166   6.995   9.835  1.00  6.530          H  
ATOM    591 1HB  ALA A  38      -8.982   7.948   9.380  1.00  8.930          H  
ATOM    592 2HB  ALA A  38     -10.081   8.170   8.029  1.00  8.930          H  
ATOM    593 3HB  ALA A  38      -9.725   9.516   9.084  1.00  8.930          H  
ATOM    594  N   GLU A  39     -10.991   9.686  11.653  1.00  5.200          N  
ATOM    595  CA  GLU A  39     -10.772  10.211  12.990  1.00  5.560          C  
ATOM    596  C   GLU A  39     -11.615   9.475  14.038  1.00  5.600          C  
ATOM    597  O   GLU A  39     -11.360   9.604  15.236  1.00  6.150          O  
ATOM    598  CB  GLU A  39     -11.017  11.723  13.035  1.00  7.640          C  
ATOM    599  CG  GLU A  39      -9.937  12.545  12.307  1.00  7.640          C  
ATOM    600  CD  GLU A  39     -10.212  14.030  12.274  1.00  7.640          C  
ATOM    601  OE1 GLU A  39     -11.249  14.440  12.735  1.00  7.640          O  
ATOM    602  OE2 GLU A  39      -9.374  14.754  11.784  1.00  7.640          O  
ATOM    603  H   GLU A  39     -11.342  10.328  10.930  1.00  6.240          H  
ATOM    604  HA  GLU A  39      -9.724  10.049  13.242  1.00  6.670          H  
ATOM    605 1HB  GLU A  39     -11.980  11.947  12.572  1.00  9.170          H  
ATOM    606 2HB  GLU A  39     -11.062  12.056  14.070  1.00  9.170          H  
ATOM    607 1HG  GLU A  39      -8.992  12.382  12.819  1.00  9.170          H  
ATOM    608 2HG  GLU A  39      -9.822  12.174  11.298  1.00  9.170          H  
ATOM    609  N   LEU A  40     -12.645   8.734  13.604  1.00  5.320          N  
ATOM    610  CA  LEU A  40     -13.493   7.990  14.521  1.00  5.730          C  
ATOM    611  C   LEU A  40     -12.899   6.606  14.823  1.00  6.020          C  
ATOM    612  O   LEU A  40     -13.434   5.866  15.655  1.00  6.600          O  
ATOM    613  CB  LEU A  40     -14.878   7.791  13.896  1.00  7.860          C  
ATOM    614  CG  LEU A  40     -15.691   9.067  13.555  1.00  7.860          C  
ATOM    615  CD1 LEU A  40     -16.947   8.645  12.810  1.00  7.860          C  
ATOM    616  CD2 LEU A  40     -16.043   9.850  14.835  1.00  7.860          C  
ATOM    617  H   LEU A  40     -12.832   8.650  12.601  1.00  6.380          H  
ATOM    618  HA  LEU A  40     -13.567   8.536  15.456  1.00  6.880          H  
ATOM    619 1HB  LEU A  40     -14.754   7.217  12.976  1.00  9.430          H  
ATOM    620 2HB  LEU A  40     -15.476   7.191  14.580  1.00  9.430          H  
ATOM    621  HG  LEU A  40     -15.100   9.709  12.888  1.00  9.430          H  
ATOM    622 1HD1 LEU A  40     -17.523   9.530  12.539  1.00  9.430          H  
ATOM    623 2HD1 LEU A  40     -16.658   8.106  11.903  1.00  9.430          H  
ATOM    624 3HD1 LEU A  40     -17.549   7.996  13.444  1.00  9.430          H  
ATOM    625 1HD2 LEU A  40     -16.615  10.738  14.565  1.00  9.430          H  
ATOM    626 2HD2 LEU A  40     -16.636   9.223  15.500  1.00  9.430          H  
ATOM    627 3HD2 LEU A  40     -15.133  10.160  15.344  1.00  9.430          H  
ATOM    628  N   ASN A  41     -11.817   6.235  14.133  1.00  5.950          N  
ATOM    629  CA  ASN A  41     -11.174   4.949  14.335  1.00  6.550          C  
ATOM    630  C   ASN A  41     -10.056   5.109  15.364  1.00  6.550          C  
ATOM    631  O   ASN A  41      -9.766   6.212  15.819  1.00  7.010          O  
ATOM    632  CB  ASN A  41     -10.623   4.415  13.009  1.00  8.930          C  
ATOM    633  CG  ASN A  41     -10.456   2.898  12.984  1.00  8.930          C  
ATOM    634  OD1 ASN A  41     -10.544   2.254  14.039  1.00  8.930          O  
ATOM    635  ND2 ASN A  41     -10.208   2.325  11.837  1.00  8.930          N  
ATOM    636  H   ASN A  41     -11.396   6.876  13.454  1.00  7.140          H  
ATOM    637  HA  ASN A  41     -11.905   4.247  14.736  1.00  7.860          H  
ATOM    638 1HB  ASN A  41     -11.289   4.715  12.197  1.00 10.720          H  
ATOM    639 2HB  ASN A  41      -9.651   4.879  12.811  1.00 10.720          H  
ATOM    640 1HD2 ASN A  41     -10.079   1.336  11.786  1.00 10.720          H  
ATOM    641 2HD2 ASN A  41     -10.102   2.866  10.986  1.00 10.720          H  
ATOM    642  N   ARG A  42      -9.373   4.015  15.688  1.00  6.350          N  
ATOM    643  CA  ARG A  42      -8.250   4.101  16.617  1.00  6.660          C  
ATOM    644  C   ARG A  42      -7.126   4.997  16.086  1.00  6.300          C  
ATOM    645  O   ARG A  42      -6.489   5.709  16.872  1.00  6.320          O  
ATOM    646  CB  ARG A  42      -7.681   2.725  16.943  1.00  9.200          C  
ATOM    647  CG  ARG A  42      -8.572   1.859  17.837  1.00  9.200          C  
ATOM    648  CD  ARG A  42      -7.839   0.670  18.400  1.00  9.200          C  
ATOM    649  NE  ARG A  42      -7.423  -0.294  17.374  1.00  9.200          N  
ATOM    650  CZ  ARG A  42      -8.169  -1.327  16.909  1.00  9.200          C  
ATOM    651  NH1 ARG A  42      -9.389  -1.544  17.369  1.00  9.200          N  
ATOM    652  NH2 ARG A  42      -7.665  -2.129  15.983  1.00  9.200          N  
ATOM    653  H   ARG A  42      -9.678   3.130  15.305  1.00  7.620          H  
ATOM    654  HA  ARG A  42      -8.616   4.538  17.544  1.00  7.990          H  
ATOM    655 1HB  ARG A  42      -7.511   2.177  16.018  1.00 11.040          H  
ATOM    656 2HB  ARG A  42      -6.719   2.840  17.439  1.00 11.040          H  
ATOM    657 1HG  ARG A  42      -8.938   2.459  18.668  1.00 11.040          H  
ATOM    658 2HG  ARG A  42      -9.418   1.498  17.253  1.00 11.040          H  
ATOM    659 1HD  ARG A  42      -6.942   1.025  18.908  1.00 11.040          H  
ATOM    660 2HD  ARG A  42      -8.470   0.160  19.125  1.00 11.040          H  
ATOM    661  HE  ARG A  42      -6.492  -0.185  16.989  1.00 11.040          H  
ATOM    662 1HH1 ARG A  42      -9.783  -0.942  18.075  1.00 11.040          H  
ATOM    663 2HH1 ARG A  42      -9.931  -2.320  17.017  1.00 11.040          H  
ATOM    664 1HH2 ARG A  42      -6.732  -1.967  15.629  1.00 11.040          H  
ATOM    665 2HH2 ARG A  42      -8.209  -2.902  15.629  1.00 11.040          H  
ATOM    666  N   GLN A  43      -6.864   4.925  14.769  1.00  6.240          N  
ATOM    667  CA  GLN A  43      -5.833   5.711  14.088  1.00  6.140          C  
ATOM    668  C   GLN A  43      -6.278   6.172  12.697  1.00  5.650          C  
ATOM    669  O   GLN A  43      -6.759   5.380  11.883  1.00  5.780          O  
ATOM    670  CB  GLN A  43      -4.542   4.904  13.927  1.00  8.640          C  
ATOM    671  CG  GLN A  43      -3.817   4.538  15.204  1.00  8.640          C  
ATOM    672  CD  GLN A  43      -3.100   5.739  15.812  1.00  8.640          C  
ATOM    673  OE1 GLN A  43      -1.939   6.035  15.500  1.00  8.640          O  
ATOM    674  NE2 GLN A  43      -3.808   6.458  16.665  1.00  8.640          N  
ATOM    675  H   GLN A  43      -7.439   4.309  14.212  1.00  7.490          H  
ATOM    676  HA  GLN A  43      -5.638   6.605  14.674  1.00  7.370          H  
ATOM    677 1HB  GLN A  43      -4.743   3.988  13.372  1.00 10.360          H  
ATOM    678 2HB  GLN A  43      -3.868   5.487  13.344  1.00 10.360          H  
ATOM    679 1HG  GLN A  43      -4.511   4.147  15.931  1.00 10.360          H  
ATOM    680 2HG  GLN A  43      -3.073   3.783  14.969  1.00 10.360          H  
ATOM    681 1HE2 GLN A  43      -3.413   7.264  17.104  1.00 10.360          H  
ATOM    682 2HE2 GLN A  43      -4.778   6.198  16.862  1.00 10.360          H  
ATOM    683  N   CYS A  44      -5.975   7.425  12.362  1.00  5.380          N  
ATOM    684  CA  CYS A  44      -6.311   7.975  11.046  1.00  5.110          C  
ATOM    685  C   CYS A  44      -5.206   7.739  10.010  1.00  5.030          C  
ATOM    686  O   CYS A  44      -4.588   8.683   9.509  1.00  5.400          O  
ATOM    687  CB  CYS A  44      -6.555   9.475  11.199  1.00  7.260          C  
ATOM    688  SG  CYS A  44      -6.952  10.316   9.705  1.00  7.260          S  
ATOM    689  H   CYS A  44      -5.546   8.019  13.055  1.00  6.460          H  
ATOM    690  HA  CYS A  44      -7.225   7.498  10.707  1.00  6.130          H  
ATOM    691 1HB  CYS A  44      -7.379   9.632  11.897  1.00  8.710          H  
ATOM    692 2HB  CYS A  44      -5.673   9.944  11.623  1.00  8.710          H  
ATOM    693  HG  CYS A  44      -5.877   9.834   9.032  1.00  8.710          H  
ATOM    694  N   TRP A  45      -4.996   6.469   9.686  1.00  4.960          N  
ATOM    695  CA  TRP A  45      -3.923   6.020   8.777  1.00  5.230          C  
ATOM    696  C   TRP A  45      -4.318   5.997   7.304  1.00  5.390          C  
ATOM    697  O   TRP A  45      -5.504   5.986   6.978  1.00  5.660          O  
ATOM    698  CB  TRP A  45      -3.358   4.720   9.299  1.00  7.210          C  
ATOM    699  CG  TRP A  45      -2.535   4.946  10.566  1.00  7.210          C  
ATOM    700  CD1 TRP A  45      -2.212   6.150  11.158  1.00  7.210          C  
ATOM    701  CD2 TRP A  45      -1.944   3.948  11.391  1.00  7.210          C  
ATOM    702  NE1 TRP A  45      -1.462   5.941  12.257  1.00  7.210          N  
ATOM    703  CE2 TRP A  45      -1.277   4.608  12.421  1.00  7.210          C  
ATOM    704  CE3 TRP A  45      -1.917   2.587  11.347  1.00  7.210          C  
ATOM    705  CZ2 TRP A  45      -0.587   3.928  13.390  1.00  7.210          C  
ATOM    706  CZ3 TRP A  45      -1.221   1.898  12.316  1.00  7.210          C  
ATOM    707  CH2 TRP A  45      -0.569   2.551  13.311  1.00  7.210          C  
ATOM    708  H   TRP A  45      -5.597   5.792  10.168  1.00  5.950          H  
ATOM    709  HA  TRP A  45      -3.113   6.741   8.831  1.00  6.280          H  
ATOM    710 1HB  TRP A  45      -4.168   4.025   9.518  1.00  8.660          H  
ATOM    711 2HB  TRP A  45      -2.721   4.274   8.548  1.00  8.660          H  
ATOM    712  HD1 TRP A  45      -2.497   7.138  10.819  1.00  8.660          H  
ATOM    713  HE1 TRP A  45      -1.093   6.663  12.870  1.00  8.660          H  
ATOM    714  HE3 TRP A  45      -2.436   2.058  10.560  1.00  8.660          H  
ATOM    715  HZ2 TRP A  45      -0.067   4.447  14.198  1.00  8.660          H  
ATOM    716  HZ3 TRP A  45      -1.206   0.808  12.254  1.00  8.660          H  
ATOM    717  HH2 TRP A  45      -0.030   1.976  14.061  1.00  8.660          H  
ATOM    718  N   VAL A  46      -3.318   6.054   6.400  1.00  5.630          N  
ATOM    719  CA  VAL A  46      -3.664   6.260   4.978  1.00  6.190          C  
ATOM    720  C   VAL A  46      -3.256   5.188   3.949  1.00  6.140          C  
ATOM    721  O   VAL A  46      -2.094   4.791   3.846  1.00  6.660          O  
ATOM    722  CB  VAL A  46      -3.055   7.606   4.549  1.00  8.440          C  
ATOM    723  CG1 VAL A  46      -3.387   7.901   3.089  1.00  8.440          C  
ATOM    724  CG2 VAL A  46      -3.557   8.707   5.470  1.00  8.440          C  
ATOM    725  H   VAL A  46      -2.344   5.943   6.711  1.00  6.760          H  
ATOM    726  HA  VAL A  46      -4.746   6.359   4.913  1.00  7.430          H  
ATOM    727  HB  VAL A  46      -1.981   7.546   4.629  1.00 10.130          H  
ATOM    728 1HG1 VAL A  46      -2.939   8.841   2.796  1.00 10.130          H  
ATOM    729 2HG1 VAL A  46      -3.000   7.130   2.433  1.00 10.130          H  
ATOM    730 3HG1 VAL A  46      -4.469   7.964   2.956  1.00 10.130          H  
ATOM    731 1HG2 VAL A  46      -3.125   9.625   5.182  1.00 10.130          H  
ATOM    732 2HG2 VAL A  46      -4.609   8.779   5.391  1.00 10.130          H  
ATOM    733 3HG2 VAL A  46      -3.287   8.504   6.501  1.00 10.130          H  
ATOM    734  N   LEU A  47      -4.262   4.755   3.176  1.00  5.810          N  
ATOM    735  CA  LEU A  47      -4.155   3.781   2.093  1.00  6.080          C  
ATOM    736  C   LEU A  47      -4.464   4.465   0.752  1.00  6.080          C  
ATOM    737  O   LEU A  47      -5.625   4.511   0.328  1.00  6.460          O  
ATOM    738  CB  LEU A  47      -5.197   2.676   2.359  1.00  8.400          C  
ATOM    739  CG  LEU A  47      -5.322   1.465   1.391  1.00  8.400          C  
ATOM    740  CD1 LEU A  47      -4.015   0.687   1.361  1.00  8.400          C  
ATOM    741  CD2 LEU A  47      -6.475   0.553   1.885  1.00  8.400          C  
ATOM    742  H   LEU A  47      -5.181   5.169   3.329  1.00  6.970          H  
ATOM    743  HA  LEU A  47      -3.141   3.385   2.074  1.00  7.300          H  
ATOM    744 1HB  LEU A  47      -5.021   2.300   3.319  1.00 10.080          H  
ATOM    745 2HB  LEU A  47      -6.174   3.156   2.387  1.00 10.080          H  
ATOM    746  HG  LEU A  47      -5.539   1.815   0.379  1.00 10.080          H  
ATOM    747 1HD1 LEU A  47      -4.115  -0.160   0.703  1.00 10.080          H  
ATOM    748 2HD1 LEU A  47      -3.221   1.327   1.001  1.00 10.080          H  
ATOM    749 3HD1 LEU A  47      -3.774   0.326   2.341  1.00 10.080          H  
ATOM    750 1HD2 LEU A  47      -6.581  -0.301   1.222  1.00 10.080          H  
ATOM    751 2HD2 LEU A  47      -6.261   0.198   2.888  1.00 10.080          H  
ATOM    752 3HD2 LEU A  47      -7.409   1.120   1.896  1.00 10.080          H  
ATOM    753  N   GLY A  48      -3.472   4.960   0.032  1.00  6.040          N  
ATOM    754  CA  GLY A  48      -3.812   5.739  -1.143  1.00  6.430          C  
ATOM    755  C   GLY A  48      -4.627   6.944  -0.691  1.00  6.050          C  
ATOM    756  O   GLY A  48      -4.224   7.663   0.214  1.00  6.250          O  
ATOM    757  H   GLY A  48      -2.485   4.871   0.287  1.00  7.250          H  
ATOM    758 1HA  GLY A  48      -2.899   6.059  -1.642  1.00  7.720          H  
ATOM    759 2HA  GLY A  48      -4.392   5.131  -1.832  1.00  7.720          H  
ATOM    760  N   HIS A  49      -5.802   7.155  -1.266  1.00  5.880          N  
ATOM    761  CA  HIS A  49      -6.594   8.308  -0.843  1.00  5.940          C  
ATOM    762  C   HIS A  49      -7.663   7.912   0.177  1.00  5.530          C  
ATOM    763  O   HIS A  49      -8.521   8.718   0.545  1.00  6.000          O  
ATOM    764  CB  HIS A  49      -7.260   8.971  -2.041  1.00  8.290          C  
ATOM    765  CG  HIS A  49      -6.305   9.527  -3.036  1.00  8.290          C  
ATOM    766  ND1 HIS A  49      -5.485  10.607  -2.772  1.00  8.290          N  
ATOM    767  CD2 HIS A  49      -6.043   9.158  -4.303  1.00  8.290          C  
ATOM    768  CE1 HIS A  49      -4.738  10.854  -3.832  1.00  8.290          C  
ATOM    769  NE2 HIS A  49      -5.061   9.997  -4.775  1.00  8.290          N  
ATOM    770  H   HIS A  49      -6.125   6.550  -2.010  1.00  7.060          H  
ATOM    771  HA  HIS A  49      -5.946   9.045  -0.370  1.00  7.130          H  
ATOM    772 1HB  HIS A  49      -7.871   8.233  -2.549  1.00  9.950          H  
ATOM    773 2HB  HIS A  49      -7.904   9.770  -1.699  1.00  9.950          H  
ATOM    774  HD2 HIS A  49      -6.516   8.343  -4.846  1.00  9.950          H  
ATOM    775  HE1 HIS A  49      -3.992  11.641  -3.915  1.00  9.950          H  
ATOM    776  HE2 HIS A  49      -4.652   9.952  -5.701  1.00  9.950          H  
ATOM    777  N   TRP A  50      -7.624   6.656   0.607  1.00  5.010          N  
ATOM    778  CA  TRP A  50      -8.554   6.129   1.585  1.00  5.000          C  
ATOM    779  C   TRP A  50      -7.979   6.303   2.970  1.00  4.710          C  
ATOM    780  O   TRP A  50      -6.823   5.976   3.231  1.00  4.640          O  
ATOM    781  CB  TRP A  50      -8.847   4.685   1.250  1.00  7.000          C  
ATOM    782  CG  TRP A  50      -9.628   4.650   0.049  1.00  7.000          C  
ATOM    783  CD1 TRP A  50      -9.195   4.476  -1.224  1.00  7.000          C  
ATOM    784  CD2 TRP A  50     -11.031   4.817  -0.016  1.00  7.000          C  
ATOM    785  NE1 TRP A  50     -10.254   4.532  -2.083  1.00  7.000          N  
ATOM    786  CE2 TRP A  50     -11.386   4.746  -1.350  1.00  7.000          C  
ATOM    787  CE3 TRP A  50     -12.008   5.030   0.945  1.00  7.000          C  
ATOM    788  CZ2 TRP A  50     -12.665   4.877  -1.741  1.00  7.000          C  
ATOM    789  CZ3 TRP A  50     -13.301   5.137   0.547  1.00  7.000          C  
ATOM    790  CH2 TRP A  50     -13.619   5.066  -0.752  1.00  7.000          C  
ATOM    791  H   TRP A  50      -6.884   6.035   0.278  1.00  6.010          H  
ATOM    792  HA  TRP A  50      -9.483   6.691   1.524  1.00  6.000          H  
ATOM    793 1HB  TRP A  50      -7.932   4.134   1.091  1.00  8.400          H  
ATOM    794 2HB  TRP A  50      -9.396   4.209   2.057  1.00  8.400          H  
ATOM    795  HD1 TRP A  50      -8.155   4.324  -1.513  1.00  8.400          H  
ATOM    796  HE1 TRP A  50     -10.195   4.441  -3.103  1.00  8.400          H  
ATOM    797  HE3 TRP A  50     -11.745   5.093   1.994  1.00  8.400          H  
ATOM    798  HZ2 TRP A  50     -12.964   4.826  -2.783  1.00  8.400          H  
ATOM    799  HZ3 TRP A  50     -14.071   5.292   1.301  1.00  8.400          H  
ATOM    800  HH2 TRP A  50     -14.656   5.165  -1.037  1.00  8.400          H  
ATOM    801  N   VAL A  51      -8.782   6.782   3.897  1.00  4.960          N  
ATOM    802  CA  VAL A  51      -8.204   7.037   5.197  1.00  5.140          C  
ATOM    803  C   VAL A  51      -9.010   6.380   6.323  1.00  5.300          C  
ATOM    804  O   VAL A  51     -10.246   6.389   6.309  1.00  5.680          O  
ATOM    805  CB  VAL A  51      -8.082   8.565   5.393  1.00  7.120          C  
ATOM    806  CG1 VAL A  51      -7.368   8.871   6.656  1.00  7.120          C  
ATOM    807  CG2 VAL A  51      -7.389   9.206   4.182  1.00  7.120          C  
ATOM    808  H   VAL A  51      -9.744   7.009   3.690  1.00  5.950          H  
ATOM    809  HA  VAL A  51      -7.200   6.622   5.230  1.00  6.170          H  
ATOM    810  HB  VAL A  51      -9.067   8.984   5.503  1.00  8.550          H  
ATOM    811 1HG1 VAL A  51      -7.330   9.935   6.777  1.00  8.550          H  
ATOM    812 2HG1 VAL A  51      -7.848   8.453   7.463  1.00  8.550          H  
ATOM    813 3HG1 VAL A  51      -6.373   8.474   6.624  1.00  8.550          H  
ATOM    814 1HG2 VAL A  51      -7.323  10.273   4.335  1.00  8.550          H  
ATOM    815 2HG2 VAL A  51      -6.401   8.799   4.067  1.00  8.550          H  
ATOM    816 3HG2 VAL A  51      -7.952   9.027   3.272  1.00  8.550          H  
ATOM    817  N   GLY A  52      -8.275   5.791   7.276  1.00  5.390          N  
ATOM    818  CA  GLY A  52      -8.798   5.146   8.482  1.00  5.910          C  
ATOM    819  C   GLY A  52      -8.932   3.628   8.411  1.00  6.060          C  
ATOM    820  O   GLY A  52      -9.482   3.004   9.318  1.00  6.520          O  
ATOM    821  H   GLY A  52      -7.265   5.833   7.149  1.00  6.470          H  
ATOM    822 1HA  GLY A  52      -8.152   5.404   9.323  1.00  7.090          H  
ATOM    823 2HA  GLY A  52      -9.771   5.564   8.703  1.00  7.090          H  
ATOM    824  N   THR A  53      -8.485   3.028   7.328  1.00  6.080          N  
ATOM    825  CA  THR A  53      -8.545   1.578   7.188  1.00  6.650          C  
ATOM    826  C   THR A  53      -7.526   0.953   8.160  1.00  6.790          C  
ATOM    827  O   THR A  53      -6.498   1.556   8.459  1.00  7.290          O  
ATOM    828  CB  THR A  53      -8.350   1.142   5.710  1.00  9.080          C  
ATOM    829  OG1 THR A  53      -9.394   1.674   4.912  1.00  9.080          O  
ATOM    830  CG2 THR A  53      -8.318  -0.278   5.536  1.00  9.080          C  
ATOM    831  H   THR A  53      -8.099   3.594   6.585  1.00  7.300          H  
ATOM    832  HA  THR A  53      -9.538   1.240   7.489  1.00  7.980          H  
ATOM    833  HB  THR A  53      -7.449   1.513   5.349  1.00 10.900          H  
ATOM    834  HG1 THR A  53     -10.260   1.449   5.324  1.00 10.900          H  
ATOM    835 1HG2 THR A  53      -8.173  -0.464   4.488  1.00 10.900          H  
ATOM    836 2HG2 THR A  53      -7.505  -0.682   6.090  1.00 10.900          H  
ATOM    837 3HG2 THR A  53      -9.247  -0.714   5.872  1.00 10.900          H  
ATOM    838  N   GLY A  54      -7.841  -0.192   8.759  1.00  6.640          N  
ATOM    839  CA  GLY A  54      -6.856  -0.821   9.641  1.00  7.010          C  
ATOM    840  C   GLY A  54      -5.819  -1.571   8.809  1.00  6.790          C  
ATOM    841  O   GLY A  54      -6.007  -1.754   7.616  1.00  7.250          O  
ATOM    842  H   GLY A  54      -8.727  -0.635   8.560  1.00  7.970          H  
ATOM    843 1HA  GLY A  54      -6.370  -0.057  10.250  1.00  8.410          H  
ATOM    844 2HA  GLY A  54      -7.358  -1.508  10.321  1.00  8.410          H  
ATOM    845  N   GLY A  55      -4.727  -2.038   9.431  1.00  6.400          N  
ATOM    846  CA  GLY A  55      -3.695  -2.781   8.684  1.00  6.550          C  
ATOM    847  C   GLY A  55      -2.767  -1.854   7.877  1.00  6.080          C  
ATOM    848  O   GLY A  55      -2.069  -2.291   6.949  1.00  6.340          O  
ATOM    849  H   GLY A  55      -4.610  -1.885  10.425  1.00  7.680          H  
ATOM    850 1HA  GLY A  55      -3.098  -3.365   9.382  1.00  7.860          H  
ATOM    851 2HA  GLY A  55      -4.176  -3.491   8.013  1.00  7.860          H  
ATOM    852  N   LEU A  56      -2.816  -0.573   8.208  1.00  5.680          N  
ATOM    853  CA  LEU A  56      -2.061   0.494   7.570  1.00  5.590          C  
ATOM    854  C   LEU A  56      -0.969   1.061   8.439  1.00  5.240          C  
ATOM    855  O   LEU A  56      -0.703   0.566   9.537  1.00  5.530          O  
ATOM    856  CB  LEU A  56      -2.971   1.640   7.187  1.00  7.860          C  
ATOM    857  CG  LEU A  56      -4.138   1.335   6.358  1.00  7.860          C  
ATOM    858  CD1 LEU A  56      -4.840   2.647   6.160  1.00  7.860          C  
ATOM    859  CD2 LEU A  56      -3.748   0.688   5.094  1.00  7.860          C  
ATOM    860  H   LEU A  56      -3.433  -0.323   8.968  1.00  6.820          H  
ATOM    861  HA  LEU A  56      -1.575   0.092   6.681  1.00  6.710          H  
ATOM    862 1HB  LEU A  56      -3.364   2.049   8.110  1.00  9.430          H  
ATOM    863 2HB  LEU A  56      -2.409   2.416   6.680  1.00  9.430          H  
ATOM    864  HG  LEU A  56      -4.805   0.658   6.884  1.00  9.430          H  
ATOM    865 1HD1 LEU A  56      -5.692   2.538   5.576  1.00  9.430          H  
ATOM    866 2HD1 LEU A  56      -5.120   3.074   7.120  1.00  9.430          H  
ATOM    867 3HD1 LEU A  56      -4.175   3.312   5.664  1.00  9.430          H  
ATOM    868 1HD2 LEU A  56      -4.643   0.483   4.529  1.00  9.430          H  
ATOM    869 2HD2 LEU A  56      -3.086   1.345   4.533  1.00  9.430          H  
ATOM    870 3HD2 LEU A  56      -3.247  -0.245   5.287  1.00  9.430          H  
ATOM    871  N   VAL A  57      -0.311   2.088   7.912  1.00  4.990          N  
ATOM    872  CA  VAL A  57       0.730   2.824   8.595  1.00  5.020          C  
ATOM    873  C   VAL A  57       0.422   4.343   8.516  1.00  5.220          C  
ATOM    874  O   VAL A  57      -0.396   4.753   7.672  1.00  5.290          O  
ATOM    875  CB  VAL A  57       2.091   2.497   7.930  1.00  7.020          C  
ATOM    876  CG1 VAL A  57       2.366   1.002   8.032  1.00  7.020          C  
ATOM    877  CG2 VAL A  57       2.073   2.953   6.467  1.00  7.020          C  
ATOM    878  H   VAL A  57      -0.576   2.397   6.985  1.00  5.990          H  
ATOM    879  HA  VAL A  57       0.740   2.481   9.627  1.00  6.020          H  
ATOM    880  HB  VAL A  57       2.884   3.001   8.442  1.00  8.420          H  
ATOM    881 1HG1 VAL A  57       3.332   0.778   7.579  1.00  8.420          H  
ATOM    882 2HG1 VAL A  57       2.382   0.712   9.082  1.00  8.420          H  
ATOM    883 3HG1 VAL A  57       1.596   0.440   7.516  1.00  8.420          H  
ATOM    884 1HG2 VAL A  57       3.036   2.727   6.005  1.00  8.420          H  
ATOM    885 2HG2 VAL A  57       1.288   2.438   5.922  1.00  8.420          H  
ATOM    886 3HG2 VAL A  57       1.901   4.033   6.413  1.00  8.420          H  
ATOM    887  N   PRO A  58       1.060   5.188   9.356  1.00  5.690          N  
ATOM    888  CA  PRO A  58       1.013   6.643   9.336  1.00  6.240          C  
ATOM    889  C   PRO A  58       1.555   7.155   8.017  1.00  6.290          C  
ATOM    890  O   PRO A  58       2.375   6.485   7.394  1.00  6.190          O  
ATOM    891  CB  PRO A  58       1.963   7.048  10.470  1.00  9.360          C  
ATOM    892  CG  PRO A  58       2.024   5.861  11.387  1.00  9.360          C  
ATOM    893  CD  PRO A  58       1.878   4.653  10.488  1.00  9.360          C  
ATOM    894  HA  PRO A  58      -0.013   6.992   9.509  1.00  7.490          H  
ATOM    895 1HB  PRO A  58       2.947   7.321  10.045  1.00 11.230          H  
ATOM    896 2HB  PRO A  58       1.580   7.948  10.972  1.00 11.230          H  
ATOM    897 1HG  PRO A  58       2.987   5.859  11.920  1.00 11.230          H  
ATOM    898 2HG  PRO A  58       1.255   5.933  12.151  1.00 11.230          H  
ATOM    899 1HD  PRO A  58       2.868   4.339  10.162  1.00 11.230          H  
ATOM    900 2HD  PRO A  58       1.354   3.888  11.061  1.00 11.230          H  
ATOM    901  N   ARG A  59       1.136   8.346   7.591  1.00  6.760          N  
ATOM    902  CA  ARG A  59       1.702   8.870   6.352  1.00  7.160          C  
ATOM    903  C   ARG A  59       3.222   8.905   6.466  1.00  7.470          C  
ATOM    904  O   ARG A  59       3.767   9.339   7.484  1.00  7.950          O  
ATOM    905  CB  ARG A  59       1.206  10.279   6.034  1.00  9.860          C  
ATOM    906  CG  ARG A  59      -0.262  10.417   5.625  1.00  9.860          C  
ATOM    907  CD  ARG A  59      -0.591  11.848   5.248  1.00  9.860          C  
ATOM    908  NE  ARG A  59      -1.996  12.020   4.841  1.00  9.860          N  
ATOM    909  CZ  ARG A  59      -2.475  11.806   3.584  1.00  9.860          C  
ATOM    910  NH1 ARG A  59      -1.658  11.413   2.620  1.00  9.860          N  
ATOM    911  NH2 ARG A  59      -3.773  11.974   3.304  1.00  9.860          N  
ATOM    912  H   ARG A  59       0.453   8.871   8.116  1.00  8.110          H  
ATOM    913  HA  ARG A  59       1.430   8.206   5.538  1.00  8.590          H  
ATOM    914 1HB  ARG A  59       1.364  10.917   6.901  1.00 11.840          H  
ATOM    915 2HB  ARG A  59       1.808  10.686   5.221  1.00 11.840          H  
ATOM    916 1HG  ARG A  59      -0.463   9.777   4.768  1.00 11.840          H  
ATOM    917 2HG  ARG A  59      -0.903  10.121   6.455  1.00 11.840          H  
ATOM    918 1HD  ARG A  59      -0.416  12.485   6.116  1.00 11.840          H  
ATOM    919 2HD  ARG A  59       0.052  12.177   4.434  1.00 11.840          H  
ATOM    920  HE  ARG A  59      -2.652  12.319   5.551  1.00 11.840          H  
ATOM    921 1HH1 ARG A  59      -0.675  11.270   2.795  1.00 11.840          H  
ATOM    922 2HH1 ARG A  59      -2.016  11.235   1.687  1.00 11.840          H  
ATOM    923 1HH2 ARG A  59      -4.461  12.271   4.018  1.00 11.840          H  
ATOM    924 2HH2 ARG A  59      -4.102  11.797   2.366  1.00 11.840          H  
ATOM    925  N   GLY A  60       3.899   8.470   5.406  1.00  7.460          N  
ATOM    926  CA  GLY A  60       5.355   8.426   5.391  1.00  8.030          C  
ATOM    927  C   GLY A  60       5.847   7.906   4.055  1.00  7.620          C  
ATOM    928  O   GLY A  60       5.140   8.002   3.051  1.00  8.120          O  
ATOM    929  H   GLY A  60       3.382   8.127   4.597  1.00  8.950          H  
ATOM    930 1HA  GLY A  60       5.756   9.421   5.578  1.00  9.640          H  
ATOM    931 2HA  GLY A  60       5.705   7.776   6.193  1.00  9.640          H  
ATOM    932  N   SER A  61       7.077   7.403   4.016  1.00  6.960          N  
ATOM    933  CA  SER A  61       7.636   6.929   2.758  1.00  6.810          C  
ATOM    934  C   SER A  61       6.773   5.812   2.189  1.00  6.560          C  
ATOM    935  O   SER A  61       6.288   4.949   2.923  1.00  6.440          O  
ATOM    936  CB  SER A  61       9.048   6.417   2.964  1.00  9.590          C  
ATOM    937  OG  SER A  61       9.906   7.444   3.390  1.00  9.590          O  
ATOM    938  H   SER A  61       7.637   7.350   4.854  1.00  8.350          H  
ATOM    939  HA  SER A  61       7.653   7.754   2.045  1.00  8.170          H  
ATOM    940 1HB  SER A  61       9.040   5.616   3.701  1.00 11.510          H  
ATOM    941 2HB  SER A  61       9.417   5.994   2.028  1.00 11.510          H  
ATOM    942  HG  SER A  61      10.775   7.043   3.480  1.00 11.510          H  
ATOM    943  N   ALA A  62       6.601   5.834   0.873  1.00  6.800          N  
ATOM    944  CA  ALA A  62       5.832   4.836   0.145  1.00  6.930          C  
ATOM    945  C   ALA A  62       6.426   3.447   0.282  1.00  6.570          C  
ATOM    946  O   ALA A  62       7.640   3.299   0.160  1.00  6.760          O  
ATOM    947  CB  ALA A  62       5.844   5.226  -1.325  1.00  9.650          C  
ATOM    948  H   ALA A  62       7.027   6.589   0.357  1.00  8.160          H  
ATOM    949  HA  ALA A  62       4.817   4.822   0.538  1.00  8.320          H  
ATOM    950 1HB  ALA A  62       5.289   4.525  -1.916  1.00 11.580          H  
ATOM    951 2HB  ALA A  62       5.413   6.222  -1.442  1.00 11.580          H  
ATOM    952 3HB  ALA A  62       6.870   5.235  -1.685  1.00 11.580          H  
ATOM    953  N   ALA A  63       5.590   2.401   0.443  1.00  6.430          N  
ATOM    954  CA  ALA A  63       6.144   1.049   0.432  1.00  6.470          C  
ATOM    955  C   ALA A  63       6.802   0.756  -0.911  1.00  6.750          C  
ATOM    956  O   ALA A  63       7.822   0.066  -0.984  1.00  7.150          O  
ATOM    957  CB  ALA A  63       5.065   0.019   0.688  1.00  9.040          C  
ATOM    958  H   ALA A  63       4.587   2.509   0.622  1.00  7.720          H  
ATOM    959  HA  ALA A  63       6.902   0.984   1.211  1.00  7.760          H  
ATOM    960 1HB  ALA A  63       5.506  -0.976   0.686  1.00 10.850          H  
ATOM    961 2HB  ALA A  63       4.596   0.210   1.654  1.00 10.850          H  
ATOM    962 3HB  ALA A  63       4.325   0.089  -0.094  1.00 10.850          H  
ATOM    963  N   ALA A  64       6.192   1.278  -1.973  1.00  6.890          N  
ATOM    964  CA  ALA A  64       6.653   1.101  -3.334  1.00  7.530          C  
ATOM    965  C   ALA A  64       6.013   2.143  -4.245  1.00  8.130          C  
ATOM    966  O   ALA A  64       6.474   3.281  -4.328  1.00  8.740          O  
ATOM    967  OXT ALA A  64       5.013   1.840  -4.896  1.00 11.290          O  
ATOM    968  CB  ALA A  64       6.320  -0.298  -3.820  1.00  9.780          C  
ATOM    969  H   ALA A  64       5.341   1.795  -1.819  1.00  8.270          H  
ATOM    970  HA  ALA A  64       7.733   1.249  -3.353  1.00  9.040          H  
ATOM    971 1HB  ALA A  64       6.684  -0.422  -4.839  1.00 11.740          H  
ATOM    972 2HB  ALA A  64       6.798  -1.032  -3.171  1.00 11.740          H  
ATOM    973 3HB  ALA A  64       5.241  -0.441  -3.800  1.00 11.740          H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -311.073 38.9017 221.857 -19.2351 4.51562 14.0885 104.291 -124.542 -0.43907 -2.94383 -93.4956 -18.6487 -24.6017 -4.12619 -13.9297 -11.0245 0 1.29614 3.89899 24.6204 59.689 -16.5102 10.5838 -10.2486 -7.33 39.3063 -135.099
ASP:NtermProteinFull_1 -3.01716 0.2474 4.06859 -0.13307 0.0253 0.43959 2.29406 -1.96767 -0.03758 -0.31048 -4.21959 -1.46798 0 0 -0.7935 -0.70083 0 0.01904 0.07031 0 2.63874 0 0 -2.3716 0 0.12836 -5.08809
VAL_2 -6.47649 0.83739 3.63697 -0.28117 0.22267 0.06022 2.53729 -2.63882 -0 -0 -1.96899 -0.33167 0 0 -0.93788 0 0 -0.01919 0.02022 0.21189 0 -0.73014 0 1.9342 -0.20267 0.43485 -3.69132
SER_3 -4.37168 0.2119 3.64617 -0.03363 0.00079 0.04497 1.38776 -1.8382 -0.01999 -0.18824 -0.44791 -0.77288 0 0 -0.69901 0 0 0.1078 0.00176 0.32865 0 -0.03948 1.75904 -0.77834 -0.39886 0.41897 -1.6804
GLU_4 -2.50834 0.59463 1.93775 -0.32842 0.05486 0.45404 0.35261 -0.991 -0.02392 -0.14817 0.17699 -0.38658 0 0 0 0 0 0.04487 0.0222 0 3.05393 0.28634 0 -2.7348 0.85504 0.39126 1.1033
GLU_5 -3.46142 0.48711 2.3213 -0.3697 0.09895 0.49975 0.00305 -1.13665 -0 -0 -0.27907 -0.46693 0 0 0 0 0 -0.01346 0.01254 0 3.30747 0.07873 0 -2.7348 1.10458 0.40573 -0.14282
GLU_6 -5.81856 0.46211 7.03564 -0.19108 0.02481 0.26694 3.63125 -3.01507 -0 -0 -4.72858 -0.62009 0 0 -1.73138 -1.10258 0 0.00201 0.28776 0 3.12832 0.02853 0 -2.7348 0.06844 0.77553 -4.23082
ASP_7 -4.85727 0.54915 6.71049 -0.13984 0.02799 0.43683 3.28767 -2.79249 -0 -0 -5.46446 -1.48437 0 0 -0.92886 -1.07645 0 0.00898 0.21786 0 4.14599 0.03168 0 -2.3716 -0.128 0.96836 -2.85836
PHE_8 -9.32448 1.16991 5.46503 -0.52257 0.01155 0.18994 3.58963 -3.41495 -0 -0 -2.87133 -0.07031 0 0 -0.47381 0 0 -0.04779 0.14689 0 2.59891 0.08951 0 1.0402 -0.26392 0.61872 -2.06888
ARG_9 -4.42068 0.55829 5.59799 -0.62387 0.06525 0.4114 2.60169 -2.4264 -0 -0 -4.59748 0.5535 0 0 -0.45505 -1.07645 0 -0.07759 0.04034 1.8122 0 -0.11994 0 -1.2888 -0.3771 0.78452 -3.03819
LEU_10 -5.52498 0.62724 4.64212 -0.50676 0.21381 0.14039 2.39246 -2.34117 -0 -0 -1.46214 0.08312 0 0 0 0 0 -0.06213 0.07715 0.10723 0 -0.14288 0 0.18072 -0.55672 0.72422 -1.40833
ALA_11 -5.60753 1.32027 3.57504 -0.02592 0.00135 0 2.13487 -2.41525 -0 -4e-05 -1.56161 -0.45347 0 0 0 0 0 0.07314 0 0 0 -0.04139 0 1.8394 -0.59503 0.48166 -1.2745
CYS_12 -3.53177 0.51691 3.06885 -0.08112 0.00015 0.04982 1.1874 -1.48768 -0 -0 -0.8565 -0.03734 0 0 0 0 0 -0.0489 0.0031 0.49962 0 0.17741 0 3.6196 -0.5275 0.38188 2.93393
ARG_13 -3.94599 0.51125 3.41791 -0.45933 0.06092 0.25827 1.68137 -1.64767 -0.00113 -0.01592 -1.91487 0.18848 0 0 0 0 0 -0.04146 0.04937 1.99296 0 -0.03867 0 -1.2888 -0.50131 0.31438 -1.38023
HIS_14 -6.17958 0.80116 5.05939 -0.39833 0.07773 0.45701 2.33579 -2.65496 -0.00039 -0.00147 -2.11259 -0.35777 0 0 0 -1.10258 0 0.00206 0.38277 0 2.46141 -0.19965 0 -0.45461 -0.03547 0.73476 -1.18534
GLU_15 -1.62266 0.17485 2.26812 -0.21981 0.02518 0.30556 0.95524 -1.00632 -0 -0 -0.50755 -0.58964 0 0 0 0 0 -0.07242 0.00776 0 3.06621 -0.35487 0 -2.7348 -0.12263 0.63273 0.20495
ARG_16 -3.42718 0.35408 3.10346 -0.74163 0.15805 0.51882 1.16806 -1.43702 -0.02033 -0.17275 -1.91174 0.20454 0 0 0 -1.07324 0 -0.0561 0.1513 2.49188 0 -0.03458 0 -1.2888 -0.63999 0.47989 -2.1733
TYR_17 -8.48903 1.6258 2.86374 -0.55862 0.03153 0.23196 1.99883 -2.30064 -0.01266 -0.1332 -1.71672 -0.08217 0 0 -0.42656 -0.37241 0 0.07865 0.22939 0 2.15279 -0.25142 0.00069 1.2797 -0.02233 1.46223 -2.41047
PRO_18 -2.88398 0.63254 1.64858 -0.20728 0.00925 0.15178 0.93094 -0.84178 -0 -0 -0.12986 -0.01037 0 0 0 0 0 0.03467 0.0064 0.33621 0 -0.81559 0 -2.4119 0.12923 1.27458 -2.14658
THR_19 -4.28123 0.59948 2.39193 -0.13845 0.11636 0.1069 0.86138 -1.4225 -0 -0 -0.7023 -0.62429 0 0 0 0 0 0.05201 0.02731 0.16841 0 0.02134 2.25773 -1.0874 0.49962 0.79201 -0.36169
ARG_20 -3.53121 0.1486 3.61666 -1.09203 0.26651 0.80062 0.96602 -1.63541 -0.00279 -0.01173 -0.34606 0.166 0 0 0 -0.57846 0 -0.04692 0.02675 2.90526 0 -0.12817 0 -1.2888 0.43414 0.87199 1.54096
HIS_D_21 -6.81348 0.53122 4.97755 -0.38911 0.01825 0.50057 0.86286 -2.53379 -0.00481 -0.02744 -0.88201 -0.32649 0 0 0 -0.57846 0 -0.0314 0.01088 0 1.56442 -0.45079 0 -0.45461 -0.39793 0.45364 -3.97095
GLN_22 -9.25194 1.34879 7.47703 -0.62342 0.13659 0.98397 2.98808 -3.74155 -0.00033 -0.00129 -2.944 -0.82711 0 0 -0.54255 -0.24474 0 1.40641 0.0315 0 4.12811 0.01344 0 -0.18838 0.04743 0.9187 1.11474
PRO_23 -3.90828 0.44073 2.02682 -0.08693 0.00065 0.05378 0.2551 -0.87974 -0 -0 -0.07425 0.67293 0 0 0 0 0 -0.20081 0.00116 0.67171 0 -0.60694 0 -2.4119 0.12384 1.17719 -2.74495
HIS_D_24 -4.5187 0.43471 3.52256 -0.43812 0.02499 0.57809 1.76156 -1.79981 -0 -0 -1.75146 -0.3005 0 0 0 0 0 0.09043 0.05785 0 1.46571 -0.75536 0 -0.45461 0.40206 0.5168 -1.16382
MET_25 -7.08273 1.04565 1.64819 -0.47336 0.07448 0.14071 0.9298 -1.42475 -0 -0 0.02742 0.00276 0 0 0 0 0 -0.09148 0.05002 1.53036 0 0.32249 0 0.60916 0.39045 0.34395 -1.95685
GLY_26 -3.83092 0.3523 3.16602 -8e-05 0 0 1.22269 -1.79691 -0.03367 -0.22858 -0.26813 -0.36766 0 0 0 0 0 -0.15178 0 0 0 -1.52444 0 0.83697 -0.33446 0.37791 -2.58074
ASP_27 -3.78959 0.42025 4.99911 -0.11256 0.0189 0.33296 2.75578 -2.25235 -0.04743 -0.34274 -3.60321 -1.20516 0 0 -0.50869 0 0 -0.01988 0.00057 0 2.11106 -0.30885 0 -2.3716 -0.2725 0.41373 -3.78218
SER_28 -2.12549 0.12588 1.75409 -0.03188 0.01832 0.03012 0.70386 -0.87451 -0.01175 -0.08809 -1.86472 -0.21436 0 0 -0.50869 0 0 0.019 0.00362 0.23298 0 0.30278 0.60915 -0.77834 0.42874 0.43681 -1.83247
TRP_29 -7.77963 1.24406 3.73308 -0.96215 0.02734 0.24876 1.59498 -2.17695 -0.00201 -0.02608 -1.13416 -0.58415 0 0 0 0 0 -0.00973 0.02067 0 2.354 -0.07309 0 1.6906 0.60239 1.41786 0.1858
PRO_30 -4.26077 0.55343 3.56379 -0.12039 0.01132 0.08827 1.92126 -1.61408 -0 -0 -1.56316 0.21714 0 0 0 0 0 -0.11577 0.02821 0.10951 0 -0.89482 0 -2.4119 -0.17387 1.59072 -3.0711
ARG_31 -5.1976 0.26492 4.81869 -0.64469 0.11896 0.42405 2.4977 -2.38332 -0 -0 -1.91126 0.23171 0 0 0 -0.55381 0 -0.02321 0.09155 1.93573 0 -0.17249 0 -1.2888 -0.53404 0.44831 -1.87758
SER_32 -2.73242 0.19428 3.30048 -0.02475 0 0.02273 1.07211 -1.59487 -0 -0 -0.83553 -0.40314 0 0 0 0 0 -0.0573 0.00157 0.58974 0 0.25794 0.60611 -0.77834 -0.38156 0.22783 -0.53509
SER_33 -4.89533 0.2657 4.98603 -0.02375 0 0.02176 2.33371 -2.426 -0 -0 -1.64044 -0.26706 0 0 0 0 0 0.02627 0.00037 0.45054 0 0.32497 0.60135 -0.77834 -0.06213 0.27091 -0.81145
ALA_34 -6.12298 0.48205 4.3189 -0.01999 0 0 3.18413 -3.07728 -0.00063 -0.00809 -1.77678 -0.35176 0 0 0 0 0 0.04119 0 0 0 -0.15492 0 1.8394 -0.05238 0.41158 -1.28756
HIS_D_35 -7.15539 0.52614 5.9729 -0.34717 0.00225 0.39333 3.03026 -3.31731 -0 -0 -2.33872 -0.4442 0 0 0 -0.88299 0 -0.00362 0.61934 0 2.86553 -0.03633 0 -0.45461 -0.16213 0.63414 -1.09858
GLU_36 -3.69453 0.17455 4.64 -0.33742 0.0823 0.39862 1.96731 -2.19924 -0.02073 -0.14783 -1.03742 -0.6302 0 0 0 0 0 -0.01231 0.00066 0 3.17567 -0.10177 0 -2.7348 -0.2025 0.46815 -0.21149
ALA_37 -4.83485 0.38092 4.27519 -0.02098 0 0 2.71806 -2.53406 -0 -0 -2.22418 -0.34408 0 0 0 0 0 -0.04067 0 0 0 -0.17529 0 1.8394 -0.32565 0.23871 -1.04747
ALA_38 -6.52513 1.35919 3.79016 -0.02457 0 0 2.69961 -2.91513 -0 -0 -2.30538 -0.34512 0 0 0 0 0 0.00345 0 0 0 -0.34981 0 1.8394 -0.53201 0.48353 -2.82179
GLU_39 -3.84133 0.28866 4.2199 -0.22119 0.02635 0.31838 1.66806 -1.92492 -0.02073 -0.14783 -0.81223 -0.63042 0 0 0 0 0 -0.0833 0.06067 0 3.2798 -0.22894 0 -2.7348 -0.60412 0.4678 -0.92017
LEU_40 -3.45527 0.35767 3.2975 -0.50576 0.18271 0.13936 1.62936 -1.64522 -0 -0 -1.36905 0.11853 0 0 0 0 0 -0.03686 0.06608 0.11467 0 -0.16418 0 0.18072 -0.53841 0.26616 -1.36201
ASN_41 -4.81471 0.32489 5.84642 -0.16156 0.02851 0.22091 2.86843 -2.74491 -0 -0 -1.90373 -0.63027 0 0 -1.24974 0 0 0.0411 0.00236 0 2.00182 -0.24712 0 -0.93687 -0.26906 0.30256 -1.32097
ARG_42 -1.77844 0.22979 2.07667 -0.73758 0.09988 0.47593 1.05605 -0.90968 -0 -0 -1.0055 0.30168 0 0 -1.5588 0 0 -0.0121 0.03359 1.45096 0 -0.13425 0 -1.2888 -0.22714 0.33147 -1.59627
GLN_43 -4.5694 0.48922 3.75551 -0.58265 0.15459 0.53434 1.47358 -1.85504 -0.00349 -0.05411 -1.68943 -0.72426 0 0 -0.87804 0 0 -0.02056 0.05592 0 4.22751 -0.11119 0 -0.18838 -0.1701 0.41243 0.25644
CYS_44 -4.45763 0.44073 1.13394 -0.17212 0.15379 0.08248 0.16802 -1.03699 -0 -0 0.00926 -1.76381 0 0 0 0 0 0.04278 0.0456 0.96659 0 0.35375 0 3.6196 0.5924 0.46287 0.64124
TRP_45 -10.5551 1.1733 4.88795 -0.71468 0.39344 0.39114 2.06763 -3.13601 -0.02937 -0.1501 -3.48843 -0.17493 0 0 0 0 0 1.19412 0.05975 0 2.82077 -0.27562 0 1.6906 0.51867 0.87268 -2.45417
VAL_46 -7.21659 0.9315 2.26238 -0.27819 0.2788 0.06086 1.51838 -2.26786 -0 -0 -1.19871 -0.27274 0 0 0 0 0 -0.02231 0.07953 0.27929 0 -0.7933 0 1.9342 -0.21514 1.28085 -3.63906
LEU_47 -7.79766 0.81165 3.1453 -0.62368 0.16336 0.23511 2.02113 -2.50633 -0.02281 -0.08438 -2.56365 0.01267 0 0 0 0 0 0.03278 0.00778 0.90322 0 -0.05568 0 0.18072 0.22985 1.27797 -4.63264
GLY_48 -4.0498 0.40826 3.85317 -0.00024 0 0 1.83345 -2.12539 -0 -0 -0.62677 -0.29549 0 0 0 0 0 -0.26482 0 0 0 -1.35112 0 0.83697 0.39899 0.83106 -0.55174
HIS_49 -7.07995 0.61404 5.19443 -0.43418 0.01931 0.53191 1.50347 -2.75991 -3e-05 -0.0001 -1.72892 -0.15429 0 0 0 -0.55381 0 -0.04023 0.02343 0 1.66106 -0.26327 0 -0.45461 -0.37343 0.23911 -4.05598
TRP_50 -12.9021 1.79057 5.49809 -1.02272 0.08917 0.36449 3.88342 -3.87551 -0.01394 -0.05718 -3.00846 -0.16624 0 0 0 0 0 0.16337 0.00205 0 1.47982 -0.11469 0 1.6906 -0.3305 0.69344 -5.83632
VAL_51 -8.23236 1.63269 1.76965 -0.24841 0.17078 0.0469 1.39776 -2.54004 -0.0011 -0.00643 -0.27782 -0.24588 0 0 -0.54255 0 0 -0.04243 0.48085 0.47596 0 -0.71796 0 1.9342 -0.16371 1.01114 -4.09875
GLY_52 -3.88055 0.48887 3.30748 -6e-05 0 0 1.75719 -1.95844 -0.01394 -0.05714 -2.3971 -0.35828 0 0 -0.56898 0 0 -0.14893 0 0 0 -1.52608 0 0.83697 -0.411 0.55816 -4.37182
THR_53 -6.24232 1.29128 3.59725 -0.14684 0.06071 0.04831 1.64925 -2.20371 -0.02938 -0.11561 -1.30689 -0.07408 0 0 0 -0.24474 0 -0.02767 0.0065 0.21968 0 0.21151 4.14913 -1.0874 -0.30917 0.80246 0.24829
GLY_54 -2.42059 0.4297 2.28013 -0.00035 0 0 1.04116 -1.18558 -0 -0 -0.01036 -0.1851 0 0 0 0 0 -0.07162 0 0 0 -0.06312 0 0.83697 -0.06959 0.7142 1.29586
GLY_55 -1.6169 0.17312 1.23301 -5e-05 0 0 0.21539 -0.73105 -0 -0 -0.83268 -0.39451 0 0 -0.42656 0 0 -0.16637 0 0 0 -1.35696 0 0.83697 -0.51527 0.21399 -3.36787
LEU_56 -8.42594 1.78755 2.09041 -0.50681 0.33704 0.08476 0.86971 -2.24059 -0.02631 -0.10399 -0.04387 0.33998 0 0 0 0 0 0.04239 0.17675 0.40071 0 0.27737 0 0.18072 -0.02664 0.63069 -4.15608
VAL_57 -3.76857 0.64285 2.14843 -0.31314 0.22105 0.06538 0.81777 -1.37315 -0 -0 -1.44368 -0.42597 0 0 0 0 0 0.10903 0.00302 0.11285 0 -0.44762 0 1.9342 0.3334 1.22107 -0.16307
PRO_58 -3.89412 0.70031 1.85343 -0.13257 0.00052 0.09678 0.50341 -0.89305 -0.01311 -0.14881 -0.21707 0.23241 0 0 0 0 0 -0.04252 0.02554 0.21109 0 -1.17411 0 -2.4119 -0.43187 0.99231 -4.74335
ARG_59 -3.83809 0.37722 2.97058 -0.58782 0.09833 0.32642 0.68868 -1.40587 -0.02469 -0.16586 -1.30612 0.40536 0 0 0 -0.88299 0 -0.05987 0.06835 2.68153 0 0.03006 0 -1.2888 -0.54924 0.4561 -2.00672
GLY_60 -1.20837 0.0404 2.00863 -0.00169 0 0 0.93691 -0.89963 -0 -0 -0.23559 -0.358 0 0 -0.69901 0 0 -0.09411 0 0 0 -1.48703 0 0.83697 0.18698 0.23203 -0.74152
SER_61 -0.79162 0.05046 1.15305 -0.02699 2e-05 0.02254 0.17646 -0.53739 -1e-05 -0.00018 -0.22235 -0.245 0 0 0 0 0 -0.06675 0.00207 0.42898 0 0.0312 0.6006 -0.77834 0.15202 0.08512 0.03388
ALA_62 -2.67041 0.46568 0.93243 -0.02682 0.00127 0 0.46656 -1.02765 -0 -0 0.4717 -0.23659 0 0 0 0 0 0.1563 0 0 0 -0.01867 0 1.8394 -0.74378 0.42259 0.03201
ALA_63 -2.05235 0.21406 1.03703 -0.02322 0 0 0.99515 -0.92197 -0 -0 -0.3578 -0.37287 0 0 0 0 0 -0.05135 0 0 0 -0.31662 0 1.8394 -0.76609 0.48039 -0.29624
ALA:CtermProteinFull_64 -1.71144 0.17237 1.2583 -0.0318 0.00862 0 0.28823 -0.88254 -0 -0 -0.18053 -0.30397 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.31132 0.14053 0.28585
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 142574 DOMAINID 138915 MODEL 3 2021-10-23_00000171_1_11
MODEL     3
REMARK    Rerank model03.pdb score: 15.895
REMARK    CLUSTER 0003 t000_.out.valid.rescored.best_scoring.binary cluster_size: 19 cluster_threshold: 7.022263
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     description: cluster0003_0001
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE          fa_dun:          85.566
REMARK    SCORE          fa_rep:          29.181
REMARK    SCORE          fa_atr:        -291.091
REMARK    SCORE     hbond_lr_bb:          -5.237
REMARK    SCORE     total_score:        -103.817
REMARK    SCORE         p_aa_pp:         -17.925
REMARK    SCORE             ref:          13.118
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE     cart_bonded:          36.404
REMARK    SCORE    fa_intra_rep:           0.551
REMARK    SCORE          fa_sol:         187.524
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE fa_intra_sol_xover4:          15.365
REMARK    SCORE           score:        -103.817
REMARK    SCORE     lk_ball_wtd:         -10.720
REMARK    SCORE     rama_prepro:         -12.881
REMARK    SCORE        hbond_sc:         -11.274
REMARK    SCORE           omega:          -0.569
REMARK    SCORE     hbond_bb_sc:         -15.446
REMARK    SCORE         fa_elec:         -87.630
REMARK    SCORE            time:           0.000
REMARK    SCORE     hbond_sr_bb:         -18.755
ATOM      1  N   ASP A   1       0.270  -0.414   0.319  1.00  7.360          N  
ATOM      2  CA  ASP A   1       1.722  -0.331   0.399  1.00  7.080          C  
ATOM      3  C   ASP A   1       2.158   1.124   0.354  1.00  6.610          C  
ATOM      4  O   ASP A   1       2.779   1.628   1.287  1.00  6.760          O  
ATOM      5  CB  ASP A   1       2.383  -0.990  -0.803  1.00 10.020          C  
ATOM      6  CG  ASP A   1       2.140  -2.427  -0.969  1.00 10.020          C  
ATOM      7  OD1 ASP A   1       1.602  -3.066  -0.084  1.00 10.020          O  
ATOM      8  OD2 ASP A   1       2.519  -2.890  -2.019  1.00 10.020          O  
ATOM      9 1H   ASP A   1       0.015  -1.379   0.149  1.00  8.830          H  
ATOM     10 2H   ASP A   1      -0.126  -0.114   1.199  1.00  8.830          H  
ATOM     11 3H   ASP A   1      -0.086   0.168  -0.423  1.00  8.830          H  
ATOM     12  HA  ASP A   1       2.065  -0.785   1.329  1.00  8.500          H  
ATOM     13 1HB  ASP A   1       2.088  -0.494  -1.717  1.00 12.030          H  
ATOM     14 2HB  ASP A   1       3.449  -0.861  -0.692  1.00 12.030          H  
ATOM     15  N   VAL A   2       1.803   1.768  -0.761  1.00  6.410          N  
ATOM     16  CA  VAL A   2       2.115   3.147  -1.103  1.00  6.320          C  
ATOM     17  C   VAL A   2       1.079   4.083  -0.488  1.00  5.910          C  
ATOM     18  O   VAL A   2      -0.112   3.790  -0.568  1.00  6.080          O  
ATOM     19  CB  VAL A   2       2.087   3.306  -2.642  1.00  8.880          C  
ATOM     20  CG1 VAL A   2       2.340   4.689  -3.037  1.00  8.880          C  
ATOM     21  CG2 VAL A   2       3.101   2.433  -3.297  1.00  8.880          C  
ATOM     22  H   VAL A   2       1.267   1.265  -1.449  1.00  7.690          H  
ATOM     23  HA  VAL A   2       3.101   3.392  -0.718  1.00  7.580          H  
ATOM     24  HB  VAL A   2       1.099   3.040  -2.986  1.00 10.660          H  
ATOM     25 1HG1 VAL A   2       2.291   4.732  -4.108  1.00 10.660          H  
ATOM     26 2HG1 VAL A   2       1.596   5.353  -2.615  1.00 10.660          H  
ATOM     27 3HG1 VAL A   2       3.320   4.982  -2.709  1.00 10.660          H  
ATOM     28 1HG2 VAL A   2       3.056   2.548  -4.382  1.00 10.660          H  
ATOM     29 2HG2 VAL A   2       4.087   2.722  -2.944  1.00 10.660          H  
ATOM     30 3HG2 VAL A   2       2.895   1.413  -3.047  1.00 10.660          H  
ATOM     31  N   SER A   3       1.528   5.186   0.112  1.00  5.730          N  
ATOM     32  CA  SER A   3       0.663   6.190   0.734  1.00  5.740          C  
ATOM     33  C   SER A   3      -0.320   6.769  -0.277  1.00  5.430          C  
ATOM     34  O   SER A   3       0.012   6.939  -1.451  1.00  5.750          O  
ATOM     35  CB  SER A   3       1.501   7.324   1.304  1.00  8.030          C  
ATOM     36  OG  SER A   3       2.358   6.880   2.333  1.00  8.030          O  
ATOM     37  H   SER A   3       2.528   5.330   0.147  1.00  6.880          H  
ATOM     38  HA  SER A   3       0.092   5.716   1.537  1.00  6.890          H  
ATOM     39 1HB  SER A   3       2.091   7.761   0.502  1.00  9.640          H  
ATOM     40 2HB  SER A   3       0.840   8.108   1.684  1.00  9.640          H  
ATOM     41  HG  SER A   3       2.787   7.675   2.684  1.00  9.640          H  
ATOM     42  N   GLU A   4      -1.534   7.081   0.186  1.00  5.220          N  
ATOM     43  CA  GLU A   4      -2.592   7.601  -0.676  1.00  5.330          C  
ATOM     44  C   GLU A   4      -2.353   8.953  -1.367  1.00  5.550          C  
ATOM     45  O   GLU A   4      -2.704   9.103  -2.540  1.00  5.670          O  
ATOM     46  CB  GLU A   4      -3.885   7.715   0.141  1.00  7.420          C  
ATOM     47  CG  GLU A   4      -4.481   6.377   0.605  1.00  7.420          C  
ATOM     48  CD  GLU A   4      -3.824   5.817   1.854  1.00  7.420          C  
ATOM     49  OE1 GLU A   4      -2.925   6.454   2.372  1.00  7.420          O  
ATOM     50  OE2 GLU A   4      -4.222   4.768   2.291  1.00  7.420          O  
ATOM     51  H   GLU A   4      -1.751   6.918   1.174  1.00  6.260          H  
ATOM     52  HA  GLU A   4      -2.750   6.861  -1.460  1.00  6.400          H  
ATOM     53 1HB  GLU A   4      -3.701   8.331   1.024  1.00  8.900          H  
ATOM     54 2HB  GLU A   4      -4.641   8.225  -0.455  1.00  8.900          H  
ATOM     55 1HG  GLU A   4      -5.544   6.514   0.799  1.00  8.900          H  
ATOM     56 2HG  GLU A   4      -4.379   5.653  -0.203  1.00  8.900          H  
ATOM     57  N   GLU A   5      -1.741   9.926  -0.687  1.00  5.960          N  
ATOM     58  CA  GLU A   5      -1.551  11.254  -1.286  1.00  6.500          C  
ATOM     59  C   GLU A   5      -0.733  11.193  -2.568  1.00  6.380          C  
ATOM     60  O   GLU A   5       0.347  10.594  -2.592  1.00  6.800          O  
ATOM     61  CB  GLU A   5      -0.862  12.186  -0.283  1.00  8.880          C  
ATOM     62  CG  GLU A   5      -1.690  12.489   0.965  1.00  8.880          C  
ATOM     63  CD  GLU A   5      -1.546  11.441   2.035  1.00  8.880          C  
ATOM     64  OE1 GLU A   5      -0.866  10.467   1.791  1.00  8.880          O  
ATOM     65  OE2 GLU A   5      -2.104  11.608   3.088  1.00  8.880          O  
ATOM     66  H   GLU A   5      -1.446   9.765   0.281  1.00  7.150          H  
ATOM     67  HA  GLU A   5      -2.532  11.664  -1.531  1.00  7.800          H  
ATOM     68 1HB  GLU A   5       0.070  11.747   0.033  1.00 10.660          H  
ATOM     69 2HB  GLU A   5      -0.625  13.133  -0.769  1.00 10.660          H  
ATOM     70 1HG  GLU A   5      -1.373  13.450   1.372  1.00 10.660          H  
ATOM     71 2HG  GLU A   5      -2.738  12.572   0.681  1.00 10.660          H  
ATOM     72  N   GLU A   6      -1.155  11.926  -3.608  1.00  6.120          N  
ATOM     73  CA  GLU A   6      -0.419  11.893  -4.871  1.00  6.170          C  
ATOM     74  C   GLU A   6       1.026  12.316  -4.675  1.00  5.740          C  
ATOM     75  O   GLU A   6       1.949  11.710  -5.223  1.00  5.740          O  
ATOM     76  CB  GLU A   6      -1.072  12.825  -5.896  1.00  8.620          C  
ATOM     77  CG  GLU A   6      -2.480  12.418  -6.327  1.00  8.620          C  
ATOM     78  CD  GLU A   6      -3.549  12.881  -5.357  1.00  8.620          C  
ATOM     79  OE1 GLU A   6      -3.197  13.472  -4.351  1.00  8.620          O  
ATOM     80  OE2 GLU A   6      -4.703  12.654  -5.619  1.00  8.620          O  
ATOM     81  H   GLU A   6      -2.032  12.456  -3.553  1.00  7.340          H  
ATOM     82  HA  GLU A   6      -0.444  10.875  -5.255  1.00  7.400          H  
ATOM     83 1HB  GLU A   6      -1.118  13.837  -5.489  1.00 10.340          H  
ATOM     84 2HB  GLU A   6      -0.448  12.867  -6.790  1.00 10.340          H  
ATOM     85 1HG  GLU A   6      -2.686  12.840  -7.311  1.00 10.340          H  
ATOM     86 2HG  GLU A   6      -2.518  11.331  -6.410  1.00 10.340          H  
ATOM     87  N   ASP A   7       1.225  13.304  -3.814  1.00  5.760          N  
ATOM     88  CA  ASP A   7       2.546  13.820  -3.536  1.00  5.830          C  
ATOM     89  C   ASP A   7       3.444  12.772  -2.903  1.00  5.330          C  
ATOM     90  O   ASP A   7       4.650  12.746  -3.164  1.00  5.310          O  
ATOM     91  CB  ASP A   7       2.450  15.005  -2.579  1.00  8.130          C  
ATOM     92  CG  ASP A   7       1.845  16.257  -3.205  1.00  8.130          C  
ATOM     93  OD1 ASP A   7       1.742  16.343  -4.408  1.00  8.130          O  
ATOM     94  OD2 ASP A   7       1.498  17.134  -2.459  1.00  8.130          O  
ATOM     95  H   ASP A   7       0.414  13.743  -3.399  1.00  6.910          H  
ATOM     96  HA  ASP A   7       2.998  14.142  -4.474  1.00  7.000          H  
ATOM     97 1HB  ASP A   7       1.854  14.720  -1.710  1.00  9.760          H  
ATOM     98 2HB  ASP A   7       3.447  15.250  -2.213  1.00  9.760          H  
ATOM     99  N   PHE A   8       2.869  11.917  -2.053  1.00  5.260          N  
ATOM    100  CA  PHE A   8       3.658  10.954  -1.326  1.00  5.260          C  
ATOM    101  C   PHE A   8       3.942   9.703  -2.106  1.00  5.040          C  
ATOM    102  O   PHE A   8       4.918   9.012  -1.796  1.00  5.320          O  
ATOM    103  CB  PHE A   8       2.994  10.604  -0.008  1.00  7.360          C  
ATOM    104  CG  PHE A   8       2.972  11.725   1.017  1.00  7.360          C  
ATOM    105  CD1 PHE A   8       3.766  12.892   0.918  1.00  7.360          C  
ATOM    106  CD2 PHE A   8       2.153  11.602   2.108  1.00  7.360          C  
ATOM    107  CE1 PHE A   8       3.695  13.851   1.875  1.00  7.360          C  
ATOM    108  CE2 PHE A   8       2.093  12.573   3.064  1.00  7.360          C  
ATOM    109  CZ  PHE A   8       2.861  13.697   2.948  1.00  7.360          C  
ATOM    110  H   PHE A   8       1.862  11.904  -1.915  1.00  6.310          H  
ATOM    111  HA  PHE A   8       4.617  11.399  -1.126  1.00  6.310          H  
ATOM    112 1HB  PHE A   8       1.961  10.307  -0.207  1.00  8.840          H  
ATOM    113 2HB  PHE A   8       3.485   9.754   0.434  1.00  8.840          H  
ATOM    114  HD1 PHE A   8       4.437  13.061   0.090  1.00  8.840          H  
ATOM    115  HD2 PHE A   8       1.526  10.713   2.208  1.00  8.840          H  
ATOM    116  HE1 PHE A   8       4.302  14.750   1.783  1.00  8.840          H  
ATOM    117  HE2 PHE A   8       1.422  12.452   3.917  1.00  8.840          H  
ATOM    118  HZ  PHE A   8       2.801  14.469   3.708  1.00  8.840          H  
ATOM    119  N   ARG A   9       3.088   9.374  -3.086  1.00  4.870          N  
ATOM    120  CA  ARG A   9       3.388   8.191  -3.873  1.00  5.070          C  
ATOM    121  C   ARG A   9       4.475   8.571  -4.863  1.00  4.930          C  
ATOM    122  O   ARG A   9       5.417   7.814  -5.093  1.00  5.210          O  
ATOM    123  CB  ARG A   9       2.170   7.616  -4.601  1.00  7.020          C  
ATOM    124  CG  ARG A   9       1.577   8.391  -5.736  1.00  7.020          C  
ATOM    125  CD  ARG A   9       0.371   7.708  -6.284  1.00  7.020          C  
ATOM    126  NE  ARG A   9      -0.788   7.757  -5.372  1.00  7.020          N  
ATOM    127  CZ  ARG A   9      -1.951   7.087  -5.567  1.00  7.020          C  
ATOM    128  NH1 ARG A   9      -2.111   6.314  -6.616  1.00  7.020          N  
ATOM    129  NH2 ARG A   9      -2.946   7.206  -4.705  1.00  7.020          N  
ATOM    130  H   ARG A   9       2.247   9.939  -3.241  1.00  5.840          H  
ATOM    131  HA  ARG A   9       3.759   7.417  -3.214  1.00  6.080          H  
ATOM    132 1HB  ARG A   9       2.457   6.683  -5.048  1.00  8.420          H  
ATOM    133 2HB  ARG A   9       1.373   7.421  -3.880  1.00  8.420          H  
ATOM    134 1HG  ARG A   9       1.284   9.357  -5.383  1.00  8.420          H  
ATOM    135 2HG  ARG A   9       2.290   8.488  -6.552  1.00  8.420          H  
ATOM    136 1HD  ARG A   9       0.089   8.191  -7.220  1.00  8.420          H  
ATOM    137 2HD  ARG A   9       0.616   6.662  -6.473  1.00  8.420          H  
ATOM    138  HE  ARG A   9      -0.719   8.328  -4.529  1.00  8.420          H  
ATOM    139 1HH1 ARG A   9      -1.371   6.200  -7.289  1.00  8.420          H  
ATOM    140 2HH1 ARG A   9      -3.000   5.815  -6.742  1.00  8.420          H  
ATOM    141 1HH2 ARG A   9      -2.851   7.827  -3.882  1.00  8.420          H  
ATOM    142 2HH2 ARG A   9      -3.810   6.704  -4.861  1.00  8.420          H  
ATOM    143  N   LEU A  10       4.389   9.783  -5.419  1.00  4.840          N  
ATOM    144  CA  LEU A  10       5.394  10.216  -6.368  1.00  5.070          C  
ATOM    145  C   LEU A  10       6.730  10.392  -5.667  1.00  4.990          C  
ATOM    146  O   LEU A  10       7.781   9.971  -6.161  1.00  5.250          O  
ATOM    147  CB  LEU A  10       4.952  11.527  -7.018  1.00  7.010          C  
ATOM    148  CG  LEU A  10       3.723  11.438  -7.965  1.00  7.010          C  
ATOM    149  CD1 LEU A  10       3.286  12.844  -8.318  1.00  7.010          C  
ATOM    150  CD2 LEU A  10       4.074  10.640  -9.237  1.00  7.010          C  
ATOM    151  H   LEU A  10       3.592  10.396  -5.213  1.00  5.810          H  
ATOM    152  HA  LEU A  10       5.517   9.445  -7.120  1.00  6.080          H  
ATOM    153 1HB  LEU A  10       4.697  12.229  -6.219  1.00  8.410          H  
ATOM    154 2HB  LEU A  10       5.788  11.938  -7.580  1.00  8.410          H  
ATOM    155  HG  LEU A  10       2.901  10.947  -7.448  1.00  8.410          H  
ATOM    156 1HD1 LEU A  10       2.412  12.800  -8.966  1.00  8.410          H  
ATOM    157 2HD1 LEU A  10       3.029  13.383  -7.401  1.00  8.410          H  
ATOM    158 3HD1 LEU A  10       4.093  13.362  -8.832  1.00  8.410          H  
ATOM    159 1HD2 LEU A  10       3.198  10.599  -9.883  1.00  8.410          H  
ATOM    160 2HD2 LEU A  10       4.892  11.132  -9.763  1.00  8.410          H  
ATOM    161 3HD2 LEU A  10       4.368   9.626  -8.985  1.00  8.410          H  
ATOM    162  N   ALA A  11       6.702  10.946  -4.452  1.00  4.960          N  
ATOM    163  CA  ALA A  11       7.909  11.142  -3.681  1.00  5.330          C  
ATOM    164  C   ALA A  11       8.318   9.853  -2.974  1.00  5.310          C  
ATOM    165  O   ALA A  11       8.377   9.789  -1.749  1.00  5.530          O  
ATOM    166  CB  ALA A  11       7.697  12.244  -2.669  1.00  7.310          C  
ATOM    167  H   ALA A  11       5.828  11.309  -4.066  1.00  5.950          H  
ATOM    168  HA  ALA A  11       8.710  11.428  -4.362  1.00  6.400          H  
ATOM    169 1HB  ALA A  11       8.593  12.390  -2.120  1.00  8.780          H  
ATOM    170 2HB  ALA A  11       7.429  13.151  -3.199  1.00  8.780          H  
ATOM    171 3HB  ALA A  11       6.898  11.973  -2.006  1.00  8.780          H  
ATOM    172  N   CYS A  12       8.716   8.858  -3.752  1.00  5.450          N  
ATOM    173  CA  CYS A  12       9.099   7.544  -3.225  1.00  5.920          C  
ATOM    174  C   CYS A  12      10.424   7.605  -2.462  1.00  5.910          C  
ATOM    175  O   CYS A  12      10.790   6.697  -1.718  1.00  6.480          O  
ATOM    176  CB  CYS A  12       9.175   6.530  -4.357  1.00  8.100          C  
ATOM    177  SG  CYS A  12      10.490   6.813  -5.539  1.00  8.100          S  
ATOM    178  H   CYS A  12       8.652   9.024  -4.761  1.00  6.540          H  
ATOM    179  HA  CYS A  12       8.323   7.220  -2.535  1.00  7.100          H  
ATOM    180 1HB  CYS A  12       9.321   5.556  -3.942  1.00  9.720          H  
ATOM    181 2HB  CYS A  12       8.222   6.526  -4.899  1.00  9.720          H  
ATOM    182  HG  CYS A  12      10.094   5.878  -6.394  1.00  9.720          H  
ATOM    183  N   ARG A  13      11.132   8.712  -2.656  1.00  5.530          N  
ATOM    184  CA  ARG A  13      12.399   9.040  -2.022  1.00  5.820          C  
ATOM    185  C   ARG A  13      12.189  10.030  -0.868  1.00  5.580          C  
ATOM    186  O   ARG A  13      13.146  10.584  -0.329  1.00  5.710          O  
ATOM    187  CB  ARG A  13      13.341   9.627  -3.052  1.00  8.030          C  
ATOM    188  CG  ARG A  13      13.798   8.649  -4.105  1.00  8.030          C  
ATOM    189  CD  ARG A  13      14.763   9.263  -5.032  1.00  8.030          C  
ATOM    190  NE  ARG A  13      14.122  10.302  -5.846  1.00  8.030          N  
ATOM    191  CZ  ARG A  13      13.464  10.099  -7.007  1.00  8.030          C  
ATOM    192  NH1 ARG A  13      13.338   8.891  -7.534  1.00  8.030          N  
ATOM    193  NH2 ARG A  13      12.946  11.153  -7.605  1.00  8.030          N  
ATOM    194  H   ARG A  13      10.744   9.368  -3.319  1.00  6.640          H  
ATOM    195  HA  ARG A  13      12.836   8.125  -1.623  1.00  6.980          H  
ATOM    196 1HB  ARG A  13      12.842  10.442  -3.565  1.00  9.640          H  
ATOM    197 2HB  ARG A  13      14.222  10.036  -2.559  1.00  9.640          H  
ATOM    198 1HG  ARG A  13      14.269   7.792  -3.626  1.00  9.640          H  
ATOM    199 2HG  ARG A  13      12.941   8.315  -4.674  1.00  9.640          H  
ATOM    200 1HD  ARG A  13      15.565   9.730  -4.459  1.00  9.640          H  
ATOM    201 2HD  ARG A  13      15.187   8.509  -5.690  1.00  9.640          H  
ATOM    202  HE  ARG A  13      14.153  11.283  -5.515  1.00  9.640          H  
ATOM    203 1HH1 ARG A  13      13.733   8.089  -7.069  1.00  9.640          H  
ATOM    204 2HH1 ARG A  13      12.838   8.769  -8.403  1.00  9.640          H  
ATOM    205 1HH2 ARG A  13      13.064  12.080  -7.152  1.00  9.640          H  
ATOM    206 2HH2 ARG A  13      12.440  11.064  -8.470  1.00  9.640          H  
ATOM    207  N   HIS A  14      10.918  10.258  -0.528  1.00  5.560          N  
ATOM    208  CA  HIS A  14      10.424  11.158   0.508  1.00  5.620          C  
ATOM    209  C   HIS A  14      10.731  12.641   0.313  1.00  5.610          C  
ATOM    210  O   HIS A  14      10.689  13.424   1.261  1.00  6.060          O  
ATOM    211  CB  HIS A  14      10.896  10.714   1.896  1.00  7.840          C  
ATOM    212  CG  HIS A  14      10.388   9.370   2.311  1.00  7.840          C  
ATOM    213  ND1 HIS A  14      10.647   8.839   3.556  1.00  7.840          N  
ATOM    214  CD2 HIS A  14       9.632   8.446   1.659  1.00  7.840          C  
ATOM    215  CE1 HIS A  14      10.069   7.652   3.656  1.00  7.840          C  
ATOM    216  NE2 HIS A  14       9.454   7.393   2.519  1.00  7.840          N  
ATOM    217  H   HIS A  14      10.186   9.756  -1.031  1.00  6.670          H  
ATOM    218  HA  HIS A  14       9.361  11.053   0.504  1.00  6.740          H  
ATOM    219 1HB  HIS A  14      11.983  10.693   1.928  1.00  9.410          H  
ATOM    220 2HB  HIS A  14      10.571  11.432   2.637  1.00  9.410          H  
ATOM    221  HD1 HIS A  14      11.335   9.186   4.195  1.00  9.410          H  
ATOM    222  HD2 HIS A  14       9.182   8.408   0.661  1.00  9.410          H  
ATOM    223  HE1 HIS A  14      10.155   7.067   4.573  1.00  9.410          H  
ATOM    224  N   GLU A  15      10.856  13.045  -0.941  1.00  5.450          N  
ATOM    225  CA  GLU A  15      11.138  14.413  -1.371  1.00  5.820          C  
ATOM    226  C   GLU A  15      10.104  15.442  -0.904  1.00  5.970          C  
ATOM    227  O   GLU A  15      10.433  16.606  -0.659  1.00  6.360          O  
ATOM    228  CB  GLU A  15      11.229  14.429  -2.895  1.00  8.000          C  
ATOM    229  CG  GLU A  15      12.460  13.713  -3.446  1.00  8.000          C  
ATOM    230  CD  GLU A  15      12.453  13.609  -4.946  1.00  8.000          C  
ATOM    231  OE1 GLU A  15      11.434  13.885  -5.523  1.00  8.000          O  
ATOM    232  OE2 GLU A  15      13.459  13.241  -5.521  1.00  8.000          O  
ATOM    233  H   GLU A  15      10.852  12.320  -1.641  1.00  6.540          H  
ATOM    234  HA  GLU A  15      12.108  14.694  -0.971  1.00  6.980          H  
ATOM    235 1HB  GLU A  15      10.342  13.957  -3.318  1.00  9.600          H  
ATOM    236 2HB  GLU A  15      11.251  15.460  -3.247  1.00  9.600          H  
ATOM    237 1HG  GLU A  15      13.350  14.258  -3.136  1.00  9.600          H  
ATOM    238 2HG  GLU A  15      12.514  12.720  -3.012  1.00  9.600          H  
ATOM    239  N   ARG A  16       8.842  15.031  -0.829  1.00  5.950          N  
ATOM    240  CA  ARG A  16       7.743  15.897  -0.421  1.00  6.410          C  
ATOM    241  C   ARG A  16       7.243  15.658   1.006  1.00  6.430          C  
ATOM    242  O   ARG A  16       6.207  16.204   1.390  1.00  6.920          O  
ATOM    243  CB  ARG A  16       6.562  15.692  -1.360  1.00  8.790          C  
ATOM    244  CG  ARG A  16       6.796  16.043  -2.835  1.00  8.790          C  
ATOM    245  CD  ARG A  16       6.973  17.510  -3.059  1.00  8.790          C  
ATOM    246  NE  ARG A  16       5.813  18.256  -2.575  1.00  8.790          N  
ATOM    247  CZ  ARG A  16       4.650  18.441  -3.249  1.00  8.790          C  
ATOM    248  NH1 ARG A  16       4.476  17.941  -4.458  1.00  8.790          N  
ATOM    249  NH2 ARG A  16       3.673  19.121  -2.679  1.00  8.790          N  
ATOM    250  H   ARG A  16       8.629  14.085  -1.108  1.00  7.140          H  
ATOM    251  HA  ARG A  16       8.085  16.927  -0.479  1.00  7.690          H  
ATOM    252 1HB  ARG A  16       6.262  14.643  -1.326  1.00 10.550          H  
ATOM    253 2HB  ARG A  16       5.712  16.272  -1.008  1.00 10.550          H  
ATOM    254 1HG  ARG A  16       7.704  15.551  -3.182  1.00 10.550          H  
ATOM    255 2HG  ARG A  16       5.946  15.688  -3.422  1.00 10.550          H  
ATOM    256 1HD  ARG A  16       7.857  17.869  -2.536  1.00 10.550          H  
ATOM    257 2HD  ARG A  16       7.095  17.706  -4.121  1.00 10.550          H  
ATOM    258  HE  ARG A  16       5.882  18.664  -1.649  1.00 10.550          H  
ATOM    259 1HH1 ARG A  16       5.203  17.411  -4.902  1.00 10.550          H  
ATOM    260 2HH1 ARG A  16       3.585  18.076  -4.936  1.00 10.550          H  
ATOM    261 1HH2 ARG A  16       3.787  19.492  -1.752  1.00 10.550          H  
ATOM    262 2HH2 ARG A  16       2.787  19.239  -3.167  1.00 10.550          H  
ATOM    263  N   TYR A  17       7.932  14.827   1.779  1.00  6.160          N  
ATOM    264  CA  TYR A  17       7.419  14.468   3.092  1.00  6.360          C  
ATOM    265  C   TYR A  17       7.746  15.468   4.200  1.00  5.990          C  
ATOM    266  O   TYR A  17       8.837  16.049   4.215  1.00  5.940          O  
ATOM    267  CB  TYR A  17       7.928  13.083   3.482  1.00  8.820          C  
ATOM    268  CG  TYR A  17       7.267  11.903   2.760  1.00  8.820          C  
ATOM    269  CD1 TYR A  17       7.116  11.871   1.385  1.00  8.820          C  
ATOM    270  CD2 TYR A  17       6.862  10.805   3.497  1.00  8.820          C  
ATOM    271  CE1 TYR A  17       6.599  10.779   0.786  1.00  8.820          C  
ATOM    272  CE2 TYR A  17       6.332   9.709   2.853  1.00  8.820          C  
ATOM    273  CZ  TYR A  17       6.216   9.718   1.490  1.00  8.820          C  
ATOM    274  OH  TYR A  17       5.738   8.635   0.821  1.00  8.820          O  
ATOM    275  H   TYR A  17       8.824  14.435   1.458  1.00  7.390          H  
ATOM    276  HA  TYR A  17       6.345  14.406   2.974  1.00  7.630          H  
ATOM    277 1HB  TYR A  17       8.994  13.043   3.273  1.00 10.590          H  
ATOM    278 2HB  TYR A  17       7.822  12.931   4.552  1.00 10.590          H  
ATOM    279  HD1 TYR A  17       7.425  12.675   0.755  1.00 10.590          H  
ATOM    280  HD2 TYR A  17       6.979  10.797   4.580  1.00 10.590          H  
ATOM    281  HE1 TYR A  17       6.513  10.743  -0.280  1.00 10.590          H  
ATOM    282  HE2 TYR A  17       6.023   8.830   3.422  1.00 10.590          H  
ATOM    283  HH  TYR A  17       5.623   8.856  -0.153  1.00 10.590          H  
ATOM    284  N   PRO A  18       6.846  15.619   5.202  1.00  6.090          N  
ATOM    285  CA  PRO A  18       6.986  16.472   6.374  1.00  6.070          C  
ATOM    286  C   PRO A  18       8.170  16.076   7.243  1.00  6.100          C  
ATOM    287  O   PRO A  18       8.657  16.879   8.035  1.00  6.390          O  
ATOM    288  CB  PRO A  18       5.646  16.286   7.103  1.00  9.110          C  
ATOM    289  CG  PRO A  18       5.106  14.964   6.618  1.00  9.110          C  
ATOM    290  CD  PRO A  18       5.557  14.866   5.183  1.00  9.110          C  
ATOM    291  HA  PRO A  18       7.098  17.512   6.036  1.00  7.280          H  
ATOM    292 1HB  PRO A  18       5.817  16.295   8.191  1.00 10.930          H  
ATOM    293 2HB  PRO A  18       4.979  17.131   6.879  1.00 10.930          H  
ATOM    294 1HG  PRO A  18       5.491  14.141   7.244  1.00 10.930          H  
ATOM    295 2HG  PRO A  18       4.009  14.947   6.718  1.00 10.930          H  
ATOM    296 1HD  PRO A  18       5.671  13.800   4.952  1.00 10.930          H  
ATOM    297 2HD  PRO A  18       4.840  15.368   4.517  1.00 10.930          H  
ATOM    298  N   THR A  19       8.642  14.841   7.084  1.00  6.060          N  
ATOM    299  CA  THR A  19       9.764  14.355   7.843  1.00  6.340          C  
ATOM    300  C   THR A  19      10.861  13.864   6.911  1.00  6.210          C  
ATOM    301  O   THR A  19      11.645  12.991   7.269  1.00  6.380          O  
ATOM    302  CB  THR A  19       9.311  13.172   8.722  1.00  8.760          C  
ATOM    303  OG1 THR A  19       8.717  12.142   7.881  1.00  8.760          O  
ATOM    304  CG2 THR A  19       8.312  13.634   9.742  1.00  8.760          C  
ATOM    305  H   THR A  19       8.211  14.197   6.439  1.00  7.270          H  
ATOM    306  HA  THR A  19      10.160  15.159   8.465  1.00  7.610          H  
ATOM    307  HB  THR A  19      10.148  12.760   9.216  1.00 10.520          H  
ATOM    308  HG1 THR A  19       8.610  11.287   8.400  1.00 10.520          H  
ATOM    309 1HG2 THR A  19       8.012  12.783  10.354  1.00 10.520          H  
ATOM    310 2HG2 THR A  19       8.771  14.396  10.371  1.00 10.520          H  
ATOM    311 3HG2 THR A  19       7.441  14.048   9.246  1.00 10.520          H  
ATOM    312  N   ARG A  20      11.086  14.577   5.804  1.00  6.230          N  
ATOM    313  CA  ARG A  20      12.132  14.186   4.849  1.00  6.420          C  
ATOM    314  C   ARG A  20      13.508  14.010   5.482  1.00  6.110          C  
ATOM    315  O   ARG A  20      14.256  13.102   5.113  1.00  6.280          O  
ATOM    316  CB  ARG A  20      12.253  15.201   3.724  1.00  8.910          C  
ATOM    317  CG  ARG A  20      13.253  14.810   2.634  1.00  8.910          C  
ATOM    318  CD  ARG A  20      13.220  15.744   1.490  1.00  8.910          C  
ATOM    319  NE  ARG A  20      13.827  17.021   1.787  1.00  8.910          N  
ATOM    320  CZ  ARG A  20      13.575  18.203   1.195  1.00  8.910          C  
ATOM    321  NH1 ARG A  20      12.654  18.369   0.246  1.00  8.910          N  
ATOM    322  NH2 ARG A  20      14.313  19.211   1.613  1.00  8.910          N  
ATOM    323  H   ARG A  20      10.422  15.313   5.538  1.00  7.480          H  
ATOM    324  HA  ARG A  20      11.833  13.235   4.405  1.00  7.700          H  
ATOM    325 1HB  ARG A  20      11.279  15.331   3.245  1.00 10.690          H  
ATOM    326 2HB  ARG A  20      12.555  16.166   4.125  1.00 10.690          H  
ATOM    327 1HG  ARG A  20      14.265  14.832   3.042  1.00 10.690          H  
ATOM    328 2HG  ARG A  20      13.029  13.808   2.273  1.00 10.690          H  
ATOM    329 1HD  ARG A  20      13.752  15.299   0.651  1.00 10.690          H  
ATOM    330 2HD  ARG A  20      12.183  15.912   1.221  1.00 10.690          H  
ATOM    331  HE  ARG A  20      14.573  17.046   2.482  1.00 10.690          H  
ATOM    332 1HH1 ARG A  20      12.054  17.588  -0.079  1.00 10.690          H  
ATOM    333 2HH1 ARG A  20      12.513  19.282  -0.160  1.00 10.690          H  
ATOM    334 1HH2 ARG A  20      15.013  19.000   2.341  1.00 10.690          H  
ATOM    335 2HH2 ARG A  20      14.203  20.137   1.231  1.00 10.690          H  
ATOM    336  N   HIS A  21      13.861  14.890   6.420  1.00  6.050          N  
ATOM    337  CA  HIS A  21      15.168  14.827   7.067  1.00  6.180          C  
ATOM    338  C   HIS A  21      15.049  14.430   8.533  1.00  5.930          C  
ATOM    339  O   HIS A  21      16.001  14.559   9.305  1.00  6.180          O  
ATOM    340  CB  HIS A  21      15.856  16.188   6.987  1.00  8.600          C  
ATOM    341  CG  HIS A  21      16.092  16.649   5.599  1.00  8.600          C  
ATOM    342  ND1 HIS A  21      17.035  16.082   4.770  1.00  8.600          N  
ATOM    343  CD2 HIS A  21      15.498  17.629   4.890  1.00  8.600          C  
ATOM    344  CE1 HIS A  21      17.010  16.696   3.604  1.00  8.600          C  
ATOM    345  NE2 HIS A  21      16.079  17.644   3.649  1.00  8.600          N  
ATOM    346  H   HIS A  21      13.206  15.619   6.672  1.00  7.260          H  
ATOM    347  HA  HIS A  21      15.793  14.089   6.568  1.00  7.420          H  
ATOM    348 1HB  HIS A  21      15.246  16.931   7.499  1.00 10.320          H  
ATOM    349 2HB  HIS A  21      16.817  16.142   7.500  1.00 10.320          H  
ATOM    350  HD1 HIS A  21      17.518  15.219   4.933  1.00 10.320          H  
ATOM    351  HD2 HIS A  21      14.703  18.336   5.127  1.00 10.320          H  
ATOM    352  HE1 HIS A  21      17.685  16.393   2.804  1.00 10.320          H  
ATOM    353  N   GLN A  22      13.850  14.024   8.931  1.00  5.790          N  
ATOM    354  CA  GLN A  22      13.549  13.642  10.300  1.00  5.880          C  
ATOM    355  C   GLN A  22      12.634  12.427  10.347  1.00  5.730          C  
ATOM    356  O   GLN A  22      11.637  12.479  11.067  1.00  5.800          O  
ATOM    357  CB  GLN A  22      12.895  14.802  11.066  1.00  8.200          C  
ATOM    358  CG  GLN A  22      13.787  16.032  11.231  1.00  8.200          C  
ATOM    359  CD  GLN A  22      13.161  17.117  12.091  1.00  8.200          C  
ATOM    360  OE1 GLN A  22      11.958  17.381  12.026  1.00  8.200          O  
ATOM    361  NE2 GLN A  22      13.987  17.757  12.911  1.00  8.200          N  
ATOM    362  H   GLN A  22      13.126  13.890   8.222  1.00  6.950          H  
ATOM    363  HA  GLN A  22      14.478  13.387  10.806  1.00  7.060          H  
ATOM    364 1HB  GLN A  22      11.984  15.110  10.550  1.00  9.840          H  
ATOM    365 2HB  GLN A  22      12.610  14.466  12.063  1.00  9.840          H  
ATOM    366 1HG  GLN A  22      14.728  15.724  11.686  1.00  9.840          H  
ATOM    367 2HG  GLN A  22      13.976  16.459  10.250  1.00  9.840          H  
ATOM    368 1HE2 GLN A  22      13.639  18.484  13.506  1.00  9.840          H  
ATOM    369 2HE2 GLN A  22      14.958  17.515  12.933  1.00  9.840          H  
ATOM    370  N   PRO A  23      12.916  11.336   9.610  1.00  5.910          N  
ATOM    371  CA  PRO A  23      12.039  10.192   9.475  1.00  6.070          C  
ATOM    372  C   PRO A  23      11.771   9.547  10.810  1.00  5.990          C  
ATOM    373  O   PRO A  23      12.669   9.447  11.652  1.00  6.530          O  
ATOM    374  CB  PRO A  23      12.846   9.242   8.578  1.00  9.110          C  
ATOM    375  CG  PRO A  23      14.294   9.681   8.741  1.00  9.110          C  
ATOM    376  CD  PRO A  23      14.220  11.177   8.932  1.00  9.110          C  
ATOM    377  HA  PRO A  23      11.098  10.497   8.989  1.00  7.280          H  
ATOM    378 1HB  PRO A  23      12.674   8.201   8.897  1.00 10.930          H  
ATOM    379 2HB  PRO A  23      12.489   9.323   7.542  1.00 10.930          H  
ATOM    380 1HG  PRO A  23      14.748   9.167   9.605  1.00 10.930          H  
ATOM    381 2HG  PRO A  23      14.882   9.396   7.854  1.00 10.930          H  
ATOM    382 1HD  PRO A  23      15.053  11.526   9.554  1.00 10.930          H  
ATOM    383 2HD  PRO A  23      14.202  11.647   7.933  1.00 10.930          H  
ATOM    384  N   HIS A  24      10.552   9.065  10.972  1.00  5.690          N  
ATOM    385  CA  HIS A  24      10.134   8.395  12.182  1.00  6.030          C  
ATOM    386  C   HIS A  24       9.847   6.938  11.868  1.00  5.810          C  
ATOM    387  O   HIS A  24       9.484   6.588  10.737  1.00  5.890          O  
ATOM    388  CB  HIS A  24       8.879   9.075  12.751  1.00  8.310          C  
ATOM    389  CG  HIS A  24       8.524   8.673  14.163  1.00  8.310          C  
ATOM    390  ND1 HIS A  24       7.800   7.531  14.477  1.00  8.310          N  
ATOM    391  CD2 HIS A  24       8.800   9.277  15.340  1.00  8.310          C  
ATOM    392  CE1 HIS A  24       7.657   7.456  15.786  1.00  8.310          C  
ATOM    393  NE2 HIS A  24       8.257   8.502  16.332  1.00  8.310          N  
ATOM    394  H   HIS A  24       9.858   9.207  10.225  1.00  6.830          H  
ATOM    395  HA  HIS A  24      10.921   8.436  12.933  1.00  7.240          H  
ATOM    396 1HB  HIS A  24       9.014  10.156  12.723  1.00  9.970          H  
ATOM    397 2HB  HIS A  24       8.027   8.839  12.107  1.00  9.970          H  
ATOM    398  HD1 HIS A  24       7.516   6.770  13.841  1.00  9.970          H  
ATOM    399  HD2 HIS A  24       9.339  10.191  15.592  1.00  9.970          H  
ATOM    400  HE1 HIS A  24       7.116   6.623  16.234  1.00  9.970          H  
ATOM    401  N   MET A  25      10.019   6.064  12.848  1.00  5.960          N  
ATOM    402  CA  MET A  25       9.670   4.680  12.607  1.00  6.210          C  
ATOM    403  C   MET A  25       8.206   4.630  12.186  1.00  6.220          C  
ATOM    404  O   MET A  25       7.349   5.289  12.781  1.00  6.470          O  
ATOM    405  CB  MET A  25       9.910   3.846  13.862  1.00  8.590          C  
ATOM    406  CG  MET A  25       9.667   2.340  13.690  1.00  8.590          C  
ATOM    407  SD  MET A  25      10.049   1.374  15.177  1.00  8.590          S  
ATOM    408  CE  MET A  25      11.847   1.353  15.181  1.00  8.590          C  
ATOM    409  H   MET A  25      10.369   6.356  13.752  1.00  7.150          H  
ATOM    410  HA  MET A  25      10.279   4.294  11.791  1.00  7.450          H  
ATOM    411 1HB  MET A  25      10.930   3.995  14.192  1.00 10.310          H  
ATOM    412 2HB  MET A  25       9.254   4.199  14.659  1.00 10.310          H  
ATOM    413 1HG  MET A  25       8.619   2.167  13.442  1.00 10.310          H  
ATOM    414 2HG  MET A  25      10.276   1.963  12.870  1.00 10.310          H  
ATOM    415 1HE  MET A  25      12.199   0.783  16.042  1.00 10.310          H  
ATOM    416 2HE  MET A  25      12.208   0.883  14.265  1.00 10.310          H  
ATOM    417 3HE  MET A  25      12.233   2.366  15.244  1.00 10.310          H  
ATOM    418  N   GLY A  26       7.918   3.845  11.151  1.00  6.300          N  
ATOM    419  CA  GLY A  26       6.560   3.719  10.636  1.00  6.640          C  
ATOM    420  C   GLY A  26       6.267   4.608   9.415  1.00  6.260          C  
ATOM    421  O   GLY A  26       5.248   4.408   8.754  1.00  6.650          O  
ATOM    422  H   GLY A  26       8.663   3.327  10.708  1.00  7.560          H  
ATOM    423 1HA  GLY A  26       6.378   2.678  10.370  1.00  7.970          H  
ATOM    424 2HA  GLY A  26       5.856   3.963  11.431  1.00  7.970          H  
ATOM    425  N   ASP A  27       7.161   5.560   9.086  1.00  5.790          N  
ATOM    426  CA  ASP A  27       6.940   6.414   7.908  1.00  5.770          C  
ATOM    427  C   ASP A  27       7.178   5.641   6.606  1.00  5.580          C  
ATOM    428  O   ASP A  27       6.542   5.917   5.587  1.00  5.830          O  
ATOM    429  CB  ASP A  27       7.877   7.635   7.885  1.00  8.090          C  
ATOM    430  CG  ASP A  27       7.611   8.732   8.941  1.00  8.090          C  
ATOM    431  OD1 ASP A  27       6.577   8.761   9.559  1.00  8.090          O  
ATOM    432  OD2 ASP A  27       8.498   9.578   9.086  1.00  8.090          O  
ATOM    433  H   ASP A  27       7.976   5.731   9.685  1.00  6.950          H  
ATOM    434  HA  ASP A  27       5.906   6.759   7.921  1.00  6.920          H  
ATOM    435 1HB  ASP A  27       8.900   7.282   8.030  1.00  9.700          H  
ATOM    436 2HB  ASP A  27       7.837   8.092   6.896  1.00  9.700          H  
ATOM    437  N   SER A  28       8.131   4.707   6.644  1.00  5.510          N  
ATOM    438  CA  SER A  28       8.542   3.882   5.512  1.00  5.640          C  
ATOM    439  C   SER A  28       7.449   2.928   5.046  1.00  5.160          C  
ATOM    440  O   SER A  28       6.643   2.441   5.840  1.00  5.370          O  
ATOM    441  CB  SER A  28       9.766   3.063   5.887  1.00  7.840          C  
ATOM    442  OG  SER A  28      10.870   3.879   6.177  1.00  7.840          O  
ATOM    443  H   SER A  28       8.615   4.557   7.515  1.00  6.610          H  
ATOM    444  HA  SER A  28       8.796   4.543   4.682  1.00  6.770          H  
ATOM    445 1HB  SER A  28       9.531   2.444   6.751  1.00  9.410          H  
ATOM    446 2HB  SER A  28      10.011   2.389   5.064  1.00  9.410          H  
ATOM    447  HG  SER A  28      11.603   3.281   6.358  1.00  9.410          H  
ATOM    448  N   TRP A  29       7.461   2.613   3.758  1.00  4.870          N  
ATOM    449  CA  TRP A  29       6.509   1.666   3.202  1.00  4.740          C  
ATOM    450  C   TRP A  29       6.942   0.212   3.447  1.00  4.750          C  
ATOM    451  O   TRP A  29       8.143  -0.054   3.492  1.00  4.950          O  
ATOM    452  CB  TRP A  29       6.350   1.913   1.713  1.00  6.690          C  
ATOM    453  CG  TRP A  29       5.654   3.206   1.397  1.00  6.690          C  
ATOM    454  CD1 TRP A  29       4.742   3.865   2.174  1.00  6.690          C  
ATOM    455  CD2 TRP A  29       5.837   4.031   0.234  1.00  6.690          C  
ATOM    456  NE1 TRP A  29       4.352   5.009   1.566  1.00  6.690          N  
ATOM    457  CE2 TRP A  29       5.006   5.131   0.383  1.00  6.690          C  
ATOM    458  CE3 TRP A  29       6.626   3.939  -0.891  1.00  6.690          C  
ATOM    459  CZ2 TRP A  29       4.939   6.117  -0.562  1.00  6.690          C  
ATOM    460  CZ3 TRP A  29       6.552   4.951  -1.812  1.00  6.690          C  
ATOM    461  CH2 TRP A  29       5.746   5.990  -1.659  1.00  6.690          C  
ATOM    462  H   TRP A  29       8.140   3.055   3.154  1.00  5.840          H  
ATOM    463  HA  TRP A  29       5.569   1.869   3.678  1.00  5.690          H  
ATOM    464 1HB  TRP A  29       7.324   1.903   1.228  1.00  8.030          H  
ATOM    465 2HB  TRP A  29       5.762   1.104   1.294  1.00  8.030          H  
ATOM    466  HD1 TRP A  29       4.367   3.541   3.137  1.00  8.030          H  
ATOM    467  HE1 TRP A  29       3.679   5.675   1.957  1.00  8.030          H  
ATOM    468  HE3 TRP A  29       7.297   3.096  -1.037  1.00  8.030          H  
ATOM    469  HZ2 TRP A  29       4.291   6.984  -0.455  1.00  8.030          H  
ATOM    470  HZ3 TRP A  29       7.164   4.909  -2.665  1.00  8.030          H  
ATOM    471  HH2 TRP A  29       5.744   6.758  -2.427  1.00  8.030          H  
ATOM    472  N   PRO A  30       5.989  -0.734   3.608  1.00  4.960          N  
ATOM    473  CA  PRO A  30       6.184  -2.173   3.724  1.00  5.290          C  
ATOM    474  C   PRO A  30       6.880  -2.763   2.512  1.00  5.290          C  
ATOM    475  O   PRO A  30       6.680  -2.316   1.384  1.00  5.310          O  
ATOM    476  CB  PRO A  30       4.751  -2.714   3.810  1.00  7.940          C  
ATOM    477  CG  PRO A  30       3.933  -1.580   4.347  1.00  7.940          C  
ATOM    478  CD  PRO A  30       4.566  -0.328   3.790  1.00  7.940          C  
ATOM    479  HA  PRO A  30       6.751  -2.387   4.642  1.00  6.350          H  
ATOM    480 1HB  PRO A  30       4.414  -3.047   2.809  1.00  9.520          H  
ATOM    481 2HB  PRO A  30       4.724  -3.602   4.460  1.00  9.520          H  
ATOM    482 1HG  PRO A  30       2.884  -1.698   4.034  1.00  9.520          H  
ATOM    483 2HG  PRO A  30       3.939  -1.597   5.447  1.00  9.520          H  
ATOM    484 1HD  PRO A  30       4.106  -0.019   2.838  1.00  9.520          H  
ATOM    485 2HD  PRO A  30       4.448   0.415   4.591  1.00  9.520          H  
ATOM    486  N   ARG A  31       7.584  -3.867   2.710  1.00  5.610          N  
ATOM    487  CA  ARG A  31       8.303  -4.487   1.606  1.00  5.960          C  
ATOM    488  C   ARG A  31       7.499  -5.673   1.135  1.00  5.560          C  
ATOM    489  O   ARG A  31       7.850  -6.833   1.364  1.00  5.690          O  
ATOM    490  CB  ARG A  31       9.654  -5.001   2.078  1.00  8.200          C  
ATOM    491  CG  ARG A  31      10.636  -3.962   2.565  1.00  8.200          C  
ATOM    492  CD  ARG A  31      11.866  -4.618   3.091  1.00  8.200          C  
ATOM    493  NE  ARG A  31      12.886  -3.662   3.495  1.00  8.200          N  
ATOM    494  CZ  ARG A  31      12.958  -3.020   4.686  1.00  8.200          C  
ATOM    495  NH1 ARG A  31      12.050  -3.226   5.628  1.00  8.200          N  
ATOM    496  NH2 ARG A  31      13.954  -2.178   4.905  1.00  8.200          N  
ATOM    497  H   ARG A  31       7.673  -4.245   3.642  1.00  6.730          H  
ATOM    498  HA  ARG A  31       8.427  -3.771   0.788  1.00  7.150          H  
ATOM    499 1HB  ARG A  31       9.505  -5.710   2.890  1.00  9.840          H  
ATOM    500 2HB  ARG A  31      10.134  -5.539   1.265  1.00  9.840          H  
ATOM    501 1HG  ARG A  31      10.908  -3.313   1.734  1.00  9.840          H  
ATOM    502 2HG  ARG A  31      10.180  -3.364   3.352  1.00  9.840          H  
ATOM    503 1HD  ARG A  31      11.620  -5.248   3.943  1.00  9.840          H  
ATOM    504 2HD  ARG A  31      12.291  -5.239   2.301  1.00  9.840          H  
ATOM    505  HE  ARG A  31      13.617  -3.464   2.803  1.00  9.840          H  
ATOM    506 1HH1 ARG A  31      11.287  -3.865   5.469  1.00  9.840          H  
ATOM    507 2HH1 ARG A  31      12.119  -2.741   6.512  1.00  9.840          H  
ATOM    508 1HH2 ARG A  31      14.653  -2.022   4.186  1.00  9.840          H  
ATOM    509 2HH2 ARG A  31      14.024  -1.693   5.785  1.00  9.840          H  
ATOM    510  N   SER A  32       6.402  -5.324   0.488  1.00  5.380          N  
ATOM    511  CA  SER A  32       5.387  -6.237  -0.024  1.00  5.300          C  
ATOM    512  C   SER A  32       5.849  -6.966  -1.278  1.00  5.390          C  
ATOM    513  O   SER A  32       6.822  -6.560  -1.941  1.00  5.890          O  
ATOM    514  CB  SER A  32       4.114  -5.464  -0.338  1.00  7.450          C  
ATOM    515  OG  SER A  32       3.537  -4.889   0.816  1.00  7.450          O  
ATOM    516  H   SER A  32       6.257  -4.311   0.394  1.00  6.460          H  
ATOM    517  HA  SER A  32       5.166  -6.983   0.742  1.00  6.360          H  
ATOM    518 1HB  SER A  32       4.340  -4.678  -1.057  1.00  8.940          H  
ATOM    519 2HB  SER A  32       3.392  -6.133  -0.813  1.00  8.940          H  
ATOM    520  HG  SER A  32       2.751  -4.371   0.493  1.00  8.940          H  
ATOM    521  N   SER A  33       5.191  -8.097  -1.581  1.00  5.270          N  
ATOM    522  CA  SER A  33       5.473  -8.795  -2.842  1.00  5.690          C  
ATOM    523  C   SER A  33       4.494  -8.330  -3.918  1.00  5.550          C  
ATOM    524  O   SER A  33       3.426  -7.786  -3.597  1.00  5.400          O  
ATOM    525  CB  SER A  33       5.380 -10.299  -2.685  1.00  7.800          C  
ATOM    526  OG  SER A  33       4.061 -10.728  -2.474  1.00  7.800          O  
ATOM    527  H   SER A  33       4.449  -8.452  -0.953  1.00  6.320          H  
ATOM    528  HA  SER A  33       6.482  -8.555  -3.155  1.00  6.830          H  
ATOM    529 1HB  SER A  33       5.784 -10.783  -3.572  1.00  9.360          H  
ATOM    530 2HB  SER A  33       5.997 -10.603  -1.843  1.00  9.360          H  
ATOM    531  HG  SER A  33       4.137 -11.651  -2.193  1.00  9.360          H  
ATOM    532  N   ALA A  34       4.824  -8.575  -5.193  1.00  5.990          N  
ATOM    533  CA  ALA A  34       3.931  -8.248  -6.299  1.00  6.310          C  
ATOM    534  C   ALA A  34       2.662  -9.056  -6.188  1.00  5.880          C  
ATOM    535  O   ALA A  34       1.576  -8.577  -6.510  1.00  5.620          O  
ATOM    536  CB  ALA A  34       4.619  -8.493  -7.634  1.00  8.710          C  
ATOM    537  H   ALA A  34       5.714  -9.034  -5.401  1.00  7.190          H  
ATOM    538  HA  ALA A  34       3.652  -7.201  -6.221  1.00  7.570          H  
ATOM    539 1HB  ALA A  34       3.945  -8.232  -8.444  1.00 10.450          H  
ATOM    540 2HB  ALA A  34       5.515  -7.889  -7.703  1.00 10.450          H  
ATOM    541 3HB  ALA A  34       4.891  -9.545  -7.706  1.00 10.450          H  
ATOM    542  N   HIS A  35       2.800 -10.301  -5.735  1.00  6.090          N  
ATOM    543  CA  HIS A  35       1.667 -11.190  -5.602  1.00  6.010          C  
ATOM    544  C   HIS A  35       0.668 -10.635  -4.601  1.00  5.100          C  
ATOM    545  O   HIS A  35      -0.529 -10.554  -4.888  1.00  5.030          O  
ATOM    546  CB  HIS A  35       2.095 -12.581  -5.139  1.00  8.450          C  
ATOM    547  CG  HIS A  35       0.948 -13.503  -5.090  1.00  8.450          C  
ATOM    548  ND1 HIS A  35       0.467 -14.150  -6.211  1.00  8.450          N  
ATOM    549  CD2 HIS A  35       0.122 -13.832  -4.082  1.00  8.450          C  
ATOM    550  CE1 HIS A  35      -0.601 -14.849  -5.880  1.00  8.450          C  
ATOM    551  NE2 HIS A  35      -0.831 -14.664  -4.600  1.00  8.450          N  
ATOM    552  H   HIS A  35       3.722 -10.645  -5.501  1.00  7.310          H  
ATOM    553  HA  HIS A  35       1.161 -11.287  -6.562  1.00  7.210          H  
ATOM    554 1HB  HIS A  35       2.846 -12.984  -5.818  1.00 10.140          H  
ATOM    555 2HB  HIS A  35       2.537 -12.521  -4.146  1.00 10.140          H  
ATOM    556  HD2 HIS A  35       0.177 -13.478  -3.051  1.00 10.140          H  
ATOM    557  HE1 HIS A  35      -1.206 -15.452  -6.555  1.00 10.140          H  
ATOM    558  HE2 HIS A  35      -1.626 -15.039  -4.051  1.00 10.140          H  
ATOM    559  N   GLU A  36       1.151 -10.275  -3.408  1.00  4.660          N  
ATOM    560  CA  GLU A  36       0.261  -9.785  -2.365  1.00  4.100          C  
ATOM    561  C   GLU A  36      -0.453  -8.513  -2.786  1.00  3.500          C  
ATOM    562  O   GLU A  36      -1.663  -8.370  -2.586  1.00  3.300          O  
ATOM    563  CB  GLU A  36       1.090  -9.487  -1.118  1.00  5.960          C  
ATOM    564  CG  GLU A  36       1.629 -10.707  -0.396  1.00  5.960          C  
ATOM    565  CD  GLU A  36       2.700 -10.348   0.611  1.00  5.960          C  
ATOM    566  OE1 GLU A  36       3.272  -9.268   0.496  1.00  5.960          O  
ATOM    567  OE2 GLU A  36       2.949 -11.139   1.492  1.00  5.960          O  
ATOM    568  H   GLU A  36       2.150 -10.361  -3.218  1.00  5.590          H  
ATOM    569  HA  GLU A  36      -0.483 -10.554  -2.150  1.00  4.920          H  
ATOM    570 1HB  GLU A  36       1.944  -8.867  -1.405  1.00  7.160          H  
ATOM    571 2HB  GLU A  36       0.493  -8.912  -0.413  1.00  7.160          H  
ATOM    572 1HG  GLU A  36       0.803 -11.190   0.126  1.00  7.160          H  
ATOM    573 2HG  GLU A  36       2.019 -11.415  -1.119  1.00  7.160          H  
ATOM    574  N   ALA A  37       0.299  -7.589  -3.379  1.00  3.650          N  
ATOM    575  CA  ALA A  37      -0.264  -6.339  -3.833  1.00  3.640          C  
ATOM    576  C   ALA A  37      -1.302  -6.593  -4.934  1.00  3.650          C  
ATOM    577  O   ALA A  37      -2.320  -5.890  -5.019  1.00  3.880          O  
ATOM    578  CB  ALA A  37       0.861  -5.443  -4.272  1.00  5.100          C  
ATOM    579  H   ALA A  37       1.305  -7.751  -3.502  1.00  4.380          H  
ATOM    580  HA  ALA A  37      -0.782  -5.866  -3.002  1.00  4.370          H  
ATOM    581 1HB  ALA A  37       0.463  -4.493  -4.607  1.00  6.120          H  
ATOM    582 2HB  ALA A  37       1.549  -5.279  -3.433  1.00  6.120          H  
ATOM    583 3HB  ALA A  37       1.391  -5.946  -5.055  1.00  6.120          H  
ATOM    584  N   ALA A  38      -1.039  -7.578  -5.807  1.00  3.780          N  
ATOM    585  CA  ALA A  38      -1.990  -7.931  -6.847  1.00  4.170          C  
ATOM    586  C   ALA A  38      -3.281  -8.517  -6.256  1.00  4.110          C  
ATOM    587  O   ALA A  38      -4.375  -8.106  -6.635  1.00  4.620          O  
ATOM    588  CB  ALA A  38      -1.367  -8.924  -7.808  1.00  5.680          C  
ATOM    589  H   ALA A  38      -0.144  -8.074  -5.773  1.00  4.540          H  
ATOM    590  HA  ALA A  38      -2.246  -7.023  -7.391  1.00  5.000          H  
ATOM    591 1HB  ALA A  38      -2.075  -9.161  -8.598  1.00  6.820          H  
ATOM    592 2HB  ALA A  38      -0.468  -8.494  -8.239  1.00  6.820          H  
ATOM    593 3HB  ALA A  38      -1.106  -9.833  -7.269  1.00  6.820          H  
ATOM    594  N   GLU A  39      -3.176  -9.415  -5.257  1.00  3.930          N  
ATOM    595  CA  GLU A  39      -4.375 -10.021  -4.648  1.00  4.380          C  
ATOM    596  C   GLU A  39      -5.271  -8.982  -4.006  1.00  4.490          C  
ATOM    597  O   GLU A  39      -6.498  -9.077  -4.054  1.00  4.810          O  
ATOM    598  CB  GLU A  39      -4.039 -11.072  -3.578  1.00  5.950          C  
ATOM    599  CG  GLU A  39      -3.504 -12.408  -4.075  1.00  5.950          C  
ATOM    600  CD  GLU A  39      -3.214 -13.367  -2.919  1.00  5.950          C  
ATOM    601  OE1 GLU A  39      -3.092 -12.895  -1.815  1.00  5.950          O  
ATOM    602  OE2 GLU A  39      -3.157 -14.571  -3.138  1.00  5.950          O  
ATOM    603  H   GLU A  39      -2.244  -9.734  -4.971  1.00  4.720          H  
ATOM    604  HA  GLU A  39      -4.942 -10.512  -5.437  1.00  5.260          H  
ATOM    605 1HB  GLU A  39      -3.282 -10.655  -2.908  1.00  7.140          H  
ATOM    606 2HB  GLU A  39      -4.925 -11.269  -2.978  1.00  7.140          H  
ATOM    607 1HG  GLU A  39      -4.233 -12.862  -4.744  1.00  7.140          H  
ATOM    608 2HG  GLU A  39      -2.590 -12.231  -4.642  1.00  7.140          H  
ATOM    609  N   LEU A  40      -4.648  -7.962  -3.441  1.00  4.580          N  
ATOM    610  CA  LEU A  40      -5.348  -6.884  -2.776  1.00  5.090          C  
ATOM    611  C   LEU A  40      -5.833  -5.807  -3.749  1.00  5.140          C  
ATOM    612  O   LEU A  40      -6.375  -4.781  -3.319  1.00  5.650          O  
ATOM    613  CB  LEU A  40      -4.421  -6.253  -1.735  1.00  6.920          C  
ATOM    614  CG  LEU A  40      -3.972  -7.126  -0.549  1.00  6.920          C  
ATOM    615  CD1 LEU A  40      -2.928  -6.343   0.234  1.00  6.920          C  
ATOM    616  CD2 LEU A  40      -5.164  -7.477   0.346  1.00  6.920          C  
ATOM    617  H   LEU A  40      -3.621  -7.991  -3.405  1.00  5.500          H  
ATOM    618  HA  LEU A  40      -6.224  -7.299  -2.289  1.00  6.110          H  
ATOM    619 1HB  LEU A  40      -3.518  -5.952  -2.250  1.00  8.310          H  
ATOM    620 2HB  LEU A  40      -4.903  -5.379  -1.327  1.00  8.310          H  
ATOM    621  HG  LEU A  40      -3.513  -8.046  -0.915  1.00  8.310          H  
ATOM    622 1HD1 LEU A  40      -2.579  -6.941   1.075  1.00  8.310          H  
ATOM    623 2HD1 LEU A  40      -2.083  -6.112  -0.421  1.00  8.310          H  
ATOM    624 3HD1 LEU A  40      -3.367  -5.417   0.603  1.00  8.310          H  
ATOM    625 1HD2 LEU A  40      -4.815  -8.080   1.184  1.00  8.310          H  
ATOM    626 2HD2 LEU A  40      -5.620  -6.561   0.723  1.00  8.310          H  
ATOM    627 3HD2 LEU A  40      -5.901  -8.045  -0.212  1.00  8.310          H  
ATOM    628  N   ASN A  41      -5.608  -6.006  -5.057  1.00  4.970          N  
ATOM    629  CA  ASN A  41      -6.015  -5.068  -6.092  1.00  5.340          C  
ATOM    630  C   ASN A  41      -5.512  -3.658  -5.833  1.00  5.150          C  
ATOM    631  O   ASN A  41      -6.264  -2.690  -5.977  1.00  5.530          O  
ATOM    632  CB  ASN A  41      -7.527  -5.067  -6.246  1.00  7.330          C  
ATOM    633  CG  ASN A  41      -8.069  -6.389  -6.713  1.00  7.330          C  
ATOM    634  OD1 ASN A  41      -7.511  -7.036  -7.610  1.00  7.330          O  
ATOM    635  ND2 ASN A  41      -9.165  -6.804  -6.124  1.00  7.330          N  
ATOM    636  H   ASN A  41      -5.155  -6.866  -5.375  1.00  5.960          H  
ATOM    637  HA  ASN A  41      -5.570  -5.399  -7.032  1.00  6.410          H  
ATOM    638 1HB  ASN A  41      -7.997  -4.809  -5.299  1.00  8.790          H  
ATOM    639 2HB  ASN A  41      -7.815  -4.304  -6.968  1.00  8.790          H  
ATOM    640 1HD2 ASN A  41      -9.576  -7.677  -6.391  1.00  8.790          H  
ATOM    641 2HD2 ASN A  41      -9.587  -6.252  -5.406  1.00  8.790          H  
ATOM    642  N   ARG A  42      -4.252  -3.526  -5.436  1.00  4.970          N  
ATOM    643  CA  ARG A  42      -3.731  -2.201  -5.164  1.00  5.240          C  
ATOM    644  C   ARG A  42      -3.531  -1.419  -6.463  1.00  5.300          C  
ATOM    645  O   ARG A  42      -3.037  -1.961  -7.454  1.00  5.420          O  
ATOM    646  CB  ARG A  42      -2.413  -2.305  -4.416  1.00  7.230          C  
ATOM    647  CG  ARG A  42      -2.468  -3.039  -3.066  1.00  7.230          C  
ATOM    648  CD  ARG A  42      -3.257  -2.327  -2.010  1.00  7.230          C  
ATOM    649  NE  ARG A  42      -4.676  -2.715  -1.996  1.00  7.230          N  
ATOM    650  CZ  ARG A  42      -5.648  -2.150  -1.262  1.00  7.230          C  
ATOM    651  NH1 ARG A  42      -5.414  -1.129  -0.456  1.00  7.230          N  
ATOM    652  NH2 ARG A  42      -6.852  -2.666  -1.373  1.00  7.230          N  
ATOM    653  H   ARG A  42      -3.654  -4.354  -5.330  1.00  5.960          H  
ATOM    654  HA  ARG A  42      -4.450  -1.664  -4.550  1.00  6.290          H  
ATOM    655 1HB  ARG A  42      -1.682  -2.822  -5.039  1.00  8.670          H  
ATOM    656 2HB  ARG A  42      -2.030  -1.308  -4.229  1.00  8.670          H  
ATOM    657 1HG  ARG A  42      -2.931  -4.001  -3.229  1.00  8.670          H  
ATOM    658 2HG  ARG A  42      -1.451  -3.190  -2.696  1.00  8.670          H  
ATOM    659 1HD  ARG A  42      -2.832  -2.566  -1.036  1.00  8.670          H  
ATOM    660 2HD  ARG A  42      -3.196  -1.255  -2.183  1.00  8.670          H  
ATOM    661  HE  ARG A  42      -4.991  -3.504  -2.585  1.00  8.670          H  
ATOM    662 1HH1 ARG A  42      -4.487  -0.745  -0.377  1.00  8.670          H  
ATOM    663 2HH1 ARG A  42      -6.168  -0.729   0.084  1.00  8.670          H  
ATOM    664 1HH2 ARG A  42      -6.970  -3.472  -2.014  1.00  8.670          H  
ATOM    665 2HH2 ARG A  42      -7.629  -2.293  -0.852  1.00  8.670          H  
ATOM    666  N   GLN A  43      -3.879  -0.121  -6.440  1.00  5.600          N  
ATOM    667  CA  GLN A  43      -3.698   0.775  -7.591  1.00  6.010          C  
ATOM    668  C   GLN A  43      -2.239   0.906  -8.004  1.00  5.680          C  
ATOM    669  O   GLN A  43      -1.918   1.001  -9.189  1.00  6.020          O  
ATOM    670  CB  GLN A  43      -4.243   2.170  -7.283  1.00  8.250          C  
ATOM    671  CG  GLN A  43      -4.163   3.134  -8.458  1.00  8.250          C  
ATOM    672  CD  GLN A  43      -4.751   4.476  -8.136  1.00  8.250          C  
ATOM    673  OE1 GLN A  43      -4.603   4.976  -7.013  1.00  8.250          O  
ATOM    674  NE2 GLN A  43      -5.421   5.077  -9.107  1.00  8.250          N  
ATOM    675  H   GLN A  43      -4.300   0.244  -5.598  1.00  6.720          H  
ATOM    676  HA  GLN A  43      -4.250   0.361  -8.433  1.00  7.210          H  
ATOM    677 1HB  GLN A  43      -5.285   2.096  -6.975  1.00  9.900          H  
ATOM    678 2HB  GLN A  43      -3.681   2.605  -6.455  1.00  9.900          H  
ATOM    679 1HG  GLN A  43      -3.117   3.288  -8.730  1.00  9.900          H  
ATOM    680 2HG  GLN A  43      -4.707   2.710  -9.302  1.00  9.900          H  
ATOM    681 1HE2 GLN A  43      -5.839   5.975  -8.951  1.00  9.900          H  
ATOM    682 2HE2 GLN A  43      -5.514   4.635 -10.001  1.00  9.900          H  
ATOM    683  N   CYS A  44      -1.369   0.924  -7.011  1.00  5.320          N  
ATOM    684  CA  CYS A  44       0.062   1.060  -7.191  1.00  5.230          C  
ATOM    685  C   CYS A  44       0.707   0.248  -6.089  1.00  5.140          C  
ATOM    686  O   CYS A  44       0.018  -0.155  -5.152  1.00  5.350          O  
ATOM    687  CB  CYS A  44       0.461   2.535  -7.174  1.00  7.360          C  
ATOM    688  SG  CYS A  44       0.096   3.408  -5.653  1.00  7.360          S  
ATOM    689  H   CYS A  44      -1.719   0.860  -6.067  1.00  6.380          H  
ATOM    690  HA  CYS A  44       0.347   0.644  -8.148  1.00  6.280          H  
ATOM    691 1HB  CYS A  44       1.521   2.610  -7.345  1.00  8.830          H  
ATOM    692 2HB  CYS A  44      -0.036   3.053  -7.998  1.00  8.830          H  
ATOM    693  HG  CYS A  44       0.952   2.733  -4.886  1.00  8.830          H  
ATOM    694  N   TRP A  45       2.009   0.005  -6.161  1.00  5.270          N  
ATOM    695  CA  TRP A  45       2.590  -0.896  -5.153  1.00  5.600          C  
ATOM    696  C   TRP A  45       4.081  -0.749  -4.811  1.00  5.800          C  
ATOM    697  O   TRP A  45       4.857  -0.111  -5.533  1.00  6.130          O  
ATOM    698  CB  TRP A  45       2.303  -2.338  -5.642  1.00  7.710          C  
ATOM    699  CG  TRP A  45       2.872  -2.685  -7.063  1.00  7.710          C  
ATOM    700  CD1 TRP A  45       3.716  -1.937  -7.800  1.00  7.710          C  
ATOM    701  CD2 TRP A  45       2.604  -3.857  -7.885  1.00  7.710          C  
ATOM    702  NE1 TRP A  45       4.003  -2.545  -8.969  1.00  7.710          N  
ATOM    703  CE2 TRP A  45       3.348  -3.714  -9.040  1.00  7.710          C  
ATOM    704  CE3 TRP A  45       1.815  -4.985  -7.736  1.00  7.710          C  
ATOM    705  CZ2 TRP A  45       3.344  -4.661 -10.032  1.00  7.710          C  
ATOM    706  CZ3 TRP A  45       1.812  -5.938  -8.723  1.00  7.710          C  
ATOM    707  CH2 TRP A  45       2.565  -5.781  -9.845  1.00  7.710          C  
ATOM    708  H   TRP A  45       2.549   0.400  -6.936  1.00  6.320          H  
ATOM    709  HA  TRP A  45       2.037  -0.747  -4.226  1.00  6.720          H  
ATOM    710 1HB  TRP A  45       2.725  -3.049  -4.925  1.00  9.250          H  
ATOM    711 2HB  TRP A  45       1.227  -2.498  -5.663  1.00  9.250          H  
ATOM    712  HD1 TRP A  45       4.110  -1.000  -7.519  1.00  9.250          H  
ATOM    713  HE1 TRP A  45       4.621  -2.173  -9.706  1.00  9.250          H  
ATOM    714  HE3 TRP A  45       1.216  -5.111  -6.890  1.00  9.250          H  
ATOM    715  HZ2 TRP A  45       3.927  -4.545 -10.934  1.00  9.250          H  
ATOM    716  HZ3 TRP A  45       1.191  -6.819  -8.582  1.00  9.250          H  
ATOM    717  HH2 TRP A  45       2.541  -6.551 -10.613  1.00  9.250          H  
ATOM    718  N   VAL A  46       4.498  -1.383  -3.711  1.00  5.960          N  
ATOM    719  CA  VAL A  46       5.922  -1.359  -3.362  1.00  6.490          C  
ATOM    720  C   VAL A  46       6.454  -2.763  -3.437  1.00  6.410          C  
ATOM    721  O   VAL A  46       5.934  -3.675  -2.804  1.00  6.780          O  
ATOM    722  CB  VAL A  46       6.191  -0.781  -1.956  1.00  8.870          C  
ATOM    723  CG1 VAL A  46       7.700  -0.801  -1.656  1.00  8.870          C  
ATOM    724  CG2 VAL A  46       5.653   0.608  -1.886  1.00  8.870          C  
ATOM    725  H   VAL A  46       3.821  -1.915  -3.132  1.00  7.150          H  
ATOM    726  HA  VAL A  46       6.464  -0.754  -4.086  1.00  7.790          H  
ATOM    727  HB  VAL A  46       5.709  -1.408  -1.201  1.00 10.650          H  
ATOM    728 1HG1 VAL A  46       7.871  -0.402  -0.654  1.00 10.650          H  
ATOM    729 2HG1 VAL A  46       8.078  -1.827  -1.689  1.00 10.650          H  
ATOM    730 3HG1 VAL A  46       8.240  -0.204  -2.383  1.00 10.650          H  
ATOM    731 1HG2 VAL A  46       5.826   1.018  -0.921  1.00 10.650          H  
ATOM    732 2HG2 VAL A  46       6.125   1.224  -2.630  1.00 10.650          H  
ATOM    733 3HG2 VAL A  46       4.622   0.561  -2.063  1.00 10.650          H  
ATOM    734  N   LEU A  47       7.464  -2.949  -4.257  1.00  6.240          N  
ATOM    735  CA  LEU A  47       8.008  -4.267  -4.449  1.00  6.420          C  
ATOM    736  C   LEU A  47       9.387  -4.343  -3.843  1.00  6.330          C  
ATOM    737  O   LEU A  47      10.375  -3.895  -4.441  1.00  6.410          O  
ATOM    738  CB  LEU A  47       8.028  -4.577  -5.948  1.00  8.920          C  
ATOM    739  CG  LEU A  47       6.675  -4.435  -6.679  1.00  8.920          C  
ATOM    740  CD1 LEU A  47       6.870  -4.838  -8.109  1.00  8.920          C  
ATOM    741  CD2 LEU A  47       5.618  -5.261  -6.016  1.00  8.920          C  
ATOM    742  H   LEU A  47       7.893  -2.141  -4.712  1.00  7.490          H  
ATOM    743  HA  LEU A  47       7.391  -4.996  -3.928  1.00  7.700          H  
ATOM    744 1HB  LEU A  47       8.727  -3.885  -6.422  1.00 10.700          H  
ATOM    745 2HB  LEU A  47       8.388  -5.562  -6.113  1.00 10.700          H  
ATOM    746  HG  LEU A  47       6.360  -3.386  -6.673  1.00 10.700          H  
ATOM    747 1HD1 LEU A  47       5.943  -4.722  -8.643  1.00 10.700          H  
ATOM    748 2HD1 LEU A  47       7.621  -4.216  -8.550  1.00 10.700          H  
ATOM    749 3HD1 LEU A  47       7.183  -5.870  -8.158  1.00 10.700          H  
ATOM    750 1HD2 LEU A  47       4.696  -5.151  -6.558  1.00 10.700          H  
ATOM    751 2HD2 LEU A  47       5.936  -6.279  -6.029  1.00 10.700          H  
ATOM    752 3HD2 LEU A  47       5.450  -4.955  -4.993  1.00 10.700          H  
ATOM    753  N   GLY A  48       9.490  -4.936  -2.664  1.00  6.450          N  
ATOM    754  CA  GLY A  48      10.796  -4.898  -2.022  1.00  6.570          C  
ATOM    755  C   GLY A  48      11.175  -3.431  -1.779  1.00  6.130          C  
ATOM    756  O   GLY A  48      10.501  -2.733  -1.025  1.00  6.310          O  
ATOM    757  H   GLY A  48       8.656  -5.359  -2.227  1.00  7.740          H  
ATOM    758 1HA  GLY A  48      10.761  -5.442  -1.080  1.00  7.880          H  
ATOM    759 2HA  GLY A  48      11.537  -5.381  -2.658  1.00  7.880          H  
ATOM    760  N   HIS A  49      12.283  -2.983  -2.377  1.00  5.920          N  
ATOM    761  CA  HIS A  49      12.761  -1.603  -2.213  1.00  6.000          C  
ATOM    762  C   HIS A  49      12.472  -0.676  -3.408  1.00  5.560          C  
ATOM    763  O   HIS A  49      12.963   0.455  -3.445  1.00  5.600          O  
ATOM    764  CB  HIS A  49      14.271  -1.597  -1.963  1.00  8.370          C  
ATOM    765  CG  HIS A  49      14.673  -2.241  -0.687  1.00  8.370          C  
ATOM    766  ND1 HIS A  49      15.986  -2.525  -0.381  1.00  8.370          N  
ATOM    767  CD2 HIS A  49      13.944  -2.642   0.371  1.00  8.370          C  
ATOM    768  CE1 HIS A  49      16.044  -3.082   0.813  1.00  8.370          C  
ATOM    769  NE2 HIS A  49      14.815  -3.163   1.293  1.00  8.370          N  
ATOM    770  H   HIS A  49      12.792  -3.624  -2.968  1.00  7.100          H  
ATOM    771  HA  HIS A  49      12.273  -1.160  -1.346  1.00  7.200          H  
ATOM    772 1HB  HIS A  49      14.774  -2.113  -2.782  1.00 10.040          H  
ATOM    773 2HB  HIS A  49      14.633  -0.571  -1.952  1.00 10.040          H  
ATOM    774  HD1 HIS A  49      16.790  -2.247  -0.910  1.00 10.040          H  
ATOM    775  HD2 HIS A  49      12.879  -2.614   0.584  1.00 10.040          H  
ATOM    776  HE1 HIS A  49      17.000  -3.385   1.239  1.00 10.040          H  
ATOM    777  N   TRP A  50      11.686  -1.137  -4.378  1.00  5.600          N  
ATOM    778  CA  TRP A  50      11.382  -0.338  -5.567  1.00  5.660          C  
ATOM    779  C   TRP A  50       9.908   0.085  -5.552  1.00  5.650          C  
ATOM    780  O   TRP A  50       9.039  -0.693  -5.149  1.00  6.130          O  
ATOM    781  CB  TRP A  50      11.669  -1.173  -6.807  1.00  7.900          C  
ATOM    782  CG  TRP A  50      13.102  -1.531  -7.035  1.00  7.900          C  
ATOM    783  CD1 TRP A  50      13.831  -2.451  -6.349  1.00  7.900          C  
ATOM    784  CD2 TRP A  50      13.963  -1.050  -8.095  1.00  7.900          C  
ATOM    785  NE1 TRP A  50      15.087  -2.560  -6.889  1.00  7.900          N  
ATOM    786  CE2 TRP A  50      15.178  -1.722  -7.967  1.00  7.900          C  
ATOM    787  CE3 TRP A  50      13.791  -0.139  -9.147  1.00  7.900          C  
ATOM    788  CZ2 TRP A  50      16.223  -1.513  -8.845  1.00  7.900          C  
ATOM    789  CZ3 TRP A  50      14.834   0.061 -10.026  1.00  7.900          C  
ATOM    790  CH2 TRP A  50      16.019  -0.607  -9.881  1.00  7.900          C  
ATOM    791  H   TRP A  50      11.295  -2.081  -4.297  1.00  6.720          H  
ATOM    792  HA  TRP A  50      12.010   0.552  -5.571  1.00  6.790          H  
ATOM    793 1HB  TRP A  50      11.078  -2.094  -6.784  1.00  9.480          H  
ATOM    794 2HB  TRP A  50      11.375  -0.611  -7.662  1.00  9.480          H  
ATOM    795  HD1 TRP A  50      13.468  -3.022  -5.499  1.00  9.480          H  
ATOM    796  HE1 TRP A  50      15.821  -3.175  -6.564  1.00  9.480          H  
ATOM    797  HE3 TRP A  50      12.858   0.393  -9.279  1.00  9.480          H  
ATOM    798  HZ2 TRP A  50      17.172  -2.040  -8.752  1.00  9.480          H  
ATOM    799  HZ3 TRP A  50      14.688   0.763 -10.850  1.00  9.480          H  
ATOM    800  HH2 TRP A  50      16.817  -0.426 -10.598  1.00  9.480          H  
ATOM    801  N   VAL A  51       9.588   1.288  -6.044  1.00  5.520          N  
ATOM    802  CA  VAL A  51       8.181   1.694  -5.990  1.00  5.990          C  
ATOM    803  C   VAL A  51       7.512   1.878  -7.347  1.00  6.140          C  
ATOM    804  O   VAL A  51       7.865   2.744  -8.155  1.00  6.640          O  
ATOM    805  CB  VAL A  51       8.059   2.977  -5.174  1.00  8.200          C  
ATOM    806  CG1 VAL A  51       6.563   3.409  -5.098  1.00  8.200          C  
ATOM    807  CG2 VAL A  51       8.701   2.713  -3.790  1.00  8.200          C  
ATOM    808  H   VAL A  51      10.301   1.909  -6.409  1.00  6.620          H  
ATOM    809  HA  VAL A  51       7.622   0.924  -5.460  1.00  7.190          H  
ATOM    810  HB  VAL A  51       8.592   3.778  -5.680  1.00  9.840          H  
ATOM    811 1HG1 VAL A  51       6.455   4.321  -4.557  1.00  9.840          H  
ATOM    812 2HG1 VAL A  51       6.171   3.564  -6.085  1.00  9.840          H  
ATOM    813 3HG1 VAL A  51       5.984   2.626  -4.610  1.00  9.840          H  
ATOM    814 1HG2 VAL A  51       8.672   3.568  -3.175  1.00  9.840          H  
ATOM    815 2HG2 VAL A  51       8.175   1.913  -3.308  1.00  9.840          H  
ATOM    816 3HG2 VAL A  51       9.743   2.431  -3.910  1.00  9.840          H  
ATOM    817  N   GLY A  52       6.498   1.062  -7.563  1.00  6.100          N  
ATOM    818  CA  GLY A  52       5.719   1.001  -8.784  1.00  6.690          C  
ATOM    819  C   GLY A  52       4.556   1.956  -8.724  1.00  6.740          C  
ATOM    820  O   GLY A  52       3.398   1.530  -8.620  1.00  6.970          O  
ATOM    821  H   GLY A  52       6.217   0.443  -6.800  1.00  7.320          H  
ATOM    822 1HA  GLY A  52       6.351   1.269  -9.628  1.00  8.030          H  
ATOM    823 2HA  GLY A  52       5.385  -0.011  -8.970  1.00  8.030          H  
ATOM    824  N   THR A  53       4.841   3.252  -8.822  1.00  6.920          N  
ATOM    825  CA  THR A  53       3.782   4.268  -8.713  1.00  7.390          C  
ATOM    826  C   THR A  53       2.755   4.133  -9.839  1.00  7.350          C  
ATOM    827  O   THR A  53       1.626   4.609  -9.721  1.00  7.490          O  
ATOM    828  CB  THR A  53       4.344   5.705  -8.737  1.00 10.160          C  
ATOM    829  OG1 THR A  53       5.053   5.933  -9.967  1.00 10.160          O  
ATOM    830  CG2 THR A  53       5.272   5.911  -7.576  1.00 10.160          C  
ATOM    831  H   THR A  53       5.834   3.506  -8.904  1.00  8.300          H  
ATOM    832  HA  THR A  53       3.271   4.130  -7.761  1.00  8.870          H  
ATOM    833  HB  THR A  53       3.521   6.417  -8.662  1.00 12.190          H  
ATOM    834  HG1 THR A  53       4.425   6.093 -10.680  1.00 12.190          H  
ATOM    835 1HG2 THR A  53       5.657   6.931  -7.594  1.00 12.190          H  
ATOM    836 2HG2 THR A  53       4.733   5.744  -6.643  1.00 12.190          H  
ATOM    837 3HG2 THR A  53       6.103   5.221  -7.646  1.00 12.190          H  
ATOM    838  N   GLY A  54       3.153   3.485 -10.935  1.00  7.500          N  
ATOM    839  CA  GLY A  54       2.281   3.255 -12.083  1.00  7.870          C  
ATOM    840  C   GLY A  54       1.533   1.908 -12.055  1.00  7.590          C  
ATOM    841  O   GLY A  54       0.832   1.581 -13.013  1.00  8.120          O  
ATOM    842  H   GLY A  54       4.105   3.149 -10.951  1.00  9.000          H  
ATOM    843 1HA  GLY A  54       1.553   4.065 -12.142  1.00  9.440          H  
ATOM    844 2HA  GLY A  54       2.877   3.312 -12.993  1.00  9.440          H  
ATOM    845  N   GLY A  55       1.718   1.092 -11.002  1.00  7.050          N  
ATOM    846  CA  GLY A  55       1.071  -0.233 -10.914  1.00  7.090          C  
ATOM    847  C   GLY A  55       1.823  -1.305 -11.698  1.00  6.590          C  
ATOM    848  O   GLY A  55       1.370  -2.442 -11.841  1.00  6.840          O  
ATOM    849  H   GLY A  55       2.304   1.393 -10.219  1.00  8.460          H  
ATOM    850 1HA  GLY A  55       1.018  -0.542  -9.872  1.00  8.510          H  
ATOM    851 2HA  GLY A  55       0.044  -0.159 -11.271  1.00  8.510          H  
ATOM    852  N   LEU A  56       2.958  -0.912 -12.234  1.00  6.230          N  
ATOM    853  CA  LEU A  56       3.826  -1.745 -13.034  1.00  6.150          C  
ATOM    854  C   LEU A  56       5.033  -2.124 -12.214  1.00  5.470          C  
ATOM    855  O   LEU A  56       5.313  -1.488 -11.196  1.00  5.500          O  
ATOM    856  CB  LEU A  56       4.266  -0.976 -14.278  1.00  8.640          C  
ATOM    857  CG  LEU A  56       3.121  -0.411 -15.161  1.00  8.640          C  
ATOM    858  CD1 LEU A  56       3.731   0.393 -16.283  1.00  8.640          C  
ATOM    859  CD2 LEU A  56       2.249  -1.542 -15.702  1.00  8.640          C  
ATOM    860  H   LEU A  56       3.215   0.048 -12.073  1.00  7.480          H  
ATOM    861  HA  LEU A  56       3.305  -2.661 -13.309  1.00  7.380          H  
ATOM    862 1HB  LEU A  56       4.885  -0.140 -13.960  1.00 10.370          H  
ATOM    863 2HB  LEU A  56       4.878  -1.633 -14.896  1.00 10.370          H  
ATOM    864  HG  LEU A  56       2.500   0.260 -14.566  1.00 10.370          H  
ATOM    865 1HD1 LEU A  56       2.936   0.814 -16.901  1.00 10.370          H  
ATOM    866 2HD1 LEU A  56       4.331   1.202 -15.870  1.00 10.370          H  
ATOM    867 3HD1 LEU A  56       4.361  -0.251 -16.895  1.00 10.370          H  
ATOM    868 1HD2 LEU A  56       1.454  -1.118 -16.315  1.00 10.370          H  
ATOM    869 2HD2 LEU A  56       2.851  -2.218 -16.305  1.00 10.370          H  
ATOM    870 3HD2 LEU A  56       1.797  -2.095 -14.879  1.00 10.370          H  
ATOM    871  N   VAL A  57       5.750  -3.158 -12.622  1.00  5.250          N  
ATOM    872  CA  VAL A  57       6.980  -3.464 -11.920  1.00  4.960          C  
ATOM    873  C   VAL A  57       7.954  -2.365 -12.363  1.00  4.950          C  
ATOM    874  O   VAL A  57       8.077  -2.143 -13.565  1.00  5.340          O  
ATOM    875  CB  VAL A  57       7.507  -4.866 -12.296  1.00  7.060          C  
ATOM    876  CG1 VAL A  57       8.875  -5.135 -11.631  1.00  7.060          C  
ATOM    877  CG2 VAL A  57       6.489  -5.918 -11.852  1.00  7.060          C  
ATOM    878  H   VAL A  57       5.470  -3.681 -13.440  1.00  6.300          H  
ATOM    879  HA  VAL A  57       6.787  -3.461 -10.859  1.00  5.950          H  
ATOM    880  HB  VAL A  57       7.650  -4.918 -13.374  1.00  8.470          H  
ATOM    881 1HG1 VAL A  57       9.237  -6.120 -11.919  1.00  8.470          H  
ATOM    882 2HG1 VAL A  57       9.604  -4.387 -11.962  1.00  8.470          H  
ATOM    883 3HG1 VAL A  57       8.789  -5.094 -10.552  1.00  8.470          H  
ATOM    884 1HG2 VAL A  57       6.849  -6.902 -12.130  1.00  8.470          H  
ATOM    885 2HG2 VAL A  57       6.354  -5.873 -10.779  1.00  8.470          H  
ATOM    886 3HG2 VAL A  57       5.535  -5.736 -12.342  1.00  8.470          H  
ATOM    887  N   PRO A  58       8.625  -1.641 -11.452  1.00  5.010          N  
ATOM    888  CA  PRO A  58       9.542  -0.558 -11.755  1.00  5.450          C  
ATOM    889  C   PRO A  58      10.614  -1.001 -12.720  1.00  5.550          C  
ATOM    890  O   PRO A  58      11.130  -2.110 -12.602  1.00  5.580          O  
ATOM    891  CB  PRO A  58      10.130  -0.244 -10.379  1.00  8.180          C  
ATOM    892  CG  PRO A  58       9.042  -0.649  -9.434  1.00  8.180          C  
ATOM    893  CD  PRO A  58       8.440  -1.865 -10.016  1.00  8.180          C  
ATOM    894  HA  PRO A  58       8.977   0.296 -12.156  1.00  6.540          H  
ATOM    895 1HB  PRO A  58      11.061  -0.802 -10.245  1.00  9.810          H  
ATOM    896 2HB  PRO A  58      10.377   0.827 -10.312  1.00  9.810          H  
ATOM    897 1HG  PRO A  58       9.366  -0.803  -8.419  1.00  9.810          H  
ATOM    898 2HG  PRO A  58       8.341   0.160  -9.404  1.00  9.810          H  
ATOM    899 1HD  PRO A  58       8.978  -2.760  -9.685  1.00  9.810          H  
ATOM    900 2HD  PRO A  58       7.386  -1.843  -9.713  1.00  9.810          H  
ATOM    901  N   ARG A  59      10.966  -0.135 -13.658  1.00  6.010          N  
ATOM    902  CA  ARG A  59      11.975  -0.497 -14.632  1.00  6.510          C  
ATOM    903  C   ARG A  59      13.276  -0.835 -13.938  1.00  6.650          C  
ATOM    904  O   ARG A  59      13.784  -0.051 -13.140  1.00  7.030          O  
ATOM    905  CB  ARG A  59      12.205   0.647 -15.612  1.00  8.910          C  
ATOM    906  CG  ARG A  59      13.181   0.357 -16.747  1.00  8.910          C  
ATOM    907  CD  ARG A  59      13.266   1.497 -17.694  1.00  8.910          C  
ATOM    908  NE  ARG A  59      14.216   1.242 -18.773  1.00  8.910          N  
ATOM    909  CZ  ARG A  59      14.477   2.087 -19.798  1.00  8.910          C  
ATOM    910  NH1 ARG A  59      13.855   3.247 -19.885  1.00  8.910          N  
ATOM    911  NH2 ARG A  59      15.364   1.743 -20.719  1.00  8.910          N  
ATOM    912  H   ARG A  59      10.512   0.768 -13.709  1.00  7.210          H  
ATOM    913  HA  ARG A  59      11.628  -1.373 -15.184  1.00  7.810          H  
ATOM    914 1HB  ARG A  59      11.255   0.930 -16.062  1.00 10.700          H  
ATOM    915 2HB  ARG A  59      12.581   1.514 -15.070  1.00 10.700          H  
ATOM    916 1HG  ARG A  59      14.179   0.190 -16.339  1.00 10.700          H  
ATOM    917 2HG  ARG A  59      12.860  -0.526 -17.297  1.00 10.700          H  
ATOM    918 1HD  ARG A  59      12.282   1.671 -18.134  1.00 10.700          H  
ATOM    919 2HD  ARG A  59      13.589   2.386 -17.153  1.00 10.700          H  
ATOM    920  HE  ARG A  59      14.720   0.364 -18.753  1.00 10.700          H  
ATOM    921 1HH1 ARG A  59      13.179   3.516 -19.186  1.00 10.700          H  
ATOM    922 2HH1 ARG A  59      14.055   3.873 -20.652  1.00 10.700          H  
ATOM    923 1HH2 ARG A  59      15.843   0.855 -20.656  1.00 10.700          H  
ATOM    924 2HH2 ARG A  59      15.566   2.368 -21.487  1.00 10.700          H  
ATOM    925  N   GLY A  60      13.828  -1.997 -14.268  1.00  6.680          N  
ATOM    926  CA  GLY A  60      15.075  -2.472 -13.682  1.00  7.180          C  
ATOM    927  C   GLY A  60      14.856  -3.375 -12.466  1.00  6.860          C  
ATOM    928  O   GLY A  60      15.799  -4.019 -11.998  1.00  7.270          O  
ATOM    929  H   GLY A  60      13.350  -2.588 -14.934  1.00  8.020          H  
ATOM    930 1HA  GLY A  60      15.643  -3.012 -14.437  1.00  8.620          H  
ATOM    931 2HA  GLY A  60      15.679  -1.615 -13.386  1.00  8.620          H  
ATOM    932  N   SER A  61      13.624  -3.443 -11.964  1.00  6.450          N  
ATOM    933  CA  SER A  61      13.324  -4.271 -10.806  1.00  6.460          C  
ATOM    934  C   SER A  61      12.744  -5.603 -11.200  1.00  6.360          C  
ATOM    935  O   SER A  61      12.000  -5.723 -12.175  1.00  6.490          O  
ATOM    936  CB  SER A  61      12.291  -3.650  -9.906  1.00  9.040          C  
ATOM    937  OG  SER A  61      12.068  -4.470  -8.761  1.00  9.040          O  
ATOM    938  H   SER A  61      12.863  -2.898 -12.374  1.00  7.740          H  
ATOM    939  HA  SER A  61      14.244  -4.435 -10.243  1.00  7.750          H  
ATOM    940 1HB  SER A  61      12.597  -2.689  -9.626  1.00 10.850          H  
ATOM    941 2HB  SER A  61      11.363  -3.539 -10.453  1.00 10.850          H  
ATOM    942  HG  SER A  61      11.553  -5.271  -9.031  1.00 10.850          H  
ATOM    943  N   ALA A  62      13.054  -6.615 -10.420  1.00  6.550          N  
ATOM    944  CA  ALA A  62      12.389  -7.888 -10.584  1.00  6.870          C  
ATOM    945  C   ALA A  62      11.039  -7.745  -9.912  1.00  6.850          C  
ATOM    946  O   ALA A  62      10.877  -6.878  -9.047  1.00  7.030          O  
ATOM    947  CB  ALA A  62      13.184  -9.016  -9.962  1.00  9.490          C  
ATOM    948  H   ALA A  62      13.715  -6.472  -9.668  1.00  7.860          H  
ATOM    949  HA  ALA A  62      12.236  -8.080 -11.645  1.00  8.240          H  
ATOM    950 1HB  ALA A  62      12.639  -9.953 -10.085  1.00 11.390          H  
ATOM    951 2HB  ALA A  62      14.155  -9.093 -10.449  1.00 11.390          H  
ATOM    952 3HB  ALA A  62      13.322  -8.816  -8.901  1.00 11.390          H  
ATOM    953  N   ALA A  63      10.043  -8.525 -10.301  1.00  6.950          N  
ATOM    954  CA  ALA A  63       8.834  -8.476  -9.497  1.00  7.210          C  
ATOM    955  C   ALA A  63       9.207  -9.014  -8.122  1.00  7.530          C  
ATOM    956  O   ALA A  63       9.937 -10.003  -8.039  1.00  7.900          O  
ATOM    957  CB  ALA A  63       7.717  -9.290 -10.112  1.00  9.990          C  
ATOM    958  H   ALA A  63      10.147  -9.180 -11.062  1.00  8.340          H  
ATOM    959  HA  ALA A  63       8.518  -7.441  -9.396  1.00  8.650          H  
ATOM    960 1HB  ALA A  63       6.844  -9.239  -9.474  1.00 11.990          H  
ATOM    961 2HB  ALA A  63       7.476  -8.899 -11.094  1.00 11.990          H  
ATOM    962 3HB  ALA A  63       8.037 -10.326 -10.203  1.00 11.990          H  
ATOM    963  N   ALA A  64       8.673  -8.433  -7.059  1.00  7.700          N  
ATOM    964  CA  ALA A  64       8.964  -8.958  -5.729  1.00  8.310          C  
ATOM    965  C   ALA A  64       8.085 -10.162  -5.437  1.00  8.840          C  
ATOM    966  O   ALA A  64       8.298 -10.849  -4.440  1.00  9.330          O  
ATOM    967  OXT ALA A  64       6.966 -10.185  -5.937  1.00 12.460          O  
ATOM    968  CB  ALA A  64       8.774  -7.889  -4.673  1.00 10.850          C  
ATOM    969  H   ALA A  64       8.098  -7.616  -7.180  1.00  9.240          H  
ATOM    970  HA  ALA A  64      10.001  -9.292  -5.706  1.00  9.970          H  
ATOM    971 1HB  ALA A  64       9.007  -8.293  -3.688  1.00 13.020          H  
ATOM    972 2HB  ALA A  64       9.449  -7.074  -4.888  1.00 13.020          H  
ATOM    973 3HB  ALA A  64       7.753  -7.528  -4.682  1.00 13.020          H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -291.036 29.0918 220.814 -19.8732 6.40374 17.7225 103.478 -119.808 -0.5449 -3.6583 -96.7389 -22.1174 -21.2486 -5.93564 -16.3725 -10.8142 0 -0.68212 2.93331 29.1737 64.5013 -18.2281 8.93704 -10.2486 -14.3206 36.3856 -132.186
ASP:NtermProteinFull_1 -4.86239 0.30336 5.00254 -0.11778 0.00219 0.36649 2.18846 -2.10739 -0.03584 -0.11778 -3.52184 -0.91789 0 0 -1.12351 -0.43766 0 0.03567 0.30906 0 2.27102 0 0 -2.3716 0 0.46859 -4.66628
VAL_2 -6.64138 1.19276 0.27958 -0.28287 0.19602 0.05621 0.3137 -1.42264 -0.03584 -0.11778 -0.42943 0.22324 0 0 0 0 0 -0.08324 0.03932 0.13892 0 -0.40285 0 1.9342 -0.22239 0.77819 -4.48628
SER_3 -4.17331 0.27713 4.3085 -0.02656 0 0.02187 1.99418 -1.9979 -6e-05 -0.00041 -1.42011 -0.26269 0 0 0 -0.61404 0 0.07257 0.00169 0.43343 0 -0.04549 0.6146 -0.77834 -0.48429 0.3566 -1.72264
GLU_4 -2.31557 0.04484 3.40867 -0.45019 0.19458 1.40588 1.25919 -1.46786 -0.02029 -0.14471 -0.92312 -2.90833 0 0 -0.84404 0 0 -0.04512 0.00156 0 4.01271 -0.25804 0 -2.7348 -0.55014 0.40283 -1.93196
GLU_5 -4.99459 0.33905 5.87348 -0.48978 0.19506 1.55534 1.98725 -2.5676 -0.02503 -0.18764 -2.65441 -2.47018 0 0 0 0 0 -0.05064 0.00455 0 4.40076 -0.03859 0 -2.7348 -0.62057 0.56134 -1.91697
GLU_6 -3.68689 0.32688 4.36194 -0.45345 0.2088 1.41275 1.97697 -1.97381 -0.02973 -0.15152 -1.29855 -2.99249 0 0 0 0 0 -0.05237 0.02032 0 3.96872 -0.2626 0 -2.7348 -0.63605 0.31444 -1.68147
ASP_7 -4.93371 0.30655 5.56654 -0.11381 0.00878 0.34824 1.36498 -2.51074 -0.02973 -0.15152 -2.28815 -0.38617 0 0 0 0 0 0.00214 0.00677 0 1.71343 0.10604 0 -2.3716 -0.49847 0.24478 -3.61566
PHE_8 -9.23633 0.84849 4.41826 -0.57987 0.41093 0.29072 2.26157 -2.86294 -0 -0 -1.60192 -0.12174 0 0 -0.69803 0 0 0.16968 0.004 0 3.14925 0.06764 0 1.0402 -0.20754 0.53921 -2.10843
ARG_9 -8.435 0.79353 7.14449 -0.68141 0.10188 0.44117 3.3906 -3.46303 -0.00272 -0.03933 -3.22208 0.73338 0 0 -0.84404 -0.4977 0 0.0363 0.01717 3.03238 0 -0.11629 0 -1.2888 -0.05065 0.83227 -2.11787
LEU_10 -4.00451 0.33529 3.64191 -0.47854 0.23324 0.10649 1.65682 -1.83631 -0.01286 -0.11781 -1.64037 0.22053 0 0 0 0 0 0.04395 0.03909 0.38875 0 -0.27103 0 0.18072 -0.16127 0.59991 -1.076
ALA_11 -5.89511 0.67248 3.61806 -0.03087 0.01181 0 2.66796 -2.7167 -0 -0 -1.46959 -0.50798 0 0 0 0 0 0.00013 0 0 0 -0.10157 0 1.8394 0.03284 0.39355 -1.48559
CYS_12 -4.20472 0.41356 2.56187 -0.0699 0.00012 0.04366 1.00747 -1.36393 -0 -0 -0.71142 -0.40698 0 0 0 0 0 0.03529 0.00363 0.49775 0 0.18228 0 3.6196 -0.07376 0.43049 1.965
ARG_13 -3.65123 0.42254 3.75512 -0.8849 0.16367 0.69779 1.26141 -1.59429 -0.00812 -0.07488 -1.52265 0.03906 0 0 0 -0.9811 0 -0.06214 0.12576 2.19876 0 -0.10758 0 -1.2888 -0.4468 0.49834 -1.46005
HIS_D_14 -7.03337 0.69443 4.51023 -0.42668 0.18074 0.48601 2.15751 -2.63985 -0.02012 -0.12318 -2.02354 -0.42835 0 0 0 0 0 -0.05547 0.04699 0 2.73164 -0.31557 0 -0.45461 -0.36308 0.88095 -2.19531
GLU_15 -4.53157 0.31005 4.72028 -0.22624 0.04816 0.33877 1.95216 -2.0496 -0 -0 -1.95176 -0.58676 0 0 -0.72198 -0.9811 0 -0.0765 0.03422 0 3.08993 -0.32641 0 -2.7348 -0.48237 0.74611 -3.42942
ARG_16 -4.61443 0.31381 3.87612 -1.16365 0.34044 0.80453 0.69019 -1.76235 -0 -0 -1.29669 0.00798 0 0 0 0 0 0.17766 0.08443 2.68015 0 -0.12957 0 -1.2888 -0.53556 0.40286 -1.41287
TYR_17 -10.0784 1.64728 4.17209 -0.55779 0.5267 0.24317 2.70604 -2.97279 -0.02164 -0.13157 -1.5518 -0.20998 0 0 -0.69803 0 0 -0.01834 0.10585 0 3.89767 -0.14011 0.02579 1.2797 -0.11344 1.23545 -0.6542
PRO_18 -2.35686 0.5033 0.96574 -0.08769 0.00012 0.05462 0.3999 -0.44949 -0.00056 -0.0159 0.36621 0.68868 0 0 0 0 0 -0.13538 0.01013 0.57065 0 -0.44159 0 -2.4119 -0.14767 1.12895 -1.35873
THR_19 -5.05893 0.5977 4.39691 -0.13096 0.07444 0.09497 1.89124 -2.07194 -0.0187 -0.158 -1.88424 -0.89801 0 0 0 -0.40799 0 -0.03901 0.00174 0.11792 0 -0.13192 2.28724 -1.0874 0.1859 0.77225 -1.46681
ARG_20 -6.01832 0.27698 5.88227 -0.78205 0.13304 0.5497 2.94962 -2.52985 -0 -0 -3.01645 0.16492 0 0 -0.72198 -1.22933 0 -0.05982 0.33495 2.578 0 -0.18737 0 -1.2888 0.27784 1.06326 -1.62341
HIS_D_21 -3.64748 0.29857 3.13143 -0.42264 0.02138 0.5553 0.796 -1.40396 -0 -0 -1.2283 -0.30841 0 0 0 -1.22933 0 -0.04901 0.04154 0 1.55504 -0.37784 0 -0.45461 -0.36554 0.57973 -2.50813
GLN_22 -3.0054 0.61284 3.09344 -0.28292 0.05705 0.25267 1.11948 -1.41938 -0.00191 -0.02839 -1.0117 -0.82931 0 0 0 0 0 0.24536 0.05888 0 2.85709 0.04158 0 -0.18838 0.56501 0.83865 2.97469
PRO_23 -2.88892 0.44652 1.96961 -0.18581 0.0024 0.13396 0.56349 -0.81975 -0 -0 -0.58834 0.0306 0 0 0 0 0 -0.07461 0.00758 1.10045 0 -0.97856 0 -2.4119 0.36467 0.84974 -2.47886
HIS_D_24 -3.5424 0.21404 5.40461 -0.43415 0.01115 0.28061 2.4491 -2.28498 -0.04508 -0.3172 -4.11379 -0.32207 0 0 -1.489 0 0 0.0176 0.19578 0 3.03418 -0.05959 0 -0.45461 -0.44911 0.37298 -1.53194
MET_25 -1.94958 0.23207 2.55067 -0.35036 0.09699 0.08777 0.95049 -1.15029 -0 -0 -0.41459 0.21181 0 0 -0.91462 0 0 -0.0707 0.0255 1.32285 0 0.3083 0 0.60916 -0.26621 0.29908 1.57834
GLY_26 -1.34423 0.07859 1.79289 -7e-05 0 0 0.529 -0.85952 -0 -0 0.65831 -0.36782 0 0 0 0 0 -0.14528 0 0 0 -1.52246 0 0.83697 -0.60591 0.24569 -0.70385
ASP_27 -3.48476 0.05727 5.60358 -0.10387 0.00281 0.31291 2.26182 -2.30526 -0.00134 -0.01249 -3.98301 -0.31522 0 0 -0.57438 -0.40799 0 -0.04122 0.00069 0 1.86684 -0.13117 0 -2.3716 -0.50158 0.42785 -3.70011
SER_28 -1.83592 0.05702 1.9657 -0.02644 0 0.02136 0.39009 -0.94364 -0.02638 -0.1592 -0.11068 -0.20965 0 0 0 0 0 -0.02276 0.00039 0.56608 0 -0.1383 0.60472 -0.77834 -0.4261 0.33409 -0.73798
TRP_29 -8.96267 1.68235 2.37429 -0.73347 0.27686 0.41266 2.52216 -2.31904 -0.00153 -0.00839 -1.04188 -0.07564 0 0 0 -0.61404 0 0.05136 0.00026 0 3.3321 -0.35069 0 1.6906 -0.03857 0.85041 -0.95287
PRO_30 -2.89083 0.4743 2.42613 -0.11945 0.0014 0.08847 1.20899 -1.0206 -0 -0 -0.37231 0.26651 0 0 0 0 0 0.0061 0.03474 0.1628 0 -1.19642 0 -2.4119 -0.0229 1.12429 -2.24066
ARG_31 -2.9815 0.09601 2.50094 -0.66319 0.12185 0.48168 1.09645 -1.19177 -0 -0 -1.23821 -0.16222 0 0 0 -0.88283 0 0.00315 0.03587 1.96349 0 -0.10804 0 -1.2888 0.31706 0.78266 -1.1174
SER_32 -3.86736 0.1561 5.12917 -0.02255 0 0.01891 2.31005 -2.24064 -0 -0 -3.8848 -0.08436 0 0 0 -0.43766 0 0.06415 0.00019 1.00494 0 -0.31293 0.60571 -0.77834 0.26963 0.65565 -1.41414
SER_33 -5.04961 0.36083 5.64991 -0.02805 0 0.06685 2.73879 -2.67484 -0.01979 -0.12871 -3.18703 -0.5098 0 0 -1.4108 0 0 -0.01743 0.03894 0.34834 0 -0.22479 0.68658 -0.77834 -0.39854 0.35693 -4.18055
ALA_34 -5.08194 0.48798 2.44777 -0.02256 0 0 2.7085 -2.28092 -0 -0 -2.26859 -0.37965 0 0 0 0 0 -0.05388 0 0 0 -0.26701 0 1.8394 -0.36757 0.19522 -3.04326
HIS_35 -4.65688 0.40732 5.46089 -0.77619 0.05035 0.82915 2.34656 -2.58497 -0.01514 -0.05969 -1.93996 -0.32539 0 0 0 -0.35646 0 -0.00179 0.038 0 1.68572 -0.2513 0 -0.45461 -0.19069 0.25563 -0.53946
GLU_36 -5.50325 0.27166 6.90197 -0.22236 0.05883 0.34578 2.99755 -3.07215 -0.03345 -0.27182 -2.46725 -0.60729 0 0 -1.4108 0 0 0.00648 0.2654 0 3.13542 -0.1161 0 -2.7348 -0.06262 0.2971 -2.22169
ALA_37 -5.58546 0.49768 4.18302 -0.02193 0 0 2.44048 -2.60531 -0 -0 -2.28355 -0.38258 0 0 0 0 0 0.14104 0 0 0 -0.25215 0 1.8394 -0.43138 0.37882 -2.08191
ALA_38 -3.92817 0.3042 4.05637 -0.02071 0 0 2.38103 -2.36366 -0 -0 -1.91788 -0.32509 0 0 0 0 0 -0.00907 0 0 0 -0.04969 0 1.8394 -0.31409 0.45972 0.11237
GLU_39 -4.09034 0.33824 5.14641 -0.21108 0.01876 0.27187 1.87553 -2.28381 -0.01366 -0.14311 -1.90469 -0.53221 0 0 0 -0.35646 0 -0.05082 0.10921 0 3.09691 -0.33662 0 -2.7348 -0.39174 0.42901 -1.76339
LEU_40 -5.11833 0.42306 4.91825 -0.51978 0.21623 0.15409 1.89455 -2.31446 -0 -0 -2.12339 0.12442 0 0 -0.8527 0 0 -0.07841 0.03412 0.07111 0 -0.0835 0 0.18072 -0.56572 0.42469 -3.21505
ASN_41 -2.89607 0.21312 3.89771 -0.19358 0.0392 0.33029 1.52385 -1.86535 -0 -0 -1.42341 -1.02354 0 0 0 0 0 -0.08153 0.00188 0 1.93855 -1.03772 0 -0.93687 -0.71497 0.25824 -1.9702
ARG_42 -5.26548 0.34115 5.30152 -1.14245 0.17069 0.82487 2.14076 -2.30499 -0 -0 -1.69728 0.27353 0 0 -0.8527 0 0 -0.02713 0.10803 4.08608 0 -0.12722 0 -1.2888 -0.69764 0.3846 0.22753
GLN_43 -2.07541 0.0412 2.29505 -0.40455 0.11498 0.25853 0.9633 -1.00867 -0 -0 -0.55697 -0.70009 0 0 0 -0.4977 0 -0.05446 0.00125 0 3.67769 -0.19701 0 -0.18838 -0.37372 0.36366 1.65868
CYS_44 -5.57103 0.54401 2.63499 -0.08403 0 0.05397 0.64992 -1.41401 -0 -0 -0.6029 -0.2497 0 0 0 0 0 0.41588 0.06368 0.30917 0 -0.31231 0 3.6196 -0.23576 0.43304 0.25451
TRP_45 -10.9155 1.01221 3.60924 -1.0052 0.6898 0.91582 2.91585 -3.36072 -0.01801 -0.10299 -2.99899 -0.53933 0 0 -0.38692 0 0 -0.00611 0.07133 0 3.91614 -0.47583 0 1.6906 0.06898 1.11668 -3.80299
VAL_46 -7.6694 0.99298 2.81095 -0.27538 0.16638 0.05806 2.07457 -2.49234 -0.00011 -0.0003 -1.19442 -0.28949 0 0 -1.12351 0 0 -0.03093 0.01178 0.1992 0 -0.72856 0 1.9342 -0.06412 1.07338 -4.54704
LEU_47 -8.82018 1.1221 2.06294 -0.52534 0.30277 0.1414 2.40804 -2.67149 -0.0167 -0.17127 -2.28838 0.00104 0 0 0 0 0 -0.04344 0.30164 1.08219 0 -0.15633 0 0.18072 0.04596 0.68665 -6.35766
GLY_48 -3.01467 0.13572 2.83078 -0.00019 0 0 1.20599 -1.58306 -0.00011 -0.0003 -0.69999 -0.33353 0 0 0 0 0 -0.32063 0 0 0 -1.32381 0 0.83697 0.35114 0.5156 -1.40009
HIS_D_49 -2.73451 0.14241 2.26607 -0.42046 0.11311 0.48562 0.93768 -1.20093 -0 -0 -0.82974 -0.52659 0 0 0 -0.88283 0 -0.05718 0.00239 0 3.20253 -0.32002 0 -0.45461 -0.21391 0.27353 -0.21745
TRP_50 -6.86141 0.73826 4.50562 -0.71344 0.10902 0.34096 2.37888 -2.54318 -0.00608 -0.0178 -2.19548 -0.22955 0 0 0 0 0 0.10696 0.00631 0 1.96793 -0.26181 0 1.6906 -0.19979 0.51451 -0.66949
VAL_51 -5.68666 0.98731 0.16612 -0.28293 0.28641 0.06425 0.80019 -1.20462 -0.0153 -0.16499 -0.49872 -0.36264 0 0 0 0 0 -0.03703 0.04066 0.17314 0 -0.66232 0 1.9342 -0.02544 0.85832 -3.63007
GLY_52 -4.46725 0.66943 4.25506 -0.00016 0 0 2.55921 -2.28722 -0.00608 -0.0178 -2.98571 -0.41002 0 0 0 0 0 -0.04755 0 0 0 0.66809 0 0.83697 0.74951 0.58238 0.09887
THR_53 -3.6555 0.27314 1.98112 -0.12442 0.04858 0.0613 0.96171 -1.3004 -0.01796 -0.20391 -0.24637 -0.67338 0 0 0 0 0 -0.04451 1e-05 0.2149 0 0.22539 2.29174 -1.0874 0.85222 0.27367 -0.17008
GLY_54 -1.73248 0.40685 1.7421 -6e-05 0 0 0.5567 -0.91957 -0 -0 0.40426 -0.37232 0 0 0 0 0 -0.13606 0 0 0 0.38879 0 0.83697 -0.04861 0.30731 1.43387
GLY_55 -3.04225 0.15977 2.56752 -5e-05 0 0 0.89127 -1.46672 -0.01559 -0.09498 -0.90041 -0.40119 0 0 0 0 0 -0.1945 0 0 0 -1.43099 0 0.83697 -0.56487 0.29142 -3.36459
LEU_56 -3.7455 0.28754 3.18053 -0.47449 0.21443 0.089 1.09972 -1.69311 -0 -0 -1.29772 0.21978 0 0 -0.38692 0 0 0.04572 0.03954 0.40231 0 -0.25793 0 0.18072 -0.57787 0.33419 -2.34006
VAL_57 -4.86615 0.58021 0.59953 -0.27045 0.11381 0.05396 0.46969 -1.30961 -0 -0 -0.08761 0.07793 0 0 0 0 0 -0.07669 0.00085 0.05445 0 -0.38741 0 1.9342 -0.27457 1.20433 -2.18353
PRO_58 -5.99886 1.02955 3.79853 -0.12593 0.0035 0.09123 1.63759 -1.61239 -0 -0 -1.55064 0.25237 0 0 0 0 0 -0.1013 0.00308 0.11256 0 -1.01456 0 -2.4119 -0.60113 1.28137 -5.20692
ARG_59 -1.48462 0.13712 1.61225 -0.50948 0.0596 0.27499 0.67274 -0.79422 -0 -0 0.2129 0.5716 0 0 0 0 0 -0.08956 0.00253 2.00306 0 0.04337 0 -1.2888 -0.5578 0.3153 1.18096
GLY_60 -1.47076 0.04483 1.20073 -7e-05 0 0 0.25109 -0.70491 -0 -0 -0.04515 -0.38261 0 0 0 0 0 -0.17008 0 0 0 -1.51178 0 0.83697 -0.65409 0.09096 -2.51487
SER_61 -4.69421 0.46683 3.85713 -0.03403 0.00373 0.04575 1.88493 -1.91285 -0.01428 -0.16326 -2.00137 -0.41872 0 0 -0.65929 0 0 0.319 0.2 1.3599 0 0.07547 1.82067 -0.77834 -0.38966 0.45458 -0.57802
ALA_62 -1.87549 0.08957 1.68359 -0.02181 0 0 0.74794 -1.01736 -0 -0 -1.22506 -0.18658 0 0 -0.65929 0 0 0.18104 0 0 0 -0.0602 0 1.8394 -0.14906 0.87622 0.22292
ALA_63 -2.22653 0.15579 0.03876 -0.02458 0.00012 0 0.05797 -0.68934 -0 -0 0.28578 -0.25978 0 0 0 0 0 -0.04763 0 0 0 -0.03549 0 1.8394 -0.63214 0.69169 -0.84597
ALA:CtermProteinFull_64 -4.12465 0.40406 2.74456 -0.03755 0.00081 0 2.03149 -1.95097 -0.01514 -0.05969 -2.83199 -0.03144 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.4339 0.39568 -2.06933
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 142574 DOMAINID 138915 MODEL 4 2021-10-23_00000171_1_11
MODEL     4
REMARK    Rerank model05.pdb to model04.pdb score: 15.024
REMARK    S_0000_0001
REMARK    SCORE     hbond_bb_sc:         -14.759
REMARK    SCORE         fa_elec:         -97.886
REMARK    SCORE            time:           0.000
REMARK    SCORE     hbond_sr_bb:         -25.209
REMARK    SCORE           omega:          -0.064
REMARK    SCORE     lk_ball_wtd:         -10.941
REMARK    SCORE           score:        -127.842
REMARK    SCORE     rama_prepro:          -6.304
REMARK    SCORE        hbond_sc:          -9.897
REMARK    SCORE fa_intra_sol_xover4:          14.875
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE     cart_bonded:          38.681
REMARK    SCORE    fa_intra_rep:           0.537
REMARK    SCORE          fa_sol:         209.556
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE     total_score:        -127.842
REMARK    SCORE         p_aa_pp:         -20.430
REMARK    SCORE             ref:          13.118
REMARK    SCORE          fa_dun:          77.547
REMARK    SCORE          fa_rep:          35.251
REMARK    SCORE          fa_atr:        -321.978
REMARK    SCORE     hbond_lr_bb:          -9.939
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE     description: best_scoring0001_0001_0001
REMARK    SCORE       dslf_fa13:           0.000
ATOM      1  N   ASP A   1       0.129  -0.456  -0.960  1.00  8.82           N  
ATOM      2  CA  ASP A   1       1.516  -0.254  -0.561  1.00  8.57           C  
ATOM      3  C   ASP A   1       1.932   1.200  -0.477  1.00  7.85           C  
ATOM      4  O   ASP A   1       2.988   1.501   0.084  1.00  7.86           O  
ATOM      5  CB  ASP A   1       2.488  -0.949  -1.519  1.00 12.10           C  
ATOM      6  CG  ASP A   1       2.323  -2.434  -1.529  1.00 12.10           C  
ATOM      7  OD1 ASP A   1       1.547  -2.907  -0.739  1.00 12.10           O  
ATOM      8  OD2 ASP A   1       3.010  -3.098  -2.281  1.00 12.10           O  
ATOM      9 1H   ASP A   1       0.085  -1.302  -1.512  1.00 10.58           H  
ATOM     10 2H   ASP A   1      -0.418  -0.596  -0.123  1.00 10.58           H  
ATOM     11 3H   ASP A   1      -0.268   0.327  -1.486  1.00 10.58           H  
ATOM     12  HA  ASP A   1       1.644  -0.692   0.429  1.00 10.28           H  
ATOM     13 1HB  ASP A   1       2.333  -0.568  -2.530  1.00 14.52           H  
ATOM     14 2HB  ASP A   1       3.513  -0.710  -1.232  1.00 14.52           H  
ATOM     15  N   VAL A   2       1.141   2.097  -1.050  1.00  7.52           N  
ATOM     16  CA  VAL A   2       1.487   3.516  -1.025  1.00  7.11           C  
ATOM     17  C   VAL A   2       0.818   4.163   0.201  1.00  6.70           C  
ATOM     18  O   VAL A   2      -0.353   3.895   0.465  1.00  6.77           O  
ATOM     19  CB  VAL A   2       1.036   4.190  -2.348  1.00 10.12           C  
ATOM     20  CG1 VAL A   2       1.349   5.592  -2.336  1.00 10.12           C  
ATOM     21  CG2 VAL A   2       1.679   3.510  -3.523  1.00 10.12           C  
ATOM     22  H   VAL A   2       0.266   1.830  -1.508  1.00  9.02           H  
ATOM     23  HA  VAL A   2       2.570   3.624  -0.927  1.00  8.53           H  
ATOM     24  HB  VAL A   2      -0.019   4.128  -2.436  1.00 12.14           H  
ATOM     25 1HG1 VAL A   2       1.011   6.045  -3.246  1.00 12.14           H  
ATOM     26 2HG1 VAL A   2       0.859   6.051  -1.505  1.00 12.14           H  
ATOM     27 3HG1 VAL A   2       2.421   5.704  -2.249  1.00 12.14           H  
ATOM     28 1HG2 VAL A   2       1.339   3.992  -4.437  1.00 12.14           H  
ATOM     29 2HG2 VAL A   2       2.762   3.593  -3.444  1.00 12.14           H  
ATOM     30 3HG2 VAL A   2       1.395   2.461  -3.537  1.00 12.14           H  
ATOM     31  N   SER A   3       1.553   4.959   0.984  1.00  6.61           N  
ATOM     32  CA  SER A   3       0.953   5.599   2.159  1.00  6.55           C  
ATOM     33  C   SER A   3      -0.043   6.652   1.714  1.00  6.12           C  
ATOM     34  O   SER A   3       0.006   7.113   0.573  1.00  6.20           O  
ATOM     35  CB  SER A   3       2.013   6.263   2.998  1.00  9.20           C  
ATOM     36  OG  SER A   3       2.552   7.350   2.304  1.00  9.20           O  
ATOM     37  H   SER A   3       2.540   5.150   0.765  1.00  7.93           H  
ATOM     38  HA  SER A   3       0.431   4.845   2.751  1.00  7.86           H  
ATOM     39 1HB  SER A   3       1.573   6.603   3.933  1.00 11.04           H  
ATOM     40 2HB  SER A   3       2.801   5.551   3.236  1.00 11.04           H  
ATOM     41  HG  SER A   3       3.206   6.943   1.689  1.00 11.04           H  
ATOM     42  N   GLU A   4      -0.917   7.115   2.606  1.00  6.04           N  
ATOM     43  CA  GLU A   4      -1.895   8.102   2.166  1.00  6.06           C  
ATOM     44  C   GLU A   4      -1.255   9.364   1.611  1.00  5.75           C  
ATOM     45  O   GLU A   4      -1.692   9.864   0.573  1.00  5.82           O  
ATOM     46  CB  GLU A   4      -2.819   8.461   3.329  1.00  8.48           C  
ATOM     47  CG  GLU A   4      -3.725   7.312   3.784  1.00  8.48           C  
ATOM     48  CD  GLU A   4      -3.017   6.311   4.681  1.00  8.48           C  
ATOM     49  OE1 GLU A   4      -1.856   6.526   4.981  1.00  8.48           O  
ATOM     50  OE2 GLU A   4      -3.621   5.338   5.048  1.00  8.48           O  
ATOM     51  H   GLU A   4      -0.947   6.751   3.562  1.00  7.25           H  
ATOM     52  HA  GLU A   4      -2.496   7.652   1.375  1.00  7.27           H  
ATOM     53 1HB  GLU A   4      -2.226   8.791   4.179  1.00 10.18           H  
ATOM     54 2HB  GLU A   4      -3.457   9.292   3.036  1.00 10.18           H  
ATOM     55 1HG  GLU A   4      -4.576   7.728   4.321  1.00 10.18           H  
ATOM     56 2HG  GLU A   4      -4.103   6.797   2.901  1.00 10.18           H  
ATOM     57  N   GLU A   5      -0.194   9.869   2.242  1.00  5.81           N  
ATOM     58  CA  GLU A   5       0.392  11.082   1.702  1.00  5.92           C  
ATOM     59  C   GLU A   5       1.016  10.831   0.344  1.00  5.46           C  
ATOM     60  O   GLU A   5       0.876  11.651  -0.566  1.00  5.55           O  
ATOM     61  CB  GLU A   5       1.460  11.661   2.610  1.00  8.24           C  
ATOM     62  CG  GLU A   5       0.988  12.222   3.921  1.00  8.24           C  
ATOM     63  CD  GLU A   5       2.132  12.849   4.706  1.00  8.24           C  
ATOM     64  OE1 GLU A   5       3.220  12.992   4.155  1.00  8.24           O  
ATOM     65  OE2 GLU A   5       1.923  13.180   5.848  1.00  8.24           O  
ATOM     66  H   GLU A   5       0.155   9.441   3.088  1.00  6.97           H  
ATOM     67  HA  GLU A   5      -0.402  11.821   1.579  1.00  7.10           H  
ATOM     68 1HB  GLU A   5       2.219  10.903   2.810  1.00  9.89           H  
ATOM     69 2HB  GLU A   5       1.935  12.465   2.091  1.00  9.89           H  
ATOM     70 1HG  GLU A   5       0.227  12.978   3.730  1.00  9.89           H  
ATOM     71 2HG  GLU A   5       0.535  11.425   4.508  1.00  9.89           H  
ATOM     72  N   GLU A   6       1.694   9.688   0.191  1.00  5.36           N  
ATOM     73  CA  GLU A   6       2.319   9.367  -1.081  1.00  5.35           C  
ATOM     74  C   GLU A   6       1.279   9.195  -2.177  1.00  4.95           C  
ATOM     75  O   GLU A   6       1.501   9.632  -3.301  1.00  5.18           O  
ATOM     76  CB  GLU A   6       3.158   8.111  -0.960  1.00  7.49           C  
ATOM     77  CG  GLU A   6       4.435   8.239  -0.181  1.00  7.49           C  
ATOM     78  CD  GLU A   6       5.043   6.897   0.084  1.00  7.49           C  
ATOM     79  OE1 GLU A   6       4.310   6.029   0.543  1.00  7.49           O  
ATOM     80  OE2 GLU A   6       6.208   6.721  -0.162  1.00  7.49           O  
ATOM     81  H   GLU A   6       1.800   9.046   0.980  1.00  6.43           H  
ATOM     82  HA  GLU A   6       2.973  10.190  -1.358  1.00  6.42           H  
ATOM     83 1HB  GLU A   6       2.568   7.350  -0.470  1.00  8.99           H  
ATOM     84 2HB  GLU A   6       3.416   7.759  -1.955  1.00  8.99           H  
ATOM     85 1HG  GLU A   6       5.138   8.843  -0.752  1.00  8.99           H  
ATOM     86 2HG  GLU A   6       4.234   8.748   0.759  1.00  8.99           H  
ATOM     87  N   ASP A   7       0.143   8.585  -1.837  1.00  4.80           N  
ATOM     88  CA  ASP A   7      -0.959   8.320  -2.753  1.00  4.92           C  
ATOM     89  C   ASP A   7      -1.474   9.654  -3.265  1.00  4.55           C  
ATOM     90  O   ASP A   7      -1.631   9.859  -4.475  1.00  4.59           O  
ATOM     91  CB  ASP A   7      -2.038   7.469  -2.030  1.00  6.84           C  
ATOM     92  CG  ASP A   7      -3.227   6.947  -2.894  1.00  6.84           C  
ATOM     93  OD1 ASP A   7      -3.353   7.362  -4.017  1.00  6.84           O  
ATOM     94  OD2 ASP A   7      -3.969   6.078  -2.425  1.00  6.84           O  
ATOM     95  H   ASP A   7       0.066   8.239  -0.877  1.00  5.76           H  
ATOM     96  HA  ASP A   7      -0.587   7.753  -3.602  1.00  5.90           H  
ATOM     97 1HB  ASP A   7      -1.553   6.607  -1.567  1.00  8.21           H  
ATOM     98 2HB  ASP A   7      -2.453   8.062  -1.214  1.00  8.21           H  
ATOM     99  N   PHE A   8      -1.728  10.578  -2.340  1.00  4.61           N  
ATOM    100  CA  PHE A   8      -2.233  11.881  -2.712  1.00  4.74           C  
ATOM    101  C   PHE A   8      -1.207  12.587  -3.604  1.00  4.66           C  
ATOM    102  O   PHE A   8      -1.570  13.177  -4.626  1.00  4.86           O  
ATOM    103  CB  PHE A   8      -2.496  12.701  -1.451  1.00  6.58           C  
ATOM    104  CG  PHE A   8      -3.528  12.074  -0.491  1.00  6.58           C  
ATOM    105  CD1 PHE A   8      -4.383  11.019  -0.870  1.00  6.58           C  
ATOM    106  CD2 PHE A   8      -3.616  12.534   0.821  1.00  6.58           C  
ATOM    107  CE1 PHE A   8      -5.261  10.470   0.028  1.00  6.58           C  
ATOM    108  CE2 PHE A   8      -4.505  11.975   1.711  1.00  6.58           C  
ATOM    109  CZ  PHE A   8      -5.325  10.944   1.314  1.00  6.58           C  
ATOM    110  H   PHE A   8      -1.600  10.343  -1.350  1.00  5.53           H  
ATOM    111  HA  PHE A   8      -3.143  11.759  -3.288  1.00  5.69           H  
ATOM    112 1HB  PHE A   8      -1.558  12.811  -0.903  1.00  7.90           H  
ATOM    113 2HB  PHE A   8      -2.834  13.695  -1.721  1.00  7.90           H  
ATOM    114  HD1 PHE A   8      -4.352  10.609  -1.873  1.00  7.90           H  
ATOM    115  HD2 PHE A   8      -2.962  13.343   1.147  1.00  7.90           H  
ATOM    116  HE1 PHE A   8      -5.900   9.650  -0.280  1.00  7.90           H  
ATOM    117  HE2 PHE A   8      -4.556  12.344   2.735  1.00  7.90           H  
ATOM    118  HZ  PHE A   8      -6.021  10.501   2.024  1.00  7.90           H  
ATOM    119  N   ARG A   9       0.086  12.511  -3.242  1.00  4.74           N  
ATOM    120  CA  ARG A   9       1.123  13.131  -4.057  1.00  5.15           C  
ATOM    121  C   ARG A   9       1.209  12.516  -5.453  1.00  4.87           C  
ATOM    122  O   ARG A   9       1.384  13.255  -6.427  1.00  5.20           O  
ATOM    123  CB  ARG A   9       2.489  13.082  -3.375  1.00  7.04           C  
ATOM    124  CG  ARG A   9       2.661  14.068  -2.198  1.00  7.04           C  
ATOM    125  CD  ARG A   9       4.100  14.201  -1.763  1.00  7.04           C  
ATOM    126  NE  ARG A   9       4.623  12.996  -1.091  1.00  7.04           N  
ATOM    127  CZ  ARG A   9       4.574  12.752   0.252  1.00  7.04           C  
ATOM    128  NH1 ARG A   9       4.040  13.630   1.086  1.00  7.04           N  
ATOM    129  NH2 ARG A   9       5.078  11.629   0.729  1.00  7.04           N  
ATOM    130  H   ARG A   9       0.347  12.038  -2.372  1.00  5.69           H  
ATOM    131  HA  ARG A   9       0.866  14.182  -4.170  1.00  6.18           H  
ATOM    132 1HB  ARG A   9       2.655  12.081  -2.986  1.00  8.45           H  
ATOM    133 2HB  ARG A   9       3.270  13.285  -4.106  1.00  8.45           H  
ATOM    134 1HG  ARG A   9       2.303  15.051  -2.501  1.00  8.45           H  
ATOM    135 2HG  ARG A   9       2.078  13.721  -1.349  1.00  8.45           H  
ATOM    136 1HD  ARG A   9       4.713  14.381  -2.648  1.00  8.45           H  
ATOM    137 2HD  ARG A   9       4.201  15.049  -1.092  1.00  8.45           H  
ATOM    138  HE  ARG A   9       5.052  12.290  -1.676  1.00  8.45           H  
ATOM    139 1HH1 ARG A   9       3.654  14.491   0.739  1.00  8.45           H  
ATOM    140 2HH1 ARG A   9       4.014  13.439   2.109  1.00  8.45           H  
ATOM    141 1HH2 ARG A   9       5.494  10.954   0.103  1.00  8.45           H  
ATOM    142 2HH2 ARG A   9       5.052  11.441   1.723  1.00  8.45           H  
ATOM    143  N   LEU A  10       1.081  11.185  -5.576  1.00  4.61           N  
ATOM    144  CA  LEU A  10       1.141  10.566  -6.893  1.00  4.76           C  
ATOM    145  C   LEU A  10      -0.002  11.083  -7.744  1.00  4.57           C  
ATOM    146  O   LEU A  10       0.179  11.401  -8.925  1.00  4.86           O  
ATOM    147  CB  LEU A  10       1.001   9.030  -6.810  1.00  6.61           C  
ATOM    148  CG  LEU A  10       2.158   8.194  -6.190  1.00  6.61           C  
ATOM    149  CD1 LEU A  10       1.694   6.780  -6.040  1.00  6.61           C  
ATOM    150  CD2 LEU A  10       3.349   8.221  -7.060  1.00  6.61           C  
ATOM    151  H   LEU A  10       1.000  10.607  -4.739  1.00  5.53           H  
ATOM    152  HA  LEU A  10       2.079  10.841  -7.362  1.00  5.71           H  
ATOM    153 1HB  LEU A  10       0.111   8.818  -6.218  1.00  7.93           H  
ATOM    154 2HB  LEU A  10       0.830   8.649  -7.822  1.00  7.93           H  
ATOM    155  HG  LEU A  10       2.415   8.580  -5.222  1.00  7.93           H  
ATOM    156 1HD1 LEU A  10       2.484   6.175  -5.601  1.00  7.93           H  
ATOM    157 2HD1 LEU A  10       0.830   6.764  -5.403  1.00  7.93           H  
ATOM    158 3HD1 LEU A  10       1.440   6.387  -7.022  1.00  7.93           H  
ATOM    159 1HD2 LEU A  10       4.136   7.616  -6.619  1.00  7.93           H  
ATOM    160 2HD2 LEU A  10       3.092   7.815  -8.041  1.00  7.93           H  
ATOM    161 3HD2 LEU A  10       3.710   9.237  -7.165  1.00  7.93           H  
ATOM    162  N   ALA A  11      -1.200  11.209  -7.159  1.00  4.49           N  
ATOM    163  CA  ALA A  11      -2.301  11.731  -7.945  1.00  4.73           C  
ATOM    164  C   ALA A  11      -2.010  13.172  -8.374  1.00  4.68           C  
ATOM    165  O   ALA A  11      -2.139  13.518  -9.546  1.00  4.86           O  
ATOM    166  CB  ALA A  11      -3.591  11.664  -7.150  1.00  6.52           C  
ATOM    167  H   ALA A  11      -1.341  10.889  -6.189  1.00  5.39           H  
ATOM    168  HA  ALA A  11      -2.400  11.117  -8.840  1.00  5.68           H  
ATOM    169 1HB  ALA A  11      -4.420  12.027  -7.734  1.00  7.82           H  
ATOM    170 2HB  ALA A  11      -3.783  10.628  -6.865  1.00  7.82           H  
ATOM    171 3HB  ALA A  11      -3.483  12.267  -6.254  1.00  7.82           H  
ATOM    172  N   CYS A  12      -1.506  13.999  -7.457  1.00  4.87           N  
ATOM    173  CA  CYS A  12      -1.249  15.396  -7.786  1.00  5.34           C  
ATOM    174  C   CYS A  12      -0.192  15.597  -8.854  1.00  5.39           C  
ATOM    175  O   CYS A  12      -0.301  16.497  -9.689  1.00  5.91           O  
ATOM    176  CB  CYS A  12      -0.852  16.190  -6.547  1.00  7.29           C  
ATOM    177  SG  CYS A  12      -2.204  16.456  -5.397  1.00  7.29           S  
ATOM    178  H   CYS A  12      -1.379  13.675  -6.493  1.00  5.84           H  
ATOM    179  HA  CYS A  12      -2.169  15.805  -8.155  1.00  6.41           H  
ATOM    180 1HB  CYS A  12      -0.054  15.666  -6.022  1.00  8.75           H  
ATOM    181 2HB  CYS A  12      -0.472  17.162  -6.851  1.00  8.75           H  
ATOM    182  HG  CYS A  12      -3.009  17.049  -6.326  1.00  8.75           H  
ATOM    183  N   ARG A  13       0.831  14.760  -8.833  1.00  5.17           N  
ATOM    184  CA  ARG A  13       1.925  14.838  -9.781  1.00  5.56           C  
ATOM    185  C   ARG A  13       1.716  13.990 -11.033  1.00  5.24           C  
ATOM    186  O   ARG A  13       2.620  13.902 -11.866  1.00  5.57           O  
ATOM    187  CB  ARG A  13       3.207  14.373  -9.134  1.00  7.63           C  
ATOM    188  CG  ARG A  13       3.748  15.195  -7.997  1.00  7.63           C  
ATOM    189  CD  ARG A  13       4.996  14.571  -7.552  1.00  7.63           C  
ATOM    190  NE  ARG A  13       5.635  15.232  -6.449  1.00  7.63           N  
ATOM    191  CZ  ARG A  13       6.820  14.835  -5.937  1.00  7.63           C  
ATOM    192  NH1 ARG A  13       7.454  13.789  -6.464  1.00  7.63           N  
ATOM    193  NH2 ARG A  13       7.350  15.491  -4.913  1.00  7.63           N  
ATOM    194  H   ARG A  13       0.879  14.071  -8.076  1.00  6.20           H  
ATOM    195  HA  ARG A  13       2.037  15.878 -10.084  1.00  6.67           H  
ATOM    196 1HB  ARG A  13       3.044  13.367  -8.739  1.00  9.16           H  
ATOM    197 2HB  ARG A  13       3.991  14.305  -9.884  1.00  9.16           H  
ATOM    198 1HG  ARG A  13       3.950  16.212  -8.326  1.00  9.16           H  
ATOM    199 2HG  ARG A  13       3.039  15.201  -7.169  1.00  9.16           H  
ATOM    200 1HD  ARG A  13       4.781  13.542  -7.256  1.00  9.16           H  
ATOM    201 2HD  ARG A  13       5.687  14.572  -8.390  1.00  9.16           H  
ATOM    202  HE  ARG A  13       5.174  16.030  -6.037  1.00  9.16           H  
ATOM    203 1HH1 ARG A  13       7.050  13.270  -7.274  1.00  9.16           H  
ATOM    204 2HH1 ARG A  13       8.338  13.489  -6.086  1.00  9.16           H  
ATOM    205 1HH2 ARG A  13       6.869  16.288  -4.518  1.00  9.16           H  
ATOM    206 2HH2 ARG A  13       8.238  15.201  -4.529  1.00  9.16           H  
ATOM    207  N   HIS A  14       0.563  13.328 -11.152  1.00  4.95           N  
ATOM    208  CA  HIS A  14       0.263  12.437 -12.268  1.00  4.98           C  
ATOM    209  C   HIS A  14       1.316  11.304 -12.388  1.00  4.90           C  
ATOM    210  O   HIS A  14       1.747  10.964 -13.493  1.00  5.22           O  
ATOM    211  CB  HIS A  14       0.229  13.211 -13.606  1.00  6.96           C  
ATOM    212  CG  HIS A  14      -0.644  14.500 -13.683  1.00  6.96           C  
ATOM    213  ND1 HIS A  14      -0.846  15.152 -14.882  1.00  6.96           N  
ATOM    214  CD2 HIS A  14      -1.306  15.261 -12.739  1.00  6.96           C  
ATOM    215  CE1 HIS A  14      -1.586  16.235 -14.688  1.00  6.96           C  
ATOM    216  NE2 HIS A  14      -1.878  16.330 -13.409  1.00  6.96           N  
ATOM    217  H   HIS A  14      -0.176  13.467 -10.455  1.00  5.94           H  
ATOM    218  HA  HIS A  14      -0.706  11.970 -12.102  1.00  5.98           H  
ATOM    219 1HB  HIS A  14       1.243  13.480 -13.895  1.00  8.35           H  
ATOM    220 2HB  HIS A  14      -0.141  12.541 -14.378  1.00  8.35           H  
ATOM    221  HD2 HIS A  14      -1.377  15.085 -11.668  1.00  8.35           H  
ATOM    222  HE1 HIS A  14      -1.900  16.937 -15.461  1.00  8.35           H  
ATOM    223  HE2 HIS A  14      -2.444  17.106 -13.004  1.00  8.35           H  
ATOM    224  N   GLU A  15       1.737  10.728 -11.255  1.00  4.92           N  
ATOM    225  CA  GLU A  15       2.745   9.655 -11.223  1.00  5.31           C  
ATOM    226  C   GLU A  15       2.179   8.235 -11.083  1.00  5.32           C  
ATOM    227  O   GLU A  15       1.071   8.026 -10.594  1.00  5.78           O  
ATOM    228  CB  GLU A  15       3.760   9.907 -10.109  1.00  7.28           C  
ATOM    229  CG  GLU A  15       4.662  11.120 -10.299  1.00  7.28           C  
ATOM    230  CD  GLU A  15       5.629  11.338  -9.125  1.00  7.28           C  
ATOM    231  OE1 GLU A  15       5.652  10.517  -8.250  1.00  7.28           O  
ATOM    232  OE2 GLU A  15       6.314  12.339  -9.103  1.00  7.28           O  
ATOM    233  H   GLU A  15       1.319  11.047 -10.378  1.00  5.90           H  
ATOM    234  HA  GLU A  15       3.288   9.693 -12.167  1.00  6.37           H  
ATOM    235 1HB  GLU A  15       3.212  10.087  -9.210  1.00  8.74           H  
ATOM    236 2HB  GLU A  15       4.379   9.023  -9.957  1.00  8.74           H  
ATOM    237 1HG  GLU A  15       5.244  10.978 -11.208  1.00  8.74           H  
ATOM    238 2HG  GLU A  15       4.044  11.988 -10.445  1.00  8.74           H  
ATOM    239  N   ARG A  16       2.976   7.263 -11.538  1.00  5.16           N  
ATOM    240  CA  ARG A  16       2.677   5.824 -11.495  1.00  5.54           C  
ATOM    241  C   ARG A  16       2.563   5.183 -10.113  1.00  5.41           C  
ATOM    242  O   ARG A  16       3.386   5.429  -9.228  1.00  5.88           O  
ATOM    243  CB  ARG A  16       3.746   5.059 -12.255  1.00  7.61           C  
ATOM    244  CG  ARG A  16       3.728   5.266 -13.749  1.00  7.61           C  
ATOM    245  CD  ARG A  16       4.782   4.502 -14.438  1.00  7.61           C  
ATOM    246  NE  ARG A  16       4.700   4.703 -15.864  1.00  7.61           N  
ATOM    247  CZ  ARG A  16       5.525   4.173 -16.790  1.00  7.61           C  
ATOM    248  NH1 ARG A  16       6.537   3.396 -16.434  1.00  7.61           N  
ATOM    249  NH2 ARG A  16       5.304   4.441 -18.070  1.00  7.61           N  
ATOM    250  H   ARG A  16       3.860   7.549 -11.931  1.00  6.19           H  
ATOM    251  HA  ARG A  16       1.725   5.677 -12.009  1.00  6.65           H  
ATOM    252 1HB  ARG A  16       4.727   5.359 -11.893  1.00  9.13           H  
ATOM    253 2HB  ARG A  16       3.641   3.995 -12.053  1.00  9.13           H  
ATOM    254 1HG  ARG A  16       2.763   4.951 -14.152  1.00  9.13           H  
ATOM    255 2HG  ARG A  16       3.875   6.321 -13.977  1.00  9.13           H  
ATOM    256 1HD  ARG A  16       5.760   4.837 -14.094  1.00  9.13           H  
ATOM    257 2HD  ARG A  16       4.655   3.440 -14.229  1.00  9.13           H  
ATOM    258  HE  ARG A  16       3.941   5.320 -16.204  1.00  9.13           H  
ATOM    259 1HH1 ARG A  16       6.704   3.191 -15.461  1.00  9.13           H  
ATOM    260 2HH1 ARG A  16       7.146   3.004 -17.139  1.00  9.13           H  
ATOM    261 1HH2 ARG A  16       4.487   5.026 -18.335  1.00  9.13           H  
ATOM    262 2HH2 ARG A  16       5.898   4.058 -18.784  1.00  9.13           H  
ATOM    263  N   TYR A  17       1.605   4.262  -9.999  1.00  5.07           N  
ATOM    264  CA  TYR A  17       1.340   3.476  -8.802  1.00  5.20           C  
ATOM    265  C   TYR A  17       1.838   2.035  -8.955  1.00  5.22           C  
ATOM    266  O   TYR A  17       1.950   1.552 -10.081  1.00  5.22           O  
ATOM    267  CB  TYR A  17      -0.160   3.414  -8.546  1.00  7.22           C  
ATOM    268  CG  TYR A  17      -0.781   4.646  -8.043  1.00  7.22           C  
ATOM    269  CD1 TYR A  17      -1.112   5.689  -8.902  1.00  7.22           C  
ATOM    270  CD2 TYR A  17      -1.070   4.722  -6.701  1.00  7.22           C  
ATOM    271  CE1 TYR A  17      -1.716   6.815  -8.397  1.00  7.22           C  
ATOM    272  CE2 TYR A  17      -1.674   5.830  -6.201  1.00  7.22           C  
ATOM    273  CZ  TYR A  17      -1.999   6.881  -7.037  1.00  7.22           C  
ATOM    274  OH  TYR A  17      -2.600   7.996  -6.529  1.00  7.22           O  
ATOM    275  H   TYR A  17       1.005   4.091 -10.812  1.00  6.08           H  
ATOM    276  HA  TYR A  17       1.821   3.982  -7.978  1.00  6.24           H  
ATOM    277 1HB  TYR A  17      -0.643   3.172  -9.475  1.00  8.66           H  
ATOM    278 2HB  TYR A  17      -0.382   2.603  -7.848  1.00  8.66           H  
ATOM    279  HD1 TYR A  17      -0.889   5.624  -9.965  1.00  8.66           H  
ATOM    280  HD2 TYR A  17      -0.815   3.895  -6.038  1.00  8.66           H  
ATOM    281  HE1 TYR A  17      -1.973   7.645  -9.056  1.00  8.66           H  
ATOM    282  HE2 TYR A  17      -1.897   5.882  -5.141  1.00  8.66           H  
ATOM    283  HH  TYR A  17      -2.805   7.853  -5.565  1.00  8.66           H  
ATOM    284  N   PRO A  18       2.231   1.353  -7.862  1.00  5.66           N  
ATOM    285  CA  PRO A  18       2.497  -0.074  -7.809  1.00  6.03           C  
ATOM    286  C   PRO A  18       1.233  -0.831  -8.184  1.00  6.02           C  
ATOM    287  O   PRO A  18       0.144  -0.464  -7.734  1.00  6.21           O  
ATOM    288  CB  PRO A  18       2.859  -0.304  -6.333  1.00  9.06           C  
ATOM    289  CG  PRO A  18       3.343   1.035  -5.848  1.00  9.06           C  
ATOM    290  CD  PRO A  18       2.506   2.053  -6.602  1.00  9.06           C  
ATOM    291  HA  PRO A  18       3.328  -0.324  -8.486  1.00  7.24           H  
ATOM    292 1HB  PRO A  18       1.980  -0.664  -5.778  1.00 10.87           H  
ATOM    293 2HB  PRO A  18       3.629  -1.088  -6.252  1.00 10.87           H  
ATOM    294 1HG  PRO A  18       3.222   1.107  -4.755  1.00 10.87           H  
ATOM    295 2HG  PRO A  18       4.419   1.144  -6.052  1.00 10.87           H  
ATOM    296 1HD  PRO A  18       1.567   2.275  -6.085  1.00 10.87           H  
ATOM    297 2HD  PRO A  18       3.145   2.937  -6.747  1.00 10.87           H  
ATOM    298  N   THR A  19       1.377  -1.956  -8.873  1.00  6.15           N  
ATOM    299  CA  THR A  19       0.238  -2.784  -9.276  1.00  6.47           C  
ATOM    300  C   THR A  19      -0.428  -3.504  -8.109  1.00  6.42           C  
ATOM    301  O   THR A  19      -1.525  -4.053  -8.239  1.00  6.49           O  
ATOM    302  CB  THR A  19       0.674  -3.788 -10.347  1.00  8.93           C  
ATOM    303  OG1 THR A  19       1.745  -4.594  -9.832  1.00  8.93           O  
ATOM    304  CG2 THR A  19       1.139  -3.032 -11.587  1.00  8.93           C  
ATOM    305  H   THR A  19       2.296  -2.243  -9.185  1.00  7.38           H  
ATOM    306  HA  THR A  19      -0.507  -2.142  -9.729  1.00  7.76           H  
ATOM    307  HB  THR A  19      -0.166  -4.432 -10.605  1.00 10.72           H  
ATOM    308  HG1 THR A  19       1.889  -5.346 -10.419  1.00 10.72           H  
ATOM    309 1HG2 THR A  19       1.447  -3.744 -12.352  1.00 10.72           H  
ATOM    310 2HG2 THR A  19       0.317  -2.422 -11.966  1.00 10.72           H  
ATOM    311 3HG2 THR A  19       1.976  -2.387 -11.337  1.00 10.72           H  
ATOM    312  N   ARG A  20       0.230  -3.471  -6.953  1.00  6.62           N  
ATOM    313  CA  ARG A  20      -0.283  -4.080  -5.739  1.00  6.91           C  
ATOM    314  C   ARG A  20      -1.092  -3.086  -4.910  1.00  6.65           C  
ATOM    315  O   ARG A  20      -1.665  -3.443  -3.873  1.00  6.86           O  
ATOM    316  CB  ARG A  20       0.850  -4.593  -4.886  1.00  9.56           C  
ATOM    317  CG  ARG A  20       1.641  -5.746  -5.470  1.00  9.56           C  
ATOM    318  CD  ARG A  20       2.572  -6.266  -4.454  1.00  9.56           C  
ATOM    319  NE  ARG A  20       3.471  -5.212  -4.035  1.00  9.56           N  
ATOM    320  CZ  ARG A  20       4.646  -4.875  -4.595  1.00  9.56           C  
ATOM    321  NH1 ARG A  20       5.151  -5.537  -5.621  1.00  9.56           N  
ATOM    322  NH2 ARG A  20       5.270  -3.840  -4.079  1.00  9.56           N  
ATOM    323  H   ARG A  20       1.124  -3.004  -6.942  1.00  7.94           H  
ATOM    324  HA  ARG A  20      -0.925  -4.915  -6.014  1.00  8.29           H  
ATOM    325 1HB  ARG A  20       1.541  -3.770  -4.699  1.00 11.47           H  
ATOM    326 2HB  ARG A  20       0.462  -4.910  -3.918  1.00 11.47           H  
ATOM    327 1HG  ARG A  20       0.963  -6.543  -5.771  1.00 11.47           H  
ATOM    328 2HG  ARG A  20       2.209  -5.401  -6.333  1.00 11.47           H  
ATOM    329 1HD  ARG A  20       2.010  -6.600  -3.580  1.00 11.47           H  
ATOM    330 2HD  ARG A  20       3.152  -7.094  -4.851  1.00 11.47           H  
ATOM    331  HE  ARG A  20       3.163  -4.616  -3.241  1.00 11.47           H  
ATOM    332 1HH1 ARG A  20       4.658  -6.326  -6.010  1.00 11.47           H  
ATOM    333 2HH1 ARG A  20       6.035  -5.254  -6.020  1.00 11.47           H  
ATOM    334 1HH2 ARG A  20       4.800  -3.349  -3.296  1.00 11.47           H  
ATOM    335 2HH2 ARG A  20       6.153  -3.525  -4.447  1.00 11.47           H  
ATOM    336  N   HIS A  21      -1.159  -1.829  -5.343  1.00  6.52           N  
ATOM    337  CA  HIS A  21      -1.888  -0.832  -4.577  1.00  6.63           C  
ATOM    338  C   HIS A  21      -3.374  -0.961  -4.881  1.00  6.18           C  
ATOM    339  O   HIS A  21      -3.928  -0.228  -5.701  1.00  6.42           O  
ATOM    340  CB  HIS A  21      -1.354   0.585  -4.847  1.00  9.24           C  
ATOM    341  CG  HIS A  21      -1.890   1.623  -3.875  1.00  9.24           C  
ATOM    342  ND1 HIS A  21      -1.482   1.701  -2.524  1.00  9.24           N  
ATOM    343  CD2 HIS A  21      -2.785   2.636  -4.062  1.00  9.24           C  
ATOM    344  CE1 HIS A  21      -2.167   2.714  -1.944  1.00  9.24           C  
ATOM    345  NE2 HIS A  21      -2.930   3.294  -2.858  1.00  9.24           N  
ATOM    346  H   HIS A  21      -0.719  -1.547  -6.223  1.00  7.82           H  
ATOM    347  HA  HIS A  21      -1.763  -1.025  -3.514  1.00  7.96           H  
ATOM    348 1HB  HIS A  21      -0.265   0.583  -4.795  1.00 11.09           H  
ATOM    349 2HB  HIS A  21      -1.625   0.887  -5.861  1.00 11.09           H  
ATOM    350  HD2 HIS A  21      -3.295   2.880  -4.996  1.00 11.09           H  
ATOM    351  HE1 HIS A  21      -2.099   3.032  -0.911  1.00 11.09           H  
ATOM    352  HE2 HIS A  21      -3.548   4.127  -2.689  1.00 11.09           H  
ATOM    353  N   GLN A  22      -3.992  -1.938  -4.213  1.00  5.85           N  
ATOM    354  CA  GLN A  22      -5.381  -2.320  -4.431  1.00  5.70           C  
ATOM    355  C   GLN A  22      -6.324  -1.245  -3.891  1.00  5.39           C  
ATOM    356  O   GLN A  22      -5.947  -0.529  -2.964  1.00  5.40           O  
ATOM    357  CB  GLN A  22      -5.694  -3.657  -3.741  1.00  8.04           C  
ATOM    358  CG  GLN A  22      -4.932  -4.848  -4.268  1.00  8.04           C  
ATOM    359  CD  GLN A  22      -5.272  -5.195  -5.698  1.00  8.04           C  
ATOM    360  OE1 GLN A  22      -6.440  -5.365  -6.070  1.00  8.04           O  
ATOM    361  NE2 GLN A  22      -4.238  -5.308  -6.509  1.00  8.04           N  
ATOM    362  H   GLN A  22      -3.397  -2.476  -3.582  1.00  7.02           H  
ATOM    363  HA  GLN A  22      -5.495  -2.436  -5.494  1.00  6.84           H  
ATOM    364 1HB  GLN A  22      -5.463  -3.570  -2.680  1.00  9.65           H  
ATOM    365 2HB  GLN A  22      -6.746  -3.883  -3.820  1.00  9.65           H  
ATOM    366 1HG  GLN A  22      -3.870  -4.634  -4.222  1.00  9.65           H  
ATOM    367 2HG  GLN A  22      -5.162  -5.712  -3.645  1.00  9.65           H  
ATOM    368 1HE2 GLN A  22      -4.350  -5.541  -7.475  1.00  9.65           H  
ATOM    369 2HE2 GLN A  22      -3.315  -5.171  -6.147  1.00  9.65           H  
ATOM    370  N   PRO A  23      -7.575  -1.142  -4.395  1.00  5.54           N  
ATOM    371  CA  PRO A  23      -8.342  -1.944  -5.366  1.00  5.63           C  
ATOM    372  C   PRO A  23      -7.660  -2.084  -6.705  1.00  5.39           C  
ATOM    373  O   PRO A  23      -6.984  -1.163  -7.153  1.00  5.65           O  
ATOM    374  CB  PRO A  23      -9.627  -1.139  -5.506  1.00  8.44           C  
ATOM    375  CG  PRO A  23      -9.749  -0.378  -4.218  1.00  8.44           C  
ATOM    376  CD  PRO A  23      -8.335  -0.016  -3.862  1.00  8.44           C  
ATOM    377  HA  PRO A  23      -8.556  -2.934  -4.942  1.00  6.76           H  
ATOM    378 1HB  PRO A  23      -9.559  -0.486  -6.391  1.00 10.13           H  
ATOM    379 2HB  PRO A  23     -10.464  -1.820  -5.674  1.00 10.13           H  
ATOM    380 1HG  PRO A  23     -10.384   0.505  -4.363  1.00 10.13           H  
ATOM    381 2HG  PRO A  23     -10.239  -0.997  -3.453  1.00 10.13           H  
ATOM    382 1HD  PRO A  23      -8.022   0.912  -4.369  1.00 10.13           H  
ATOM    383 2HD  PRO A  23      -8.208   0.051  -2.772  1.00 10.13           H  
ATOM    384  N   HIS A  24      -7.836  -3.232  -7.338  1.00  5.31           N  
ATOM    385  CA  HIS A  24      -7.165  -3.514  -8.594  1.00  5.47           C  
ATOM    386  C   HIS A  24      -7.397  -2.407  -9.589  1.00  5.22           C  
ATOM    387  O   HIS A  24      -8.493  -1.870  -9.705  1.00  5.39           O  
ATOM    388  CB  HIS A  24      -7.649  -4.842  -9.185  1.00  7.60           C  
ATOM    389  CG  HIS A  24      -6.794  -5.359 -10.323  1.00  7.60           C  
ATOM    390  ND1 HIS A  24      -6.866  -4.882 -11.629  1.00  7.60           N  
ATOM    391  CD2 HIS A  24      -5.838  -6.314 -10.326  1.00  7.60           C  
ATOM    392  CE1 HIS A  24      -5.991  -5.530 -12.371  1.00  7.60           C  
ATOM    393  NE2 HIS A  24      -5.355  -6.401 -11.604  1.00  7.60           N  
ATOM    394  H   HIS A  24      -8.411  -3.956  -6.924  1.00  6.37           H  
ATOM    395  HA  HIS A  24      -6.091  -3.590  -8.425  1.00  6.56           H  
ATOM    396 1HB  HIS A  24      -7.674  -5.601  -8.405  1.00  9.12           H  
ATOM    397 2HB  HIS A  24      -8.665  -4.719  -9.557  1.00  9.12           H  
ATOM    398  HD1 HIS A  24      -7.356  -4.047 -11.991  1.00  9.12           H  
ATOM    399  HD2 HIS A  24      -5.434  -6.956  -9.542  1.00  9.12           H  
ATOM    400  HE1 HIS A  24      -5.892  -5.300 -13.432  1.00  9.12           H  
ATOM    401  N   MET A  25      -6.353  -2.072 -10.321  1.00  5.25           N  
ATOM    402  CA  MET A  25      -6.430  -1.015 -11.307  1.00  5.42           C  
ATOM    403  C   MET A  25      -7.550  -1.267 -12.308  1.00  5.32           C  
ATOM    404  O   MET A  25      -7.807  -2.406 -12.720  1.00  5.53           O  
ATOM    405  CB  MET A  25      -5.076  -0.910 -11.999  1.00  7.52           C  
ATOM    406  CG  MET A  25      -3.976  -0.360 -11.083  1.00  7.52           C  
ATOM    407  SD  MET A  25      -2.357  -0.280 -11.866  1.00  7.52           S  
ATOM    408  CE  MET A  25      -1.400   0.476 -10.551  1.00  7.52           C  
ATOM    409  H   MET A  25      -5.483  -2.567 -10.175  1.00  6.30           H  
ATOM    410  HA  MET A  25      -6.647  -0.078 -10.799  1.00  6.50           H  
ATOM    411 1HB  MET A  25      -4.771  -1.893 -12.356  1.00  9.02           H  
ATOM    412 2HB  MET A  25      -5.162  -0.254 -12.874  1.00  9.02           H  
ATOM    413 1HG  MET A  25      -4.256   0.650 -10.766  1.00  9.02           H  
ATOM    414 2HG  MET A  25      -3.897  -0.977 -10.190  1.00  9.02           H  
ATOM    415 1HE  MET A  25      -0.359   0.594 -10.867  1.00  9.02           H  
ATOM    416 2HE  MET A  25      -1.819   1.439 -10.323  1.00  9.02           H  
ATOM    417 3HE  MET A  25      -1.446  -0.133  -9.661  1.00  9.02           H  
ATOM    418  N   GLY A  26      -8.219  -0.187 -12.691  1.00  5.42           N  
ATOM    419  CA  GLY A  26      -9.299  -0.226 -13.660  1.00  5.73           C  
ATOM    420  C   GLY A  26     -10.081   1.080 -13.645  1.00  5.48           C  
ATOM    421  O   GLY A  26     -10.017   1.858 -12.693  1.00  5.81           O  
ATOM    422  H   GLY A  26      -7.955   0.705 -12.307  1.00  6.50           H  
ATOM    423 1HA  GLY A  26      -8.883  -0.393 -14.656  1.00  6.88           H  
ATOM    424 2HA  GLY A  26      -9.963  -1.060 -13.437  1.00  6.88           H  
ATOM    425  N   ASP A  27     -10.871   1.292 -14.689  1.00  5.27           N  
ATOM    426  CA  ASP A  27     -11.653   2.503 -14.886  1.00  5.44           C  
ATOM    427  C   ASP A  27     -12.727   2.703 -13.842  1.00  5.27           C  
ATOM    428  O   ASP A  27     -13.028   3.826 -13.433  1.00  5.62           O  
ATOM    429  CB  ASP A  27     -12.307   2.385 -16.254  1.00  7.56           C  
ATOM    430  CG  ASP A  27     -13.101   1.093 -16.329  1.00  7.56           C  
ATOM    431  OD1 ASP A  27     -12.743   0.169 -15.586  1.00  7.56           O  
ATOM    432  OD2 ASP A  27     -14.024   1.010 -17.088  1.00  7.56           O  
ATOM    433  H   ASP A  27     -10.960   0.562 -15.396  1.00  6.32           H  
ATOM    434  HA  ASP A  27     -10.976   3.355 -14.855  1.00  6.53           H  
ATOM    435 1HB  ASP A  27     -12.974   3.226 -16.429  1.00  9.07           H  
ATOM    436 2HB  ASP A  27     -11.548   2.376 -17.034  1.00  9.07           H  
ATOM    437  N   SER A  28     -13.250   1.592 -13.372  1.00  5.10           N  
ATOM    438  CA  SER A  28     -14.302   1.549 -12.381  1.00  5.24           C  
ATOM    439  C   SER A  28     -13.895   2.019 -10.982  1.00  4.82           C  
ATOM    440  O   SER A  28     -14.770   2.269 -10.149  1.00  5.09           O  
ATOM    441  CB  SER A  28     -14.845   0.137 -12.301  1.00  7.28           C  
ATOM    442  OG  SER A  28     -13.890  -0.745 -11.780  1.00  7.28           O  
ATOM    443  H   SER A  28     -12.956   0.725 -13.837  1.00  6.12           H  
ATOM    444  HA  SER A  28     -15.103   2.199 -12.730  1.00  6.29           H  
ATOM    445 1HB  SER A  28     -15.736   0.125 -11.676  1.00  8.74           H  
ATOM    446 2HB  SER A  28     -15.136  -0.190 -13.300  1.00  8.74           H  
ATOM    447  HG  SER A  28     -14.308  -1.611 -11.772  1.00  8.74           H  
ATOM    448  N   TRP A  29     -12.595   2.110 -10.684  1.00  4.50           N  
ATOM    449  CA  TRP A  29     -12.189   2.517  -9.346  1.00  4.34           C  
ATOM    450  C   TRP A  29     -11.878   4.024  -9.244  1.00  4.22           C  
ATOM    451  O   TRP A  29     -10.904   4.481  -9.845  1.00  4.30           O  
ATOM    452  CB  TRP A  29     -11.010   1.680  -8.922  1.00  6.14           C  
ATOM    453  CG  TRP A  29     -11.429   0.287  -8.727  1.00  6.14           C  
ATOM    454  CD1 TRP A  29     -11.232  -0.752  -9.571  1.00  6.14           C  
ATOM    455  CD2 TRP A  29     -12.178  -0.237  -7.614  1.00  6.14           C  
ATOM    456  NE1 TRP A  29     -11.798  -1.891  -9.057  1.00  6.14           N  
ATOM    457  CE2 TRP A  29     -12.381  -1.593  -7.863  1.00  6.14           C  
ATOM    458  CE3 TRP A  29     -12.689   0.330  -6.441  1.00  6.14           C  
ATOM    459  CZ2 TRP A  29     -13.071  -2.402  -6.981  1.00  6.14           C  
ATOM    460  CZ3 TRP A  29     -13.379  -0.480  -5.557  1.00  6.14           C  
ATOM    461  CH2 TRP A  29     -13.566  -1.812  -5.820  1.00  6.14           C  
ATOM    462  H   TRP A  29     -11.888   1.928 -11.404  1.00  5.40           H  
ATOM    463  HA  TRP A  29     -12.992   2.238  -8.684  1.00  5.21           H  
ATOM    464 1HB  TRP A  29     -10.254   1.705  -9.709  1.00  7.37           H  
ATOM    465 2HB  TRP A  29     -10.576   2.056  -8.002  1.00  7.37           H  
ATOM    466  HD1 TRP A  29     -10.700  -0.695 -10.522  1.00  7.37           H  
ATOM    467  HE1 TRP A  29     -11.780  -2.795  -9.502  1.00  7.37           H  
ATOM    468  HE3 TRP A  29     -12.544   1.380  -6.224  1.00  7.37           H  
ATOM    469  HZ2 TRP A  29     -13.232  -3.463  -7.172  1.00  7.37           H  
ATOM    470  HZ3 TRP A  29     -13.771  -0.033  -4.645  1.00  7.37           H  
ATOM    471  HH2 TRP A  29     -14.114  -2.421  -5.103  1.00  7.37           H  
ATOM    472  N   PRO A  30     -12.580   4.802  -8.374  1.00  4.47           N  
ATOM    473  CA  PRO A  30     -12.419   6.247  -8.174  1.00  4.74           C  
ATOM    474  C   PRO A  30     -10.980   6.719  -7.947  1.00  4.63           C  
ATOM    475  O   PRO A  30     -10.607   7.825  -8.359  1.00  4.73           O  
ATOM    476  CB  PRO A  30     -13.259   6.490  -6.911  1.00  7.12           C  
ATOM    477  CG  PRO A  30     -14.339   5.443  -6.969  1.00  7.12           C  
ATOM    478  CD  PRO A  30     -13.665   4.214  -7.534  1.00  7.12           C  
ATOM    479  HA  PRO A  30     -12.856   6.767  -9.033  1.00  5.69           H  
ATOM    480 1HB  PRO A  30     -12.629   6.411  -6.012  1.00  8.54           H  
ATOM    481 2HB  PRO A  30     -13.661   7.514  -6.927  1.00  8.54           H  
ATOM    482 1HG  PRO A  30     -14.757   5.271  -5.963  1.00  8.54           H  
ATOM    483 2HG  PRO A  30     -15.171   5.792  -7.599  1.00  8.54           H  
ATOM    484 1HD  PRO A  30     -13.262   3.583  -6.734  1.00  8.54           H  
ATOM    485 2HD  PRO A  30     -14.424   3.701  -8.147  1.00  8.54           H  
ATOM    486  N   ARG A  31     -10.156   5.881  -7.308  1.00  4.83           N  
ATOM    487  CA  ARG A  31      -8.773   6.255  -7.062  1.00  5.11           C  
ATOM    488  C   ARG A  31      -7.792   5.394  -7.844  1.00  4.85           C  
ATOM    489  O   ARG A  31      -6.845   5.908  -8.428  1.00  5.06           O  
ATOM    490  CB  ARG A  31      -8.448   6.171  -5.577  1.00  7.04           C  
ATOM    491  CG  ARG A  31      -9.238   7.127  -4.663  1.00  7.04           C  
ATOM    492  CD  ARG A  31      -8.878   8.564  -4.886  1.00  7.04           C  
ATOM    493  NE  ARG A  31      -9.611   9.462  -3.991  1.00  7.04           N  
ATOM    494  CZ  ARG A  31      -9.236   9.815  -2.737  1.00  7.04           C  
ATOM    495  NH1 ARG A  31      -8.127   9.345  -2.205  1.00  7.04           N  
ATOM    496  NH2 ARG A  31      -9.996  10.643  -2.040  1.00  7.04           N  
ATOM    497  H   ARG A  31     -10.490   5.004  -6.942  1.00  5.80           H  
ATOM    498  HA  ARG A  31      -8.626   7.279  -7.396  1.00  6.13           H  
ATOM    499 1HB  ARG A  31      -8.634   5.158  -5.226  1.00  8.45           H  
ATOM    500 2HB  ARG A  31      -7.386   6.374  -5.428  1.00  8.45           H  
ATOM    501 1HG  ARG A  31     -10.304   7.016  -4.860  1.00  8.45           H  
ATOM    502 2HG  ARG A  31      -9.038   6.878  -3.622  1.00  8.45           H  
ATOM    503 1HD  ARG A  31      -7.810   8.710  -4.740  1.00  8.45           H  
ATOM    504 2HD  ARG A  31      -9.138   8.850  -5.903  1.00  8.45           H  
ATOM    505  HE  ARG A  31     -10.476   9.855  -4.345  1.00  8.45           H  
ATOM    506 1HH1 ARG A  31      -7.536   8.708  -2.724  1.00  8.45           H  
ATOM    507 2HH1 ARG A  31      -7.867   9.618  -1.269  1.00  8.45           H  
ATOM    508 1HH2 ARG A  31     -10.850  11.006  -2.441  1.00  8.45           H  
ATOM    509 2HH2 ARG A  31      -9.727  10.914  -1.105  1.00  8.45           H  
ATOM    510  N   SER A  32      -7.983   4.079  -7.887  1.00  4.79           N  
ATOM    511  CA  SER A  32      -6.981   3.248  -8.549  1.00  4.89           C  
ATOM    512  C   SER A  32      -6.846   3.561 -10.050  1.00  4.87           C  
ATOM    513  O   SER A  32      -5.742   3.431 -10.607  1.00  5.16           O  
ATOM    514  CB  SER A  32      -7.262   1.783  -8.305  1.00  6.80           C  
ATOM    515  OG  SER A  32      -7.154   1.494  -6.940  1.00  6.80           O  
ATOM    516  H   SER A  32      -8.768   3.647  -7.436  1.00  5.75           H  
ATOM    517  HA  SER A  32      -6.016   3.460  -8.084  1.00  5.87           H  
ATOM    518 1HB  SER A  32      -8.230   1.505  -8.665  1.00  8.16           H  
ATOM    519 2HB  SER A  32      -6.535   1.186  -8.844  1.00  8.16           H  
ATOM    520  HG  SER A  32      -7.158   0.512  -6.886  1.00  8.16           H  
ATOM    521  N   SER A  33      -7.920   4.098 -10.683  1.00  4.94           N  
ATOM    522  CA  SER A  33      -7.940   4.479 -12.099  1.00  5.30           C  
ATOM    523  C   SER A  33      -6.942   5.586 -12.381  1.00  5.03           C  
ATOM    524  O   SER A  33      -6.601   5.824 -13.542  1.00  4.93           O  
ATOM    525  CB  SER A  33      -9.303   5.007 -12.505  1.00  7.27           C  
ATOM    526  OG  SER A  33      -9.544   6.256 -11.915  1.00  7.27           O  
ATOM    527  H   SER A  33      -8.823   4.198 -10.205  1.00  5.93           H  
ATOM    528  HA  SER A  33      -7.690   3.608 -12.706  1.00  6.36           H  
ATOM    529 1HB  SER A  33      -9.355   5.097 -13.591  1.00  8.72           H  
ATOM    530 2HB  SER A  33     -10.073   4.308 -12.202  1.00  8.72           H  
ATOM    531  HG  SER A  33     -10.490   6.415 -12.026  1.00  8.72           H  
ATOM    532  N   ALA A  34      -6.463   6.258 -11.322  1.00  5.30           N  
ATOM    533  CA  ALA A  34      -5.523   7.346 -11.429  1.00  5.46           C  
ATOM    534  C   ALA A  34      -4.244   6.917 -12.116  1.00  5.18           C  
ATOM    535  O   ALA A  34      -3.589   7.718 -12.785  1.00  4.99           O  
ATOM    536  CB  ALA A  34      -5.182   7.899 -10.060  1.00  7.58           C  
ATOM    537  H   ALA A  34      -6.775   5.999 -10.383  1.00  6.36           H  
ATOM    538  HA  ALA A  34      -6.003   8.103 -12.022  1.00  6.55           H  
ATOM    539 1HB  ALA A  34      -4.501   8.744 -10.153  1.00  9.10           H  
ATOM    540 2HB  ALA A  34      -6.095   8.224  -9.565  1.00  9.10           H  
ATOM    541 3HB  ALA A  34      -4.711   7.120  -9.463  1.00  9.10           H  
ATOM    542  N   HIS A  35      -3.836   5.664 -11.925  1.00  5.47           N  
ATOM    543  CA  HIS A  35      -2.617   5.198 -12.558  1.00  5.58           C  
ATOM    544  C   HIS A  35      -2.740   5.287 -14.069  1.00  4.93           C  
ATOM    545  O   HIS A  35      -1.909   5.896 -14.760  1.00  4.97           O  
ATOM    546  CB  HIS A  35      -2.377   3.746 -12.184  1.00  7.77           C  
ATOM    547  CG  HIS A  35      -1.203   3.140 -12.834  1.00  7.77           C  
ATOM    548  ND1 HIS A  35       0.083   3.353 -12.400  1.00  7.77           N  
ATOM    549  CD2 HIS A  35      -1.114   2.318 -13.907  1.00  7.77           C  
ATOM    550  CE1 HIS A  35       0.915   2.664 -13.175  1.00  7.77           C  
ATOM    551  NE2 HIS A  35       0.209   2.035 -14.093  1.00  7.77           N  
ATOM    552  H   HIS A  35      -4.380   5.016 -11.342  1.00  6.56           H  
ATOM    553  HA  HIS A  35      -1.771   5.805 -12.240  1.00  6.70           H  
ATOM    554 1HB  HIS A  35      -2.256   3.676 -11.111  1.00  9.32           H  
ATOM    555 2HB  HIS A  35      -3.254   3.150 -12.441  1.00  9.32           H  
ATOM    556  HD2 HIS A  35      -1.948   1.944 -14.504  1.00  9.32           H  
ATOM    557  HE1 HIS A  35       1.994   2.620 -13.073  1.00  9.32           H  
ATOM    558  HE2 HIS A  35       0.581   1.436 -14.817  1.00  9.32           H  
ATOM    559  N   GLU A  36      -3.805   4.665 -14.569  1.00  4.64           N  
ATOM    560  CA  GLU A  36      -4.089   4.613 -15.983  1.00  4.39           C  
ATOM    561  C   GLU A  36      -4.376   6.005 -16.505  1.00  3.80           C  
ATOM    562  O   GLU A  36      -3.937   6.364 -17.596  1.00  3.75           O  
ATOM    563  CB  GLU A  36      -5.287   3.690 -16.223  1.00  6.25           C  
ATOM    564  CG  GLU A  36      -4.998   2.209 -15.911  1.00  6.25           C  
ATOM    565  CD  GLU A  36      -6.194   1.305 -16.093  1.00  6.25           C  
ATOM    566  OE1 GLU A  36      -7.243   1.803 -16.398  1.00  6.25           O  
ATOM    567  OE2 GLU A  36      -6.057   0.123 -15.902  1.00  6.25           O  
ATOM    568  H   GLU A  36      -4.426   4.201 -13.923  1.00  5.57           H  
ATOM    569  HA  GLU A  36      -3.217   4.218 -16.502  1.00  5.27           H  
ATOM    570 1HB  GLU A  36      -6.124   4.013 -15.597  1.00  7.50           H  
ATOM    571 2HB  GLU A  36      -5.605   3.768 -17.264  1.00  7.50           H  
ATOM    572 1HG  GLU A  36      -4.195   1.865 -16.562  1.00  7.50           H  
ATOM    573 2HG  GLU A  36      -4.647   2.128 -14.881  1.00  7.50           H  
ATOM    574  N   ALA A  37      -5.083   6.805 -15.712  1.00  3.77           N  
ATOM    575  CA  ALA A  37      -5.440   8.145 -16.104  1.00  3.72           C  
ATOM    576  C   ALA A  37      -4.237   9.002 -16.377  1.00  3.71           C  
ATOM    577  O   ALA A  37      -4.209   9.747 -17.369  1.00  3.92           O  
ATOM    578  CB  ALA A  37      -6.204   8.773 -14.988  1.00  5.23           C  
ATOM    579  H   ALA A  37      -5.428   6.445 -14.819  1.00  4.52           H  
ATOM    580  HA  ALA A  37      -6.029   8.091 -17.014  1.00  4.46           H  
ATOM    581 1HB  ALA A  37      -6.463   9.773 -15.265  1.00  6.28           H  
ATOM    582 2HB  ALA A  37      -7.082   8.201 -14.741  1.00  6.28           H  
ATOM    583 3HB  ALA A  37      -5.565   8.784 -14.153  1.00  6.28           H  
ATOM    584  N   ALA A  38      -3.239   8.914 -15.495  1.00  3.94           N  
ATOM    585  CA  ALA A  38      -2.029   9.686 -15.653  1.00  4.42           C  
ATOM    586  C   ALA A  38      -1.293   9.295 -16.928  1.00  4.37           C  
ATOM    587  O   ALA A  38      -0.858  10.167 -17.683  1.00  4.82           O  
ATOM    588  CB  ALA A  38      -1.142   9.484 -14.445  1.00  6.00           C  
ATOM    589  H   ALA A  38      -3.347   8.329 -14.658  1.00  4.73           H  
ATOM    590  HA  ALA A  38      -2.301  10.738 -15.727  1.00  5.30           H  
ATOM    591 1HB  ALA A  38      -0.251  10.073 -14.567  1.00  7.20           H  
ATOM    592 2HB  ALA A  38      -1.668   9.788 -13.544  1.00  7.20           H  
ATOM    593 3HB  ALA A  38      -0.872   8.428 -14.364  1.00  7.20           H  
ATOM    594  N   GLU A  39      -1.226   7.985 -17.221  1.00  4.21           N  
ATOM    595  CA  GLU A  39      -0.542   7.505 -18.427  1.00  4.63           C  
ATOM    596  C   GLU A  39      -1.275   7.919 -19.703  1.00  4.61           C  
ATOM    597  O   GLU A  39      -0.659   8.263 -20.716  1.00  5.10           O  
ATOM    598  CB  GLU A  39      -0.424   5.977 -18.393  1.00  6.31           C  
ATOM    599  CG  GLU A  39       0.511   5.444 -17.327  1.00  6.31           C  
ATOM    600  CD  GLU A  39       1.938   5.831 -17.538  1.00  6.31           C  
ATOM    601  OE1 GLU A  39       2.505   5.496 -18.554  1.00  6.31           O  
ATOM    602  OE2 GLU A  39       2.457   6.505 -16.694  1.00  6.31           O  
ATOM    603  H   GLU A  39      -1.588   7.305 -16.541  1.00  5.05           H  
ATOM    604  HA  GLU A  39       0.458   7.938 -18.450  1.00  5.56           H  
ATOM    605 1HB  GLU A  39      -1.411   5.547 -18.212  1.00  7.57           H  
ATOM    606 2HB  GLU A  39      -0.082   5.616 -19.361  1.00  7.57           H  
ATOM    607 1HG  GLU A  39       0.189   5.826 -16.358  1.00  7.57           H  
ATOM    608 2HG  GLU A  39       0.430   4.359 -17.296  1.00  7.57           H  
ATOM    609  N   LEU A  40      -2.603   7.902 -19.633  1.00  4.39           N  
ATOM    610  CA  LEU A  40      -3.473   8.249 -20.743  1.00  4.85           C  
ATOM    611  C   LEU A  40      -3.686   9.743 -20.944  1.00  5.05           C  
ATOM    612  O   LEU A  40      -3.989  10.165 -22.062  1.00  5.61           O  
ATOM    613  CB  LEU A  40      -4.865   7.643 -20.510  1.00  6.61           C  
ATOM    614  CG  LEU A  40      -5.023   6.110 -20.512  1.00  6.61           C  
ATOM    615  CD1 LEU A  40      -6.441   5.786 -20.008  1.00  6.61           C  
ATOM    616  CD2 LEU A  40      -4.808   5.557 -21.915  1.00  6.61           C  
ATOM    617  H   LEU A  40      -3.031   7.559 -18.768  1.00  5.27           H  
ATOM    618  HA  LEU A  40      -3.032   7.852 -21.651  1.00  5.82           H  
ATOM    619 1HB  LEU A  40      -5.196   7.986 -19.534  1.00  7.93           H  
ATOM    620 2HB  LEU A  40      -5.541   8.053 -21.259  1.00  7.93           H  
ATOM    621  HG  LEU A  40      -4.301   5.658 -19.846  1.00  7.93           H  
ATOM    622 1HD1 LEU A  40      -6.581   4.706 -19.986  1.00  7.93           H  
ATOM    623 2HD1 LEU A  40      -6.560   6.186 -19.000  1.00  7.93           H  
ATOM    624 3HD1 LEU A  40      -7.178   6.236 -20.670  1.00  7.93           H  
ATOM    625 1HD2 LEU A  40      -4.938   4.476 -21.896  1.00  7.93           H  
ATOM    626 2HD2 LEU A  40      -5.534   5.998 -22.598  1.00  7.93           H  
ATOM    627 3HD2 LEU A  40      -3.804   5.789 -22.256  1.00  7.93           H  
ATOM    628  N   ASN A  41      -3.545  10.545 -19.874  1.00  4.97           N  
ATOM    629  CA  ASN A  41      -3.898  11.962 -19.891  1.00  5.50           C  
ATOM    630  C   ASN A  41      -5.376  12.019 -20.247  1.00  5.43           C  
ATOM    631  O   ASN A  41      -5.820  12.817 -21.075  1.00  5.89           O  
ATOM    632  CB  ASN A  41      -3.050  12.762 -20.869  1.00  7.49           C  
ATOM    633  CG  ASN A  41      -3.083  14.257 -20.586  1.00  7.49           C  
ATOM    634  OD1 ASN A  41      -3.198  14.685 -19.430  1.00  7.49           O  
ATOM    635  ND2 ASN A  41      -2.976  15.052 -21.624  1.00  7.49           N  
ATOM    636  H   ASN A  41      -3.274  10.153 -18.970  1.00  5.96           H  
ATOM    637  HA  ASN A  41      -3.767  12.375 -18.897  1.00  6.60           H  
ATOM    638 1HB  ASN A  41      -2.019  12.411 -20.823  1.00  8.99           H  
ATOM    639 2HB  ASN A  41      -3.406  12.600 -21.884  1.00  8.99           H  
ATOM    640 1HD2 ASN A  41      -2.990  16.045 -21.501  1.00  8.99           H  
ATOM    641 2HD2 ASN A  41      -2.887  14.662 -22.541  1.00  8.99           H  
ATOM    642  N   ARG A  42      -6.132  11.129 -19.601  1.00  5.25           N  
ATOM    643  CA  ARG A  42      -7.559  11.002 -19.842  1.00  5.60           C  
ATOM    644  C   ARG A  42      -8.319  12.203 -19.276  1.00  5.52           C  
ATOM    645  O   ARG A  42      -8.341  12.412 -18.064  1.00  5.65           O  
ATOM    646  CB  ARG A  42      -8.046   9.698 -19.220  1.00  7.70           C  
ATOM    647  CG  ARG A  42      -9.509   9.366 -19.386  1.00  7.70           C  
ATOM    648  CD  ARG A  42      -9.841   8.862 -20.737  1.00  7.70           C  
ATOM    649  NE  ARG A  42     -11.234   8.446 -20.793  1.00  7.70           N  
ATOM    650  CZ  ARG A  42     -11.696   7.211 -20.476  1.00  7.70           C  
ATOM    651  NH1 ARG A  42     -10.868   6.255 -20.107  1.00  7.70           N  
ATOM    652  NH2 ARG A  42     -12.995   6.966 -20.538  1.00  7.70           N  
ATOM    653  H   ARG A  42      -5.648  10.541 -18.914  1.00  6.30           H  
ATOM    654  HA  ARG A  42      -7.718  10.961 -20.920  1.00  6.72           H  
ATOM    655 1HB  ARG A  42      -7.485   8.872 -19.640  1.00  9.24           H  
ATOM    656 2HB  ARG A  42      -7.834   9.715 -18.156  1.00  9.24           H  
ATOM    657 1HG  ARG A  42      -9.809   8.620 -18.682  1.00  9.24           H  
ATOM    658 2HG  ARG A  42     -10.091  10.258 -19.212  1.00  9.24           H  
ATOM    659 1HD  ARG A  42      -9.703   9.661 -21.463  1.00  9.24           H  
ATOM    660 2HD  ARG A  42      -9.203   8.022 -21.001  1.00  9.24           H  
ATOM    661  HE  ARG A  42     -11.918   9.142 -21.067  1.00  9.24           H  
ATOM    662 1HH1 ARG A  42      -9.878   6.433 -20.070  1.00  9.24           H  
ATOM    663 2HH1 ARG A  42     -11.223   5.340 -19.872  1.00  9.24           H  
ATOM    664 1HH2 ARG A  42     -13.634   7.698 -20.818  1.00  9.24           H  
ATOM    665 2HH2 ARG A  42     -13.351   6.053 -20.303  1.00  9.24           H  
ATOM    666  N   GLN A  43      -9.062  12.905 -20.134  1.00  5.65           N  
ATOM    667  CA  GLN A  43      -9.756  14.141 -19.739  1.00  5.84           C  
ATOM    668  C   GLN A  43     -10.745  14.013 -18.585  1.00  5.41           C  
ATOM    669  O   GLN A  43     -10.908  14.944 -17.808  1.00  5.58           O  
ATOM    670  CB  GLN A  43     -10.474  14.760 -20.946  1.00  8.10           C  
ATOM    671  CG  GLN A  43     -11.146  16.114 -20.655  1.00  8.10           C  
ATOM    672  CD  GLN A  43     -10.144  17.185 -20.260  1.00  8.10           C  
ATOM    673  OE1 GLN A  43      -9.192  17.467 -20.995  1.00  8.10           O  
ATOM    674  NE2 GLN A  43     -10.348  17.768 -19.086  1.00  8.10           N  
ATOM    675  H   GLN A  43      -9.044  12.642 -21.112  1.00  6.78           H  
ATOM    676  HA  GLN A  43      -8.986  14.847 -19.421  1.00  7.01           H  
ATOM    677 1HB  GLN A  43      -9.760  14.907 -21.756  1.00  9.72           H  
ATOM    678 2HB  GLN A  43     -11.243  14.077 -21.303  1.00  9.72           H  
ATOM    679 1HG  GLN A  43     -11.642  16.447 -21.564  1.00  9.72           H  
ATOM    680 2HG  GLN A  43     -11.880  16.012 -19.860  1.00  9.72           H  
ATOM    681 1HE2 GLN A  43      -9.711  18.459 -18.741  1.00  9.72           H  
ATOM    682 2HE2 GLN A  43     -11.129  17.482 -18.521  1.00  9.72           H  
ATOM    683  N   CYS A  44     -11.426  12.887 -18.461  1.00  5.18           N  
ATOM    684  CA  CYS A  44     -12.395  12.726 -17.379  1.00  5.03           C  
ATOM    685  C   CYS A  44     -11.745  12.412 -16.023  1.00  4.93           C  
ATOM    686  O   CYS A  44     -12.437  12.329 -14.993  1.00  5.16           O  
ATOM    687  CB  CYS A  44     -13.407  11.634 -17.740  1.00  7.10           C  
ATOM    688  SG  CYS A  44     -12.716   9.957 -17.882  1.00  7.10           S  
ATOM    689  H   CYS A  44     -11.289  12.142 -19.125  1.00  6.22           H  
ATOM    690  HA  CYS A  44     -12.942  13.664 -17.281  1.00  6.04           H  
ATOM    691 1HB  CYS A  44     -14.194  11.608 -16.987  1.00  8.52           H  
ATOM    692 2HB  CYS A  44     -13.875  11.884 -18.690  1.00  8.52           H  
ATOM    693  HG  CYS A  44     -12.339   9.813 -16.602  1.00  8.52           H  
ATOM    694  N   TRP A  45     -10.438  12.137 -16.043  1.00  5.02           N  
ATOM    695  CA  TRP A  45      -9.693  11.757 -14.857  1.00  5.29           C  
ATOM    696  C   TRP A  45      -8.551  12.727 -14.484  1.00  5.32           C  
ATOM    697  O   TRP A  45      -8.170  12.836 -13.315  1.00  5.67           O  
ATOM    698  CB  TRP A  45      -9.147  10.354 -15.063  1.00  7.30           C  
ATOM    699  CG  TRP A  45     -10.191   9.253 -15.147  1.00  7.30           C  
ATOM    700  CD1 TRP A  45     -11.448   9.291 -14.660  1.00  7.30           C  
ATOM    701  CD2 TRP A  45     -10.062   7.953 -15.778  1.00  7.30           C  
ATOM    702  NE1 TRP A  45     -12.096   8.127 -14.921  1.00  7.30           N  
ATOM    703  CE2 TRP A  45     -11.265   7.300 -15.604  1.00  7.30           C  
ATOM    704  CE3 TRP A  45      -9.043   7.310 -16.463  1.00  7.30           C  
ATOM    705  CZ2 TRP A  45     -11.477   6.034 -16.085  1.00  7.30           C  
ATOM    706  CZ3 TRP A  45      -9.243   6.050 -16.940  1.00  7.30           C  
ATOM    707  CH2 TRP A  45     -10.425   5.425 -16.762  1.00  7.30           C  
ATOM    708  H   TRP A  45      -9.922  12.254 -16.912  1.00  6.02           H  
ATOM    709  HA  TRP A  45     -10.384  11.746 -14.026  1.00  6.35           H  
ATOM    710 1HB  TRP A  45      -8.560  10.343 -15.972  1.00  8.76           H  
ATOM    711 2HB  TRP A  45      -8.503  10.125 -14.224  1.00  8.76           H  
ATOM    712  HD1 TRP A  45     -11.880  10.115 -14.146  1.00  8.76           H  
ATOM    713  HE1 TRP A  45     -13.045   7.911 -14.648  1.00  8.76           H  
ATOM    714  HE3 TRP A  45      -8.124   7.789 -16.625  1.00  8.76           H  
ATOM    715  HZ2 TRP A  45     -12.428   5.518 -15.947  1.00  8.76           H  
ATOM    716  HZ3 TRP A  45      -8.427   5.562 -17.472  1.00  8.76           H  
ATOM    717  HH2 TRP A  45     -10.544   4.428 -17.161  1.00  8.76           H  
ATOM    718  N   VAL A  46      -7.954  13.393 -15.474  1.00  5.37           N  
ATOM    719  CA  VAL A  46      -6.809  14.261 -15.210  1.00  5.79           C  
ATOM    720  C   VAL A  46      -7.211  15.730 -15.304  1.00  5.81           C  
ATOM    721  O   VAL A  46      -7.380  16.263 -16.403  1.00  6.18           O  
ATOM    722  CB  VAL A  46      -5.687  13.959 -16.242  1.00  7.94           C  
ATOM    723  CG1 VAL A  46      -4.475  14.838 -16.006  1.00  7.94           C  
ATOM    724  CG2 VAL A  46      -5.292  12.492 -16.148  1.00  7.94           C  
ATOM    725  H   VAL A  46      -8.271  13.263 -16.433  1.00  6.44           H  
ATOM    726  HA  VAL A  46      -6.441  14.065 -14.203  1.00  6.95           H  
ATOM    727  HB  VAL A  46      -6.061  14.169 -17.248  1.00  9.53           H  
ATOM    728 1HG1 VAL A  46      -3.713  14.605 -16.753  1.00  9.53           H  
ATOM    729 2HG1 VAL A  46      -4.746  15.889 -16.093  1.00  9.53           H  
ATOM    730 3HG1 VAL A  46      -4.074  14.654 -15.018  1.00  9.53           H  
ATOM    731 1HG2 VAL A  46      -4.527  12.277 -16.859  1.00  9.53           H  
ATOM    732 2HG2 VAL A  46      -4.917  12.288 -15.174  1.00  9.53           H  
ATOM    733 3HG2 VAL A  46      -6.157  11.866 -16.352  1.00  9.53           H  
ATOM    734  N   LEU A  47      -7.385  16.383 -14.153  1.00  5.77           N  
ATOM    735  CA  LEU A  47      -7.853  17.775 -14.146  1.00  6.15           C  
ATOM    736  C   LEU A  47      -7.080  18.606 -13.142  1.00  6.20           C  
ATOM    737  O   LEU A  47      -7.276  18.472 -11.926  1.00  6.44           O  
ATOM    738  CB  LEU A  47      -9.357  17.931 -13.819  1.00  8.45           C  
ATOM    739  CG  LEU A  47     -10.432  17.555 -14.861  1.00  8.45           C  
ATOM    740  CD1 LEU A  47     -10.739  16.044 -14.840  1.00  8.45           C  
ATOM    741  CD2 LEU A  47     -11.712  18.366 -14.509  1.00  8.45           C  
ATOM    742  H   LEU A  47      -7.161  15.910 -13.269  1.00  6.92           H  
ATOM    743  HA  LEU A  47      -7.678  18.198 -15.134  1.00  7.38           H  
ATOM    744 1HB  LEU A  47      -9.592  17.421 -12.921  1.00 10.14           H  
ATOM    745 2HB  LEU A  47      -9.516  18.968 -13.635  1.00 10.14           H  
ATOM    746  HG  LEU A  47     -10.085  17.814 -15.860  1.00 10.14           H  
ATOM    747 1HD1 LEU A  47     -11.513  15.824 -15.567  1.00 10.14           H  
ATOM    748 2HD1 LEU A  47      -9.876  15.468 -15.083  1.00 10.14           H  
ATOM    749 3HD1 LEU A  47     -11.078  15.770 -13.882  1.00 10.14           H  
ATOM    750 1HD2 LEU A  47     -12.496  18.141 -15.230  1.00 10.14           H  
ATOM    751 2HD2 LEU A  47     -12.050  18.089 -13.508  1.00 10.14           H  
ATOM    752 3HD2 LEU A  47     -11.504  19.440 -14.533  1.00 10.14           H  
ATOM    753  N   GLY A  48      -6.274  19.539 -13.639  1.00  6.31           N  
ATOM    754  CA  GLY A  48      -5.429  20.340 -12.763  1.00  6.67           C  
ATOM    755  C   GLY A  48      -4.348  19.491 -12.095  1.00  6.25           C  
ATOM    756  O   GLY A  48      -3.571  18.817 -12.783  1.00  6.43           O  
ATOM    757  H   GLY A  48      -6.192  19.641 -14.644  1.00  7.57           H  
ATOM    758 1HA  GLY A  48      -4.962  21.140 -13.339  1.00  8.00           H  
ATOM    759 2HA  GLY A  48      -6.038  20.822 -12.001  1.00  8.00           H  
ATOM    760  N   HIS A  49      -4.327  19.498 -10.765  1.00  6.06           N  
ATOM    761  CA  HIS A  49      -3.322  18.785  -9.979  1.00  6.08           C  
ATOM    762  C   HIS A  49      -3.877  17.667  -9.102  1.00  5.61           C  
ATOM    763  O   HIS A  49      -3.658  17.640  -7.886  1.00  5.86           O  
ATOM    764  CB  HIS A  49      -2.578  19.785  -9.101  1.00  8.50           C  
ATOM    765  CG  HIS A  49      -1.936  20.872  -9.901  1.00  8.50           C  
ATOM    766  ND1 HIS A  49      -0.795  20.682 -10.661  1.00  8.50           N  
ATOM    767  CD2 HIS A  49      -2.297  22.166 -10.079  1.00  8.50           C  
ATOM    768  CE1 HIS A  49      -0.482  21.816 -11.262  1.00  8.50           C  
ATOM    769  NE2 HIS A  49      -1.376  22.729 -10.927  1.00  8.50           N  
ATOM    770  H   HIS A  49      -5.021  20.053 -10.287  1.00  7.27           H  
ATOM    771  HA  HIS A  49      -2.599  18.327 -10.653  1.00  7.30           H  
ATOM    772 1HB  HIS A  49      -3.255  20.232  -8.380  1.00 10.20           H  
ATOM    773 2HB  HIS A  49      -1.796  19.263  -8.544  1.00 10.20           H  
ATOM    774  HD1 HIS A  49      -0.378  19.802 -10.915  1.00 10.20           H  
ATOM    775  HD2 HIS A  49      -3.126  22.766  -9.692  1.00 10.20           H  
ATOM    776  HE1 HIS A  49       0.391  21.876 -11.910  1.00 10.20           H  
ATOM    777  N   TRP A  50      -4.639  16.789  -9.729  1.00  5.32           N  
ATOM    778  CA  TRP A  50      -5.161  15.566  -9.143  1.00  5.29           C  
ATOM    779  C   TRP A  50      -5.584  14.668 -10.271  1.00  5.16           C  
ATOM    780  O   TRP A  50      -6.153  15.121 -11.280  1.00  5.35           O  
ATOM    781  CB  TRP A  50      -6.331  15.782  -8.213  1.00  7.42           C  
ATOM    782  CG  TRP A  50      -6.800  14.530  -7.512  1.00  7.42           C  
ATOM    783  CD1 TRP A  50      -7.792  13.665  -7.886  1.00  7.42           C  
ATOM    784  CD2 TRP A  50      -6.304  14.033  -6.273  1.00  7.42           C  
ATOM    785  NE1 TRP A  50      -7.922  12.677  -6.982  1.00  7.42           N  
ATOM    786  CE2 TRP A  50      -7.024  12.876  -5.980  1.00  7.42           C  
ATOM    787  CE3 TRP A  50      -5.327  14.467  -5.398  1.00  7.42           C  
ATOM    788  CZ2 TRP A  50      -6.791  12.147  -4.841  1.00  7.42           C  
ATOM    789  CZ3 TRP A  50      -5.092  13.742  -4.254  1.00  7.42           C  
ATOM    790  CH2 TRP A  50      -5.810  12.607  -3.983  1.00  7.42           C  
ATOM    791  H   TRP A  50      -4.782  16.940 -10.720  1.00  6.38           H  
ATOM    792  HA  TRP A  50      -4.371  15.065  -8.587  1.00  6.35           H  
ATOM    793 1HB  TRP A  50      -6.013  16.456  -7.451  1.00  8.90           H  
ATOM    794 2HB  TRP A  50      -7.140  16.221  -8.738  1.00  8.90           H  
ATOM    795  HD1 TRP A  50      -8.390  13.734  -8.761  1.00  8.90           H  
ATOM    796  HE1 TRP A  50      -8.593  11.924  -7.052  1.00  8.90           H  
ATOM    797  HE3 TRP A  50      -4.768  15.363  -5.613  1.00  8.90           H  
ATOM    798  HZ2 TRP A  50      -7.349  11.250  -4.610  1.00  8.90           H  
ATOM    799  HZ3 TRP A  50      -4.321  14.098  -3.576  1.00  8.90           H  
ATOM    800  HH2 TRP A  50      -5.612  12.061  -3.081  1.00  8.90           H  
ATOM    801  N   VAL A  51      -5.345  13.392 -10.086  1.00  5.26           N  
ATOM    802  CA  VAL A  51      -5.737  12.400 -11.033  1.00  5.56           C  
ATOM    803  C   VAL A  51      -6.593  11.357 -10.323  1.00  5.73           C  
ATOM    804  O   VAL A  51      -6.193  10.797  -9.303  1.00  6.13           O  
ATOM    805  CB  VAL A  51      -4.488  11.795 -11.689  1.00  7.67           C  
ATOM    806  CG1 VAL A  51      -4.882  10.802 -12.614  1.00  7.67           C  
ATOM    807  CG2 VAL A  51      -3.716  12.865 -12.400  1.00  7.67           C  
ATOM    808  H   VAL A  51      -4.889  13.087  -9.239  1.00  6.31           H  
ATOM    809  HA  VAL A  51      -6.332  12.871 -11.807  1.00  6.67           H  
ATOM    810  HB  VAL A  51      -3.862  11.327 -10.932  1.00  9.20           H  
ATOM    811 1HG1 VAL A  51      -4.010  10.359 -13.079  1.00  9.20           H  
ATOM    812 2HG1 VAL A  51      -5.408  10.079 -12.097  1.00  9.20           H  
ATOM    813 3HG1 VAL A  51      -5.521  11.237 -13.363  1.00  9.20           H  
ATOM    814 1HG2 VAL A  51      -2.848  12.433 -12.877  1.00  9.20           H  
ATOM    815 2HG2 VAL A  51      -4.345  13.322 -13.142  1.00  9.20           H  
ATOM    816 3HG2 VAL A  51      -3.400  13.616 -11.693  1.00  9.20           H  
ATOM    817  N   GLY A  52      -7.774  11.115 -10.870  1.00  5.82           N  
ATOM    818  CA  GLY A  52      -8.747  10.160 -10.330  1.00  6.39           C  
ATOM    819  C   GLY A  52     -10.106  10.572 -10.858  1.00  6.41           C  
ATOM    820  O   GLY A  52     -10.181  11.476 -11.685  1.00  6.85           O  
ATOM    821  H   GLY A  52      -8.010  11.649 -11.714  1.00  6.98           H  
ATOM    822 1HA  GLY A  52      -8.507   9.143 -10.651  1.00  7.67           H  
ATOM    823 2HA  GLY A  52      -8.740  10.179  -9.241  1.00  7.67           H  
ATOM    824  N   THR A  53     -11.199   9.951 -10.442  1.00  6.33           N  
ATOM    825  CA  THR A  53     -12.436  10.415 -11.072  1.00  6.77           C  
ATOM    826  C   THR A  53     -12.676  11.903 -10.799  1.00  6.79           C  
ATOM    827  O   THR A  53     -12.800  12.318  -9.648  1.00  7.09           O  
ATOM    828  CB  THR A  53     -13.660   9.579 -10.628  1.00  9.31           C  
ATOM    829  OG1 THR A  53     -13.456   8.203 -10.990  1.00  9.31           O  
ATOM    830  CG2 THR A  53     -14.923  10.085 -11.315  1.00  9.31           C  
ATOM    831  H   THR A  53     -11.167   9.192  -9.749  1.00  7.60           H  
ATOM    832  HA  THR A  53     -12.340  10.293 -12.136  1.00  8.12           H  
ATOM    833  HB  THR A  53     -13.775   9.650  -9.546  1.00 11.17           H  
ATOM    834  HG1 THR A  53     -14.116   7.652 -10.562  1.00 11.17           H  
ATOM    835 1HG2 THR A  53     -15.772   9.481 -10.998  1.00 11.17           H  
ATOM    836 2HG2 THR A  53     -15.109  11.125 -11.048  1.00 11.17           H  
ATOM    837 3HG2 THR A  53     -14.804  10.005 -12.395  1.00 11.17           H  
ATOM    838  N   GLY A  54     -12.770  12.707 -11.874  1.00  6.80           N  
ATOM    839  CA  GLY A  54     -13.013  14.150 -11.778  1.00  7.17           C  
ATOM    840  C   GLY A  54     -11.759  14.985 -11.481  1.00  6.91           C  
ATOM    841  O   GLY A  54     -11.828  16.214 -11.422  1.00  7.35           O  
ATOM    842  H   GLY A  54     -12.642  12.325 -12.816  1.00  8.16           H  
ATOM    843 1HA  GLY A  54     -13.452  14.492 -12.716  1.00  8.60           H  
ATOM    844 2HA  GLY A  54     -13.758  14.339 -11.005  1.00  8.60           H  
ATOM    845  N   GLY A  55     -10.611  14.344 -11.309  1.00  6.50           N  
ATOM    846  CA  GLY A  55      -9.392  15.081 -10.994  1.00  6.62           C  
ATOM    847  C   GLY A  55      -9.687  15.948  -9.769  1.00  6.23           C  
ATOM    848  O   GLY A  55     -10.245  15.468  -8.782  1.00  6.54           O  
ATOM    849  H   GLY A  55     -10.607  13.328 -11.415  1.00  7.80           H  
ATOM    850 1HA  GLY A  55      -8.586  14.379 -10.797  1.00  7.94           H  
ATOM    851 2HA  GLY A  55      -9.074  15.680 -11.833  1.00  7.94           H  
ATOM    852  N   LEU A  56      -9.369  17.251  -9.831  1.00  5.88           N  
ATOM    853  CA  LEU A  56      -9.670  18.151  -8.704  1.00  5.87           C  
ATOM    854  C   LEU A  56     -11.098  18.699  -8.678  1.00  5.38           C  
ATOM    855  O   LEU A  56     -11.434  19.471  -7.776  1.00  5.65           O  
ATOM    856  CB  LEU A  56      -8.782  19.406  -8.712  1.00  8.22           C  
ATOM    857  CG  LEU A  56      -7.295  19.288  -8.443  1.00  8.22           C  
ATOM    858  CD1 LEU A  56      -6.647  20.650  -8.696  1.00  8.22           C  
ATOM    859  CD2 LEU A  56      -7.067  18.902  -6.970  1.00  8.22           C  
ATOM    860  H   LEU A  56      -8.863  17.608 -10.649  1.00  7.06           H  
ATOM    861  HA  LEU A  56      -9.516  17.592  -7.785  1.00  7.04           H  
ATOM    862 1HB  LEU A  56      -8.882  19.834  -9.683  1.00  9.86           H  
ATOM    863 2HB  LEU A  56      -9.185  20.117  -7.994  1.00  9.86           H  
ATOM    864  HG  LEU A  56      -6.855  18.555  -9.108  1.00  9.86           H  
ATOM    865 1HD1 LEU A  56      -5.589  20.600  -8.490  1.00  9.86           H  
ATOM    866 2HD1 LEU A  56      -6.803  20.958  -9.718  1.00  9.86           H  
ATOM    867 3HD1 LEU A  56      -7.097  21.386  -8.031  1.00  9.86           H  
ATOM    868 1HD2 LEU A  56      -5.992  18.837  -6.777  1.00  9.86           H  
ATOM    869 2HD2 LEU A  56      -7.504  19.665  -6.327  1.00  9.86           H  
ATOM    870 3HD2 LEU A  56      -7.530  17.952  -6.745  1.00  9.86           H  
ATOM    871  N   VAL A  57     -11.913  18.393  -9.685  1.00  5.03           N  
ATOM    872  CA  VAL A  57     -13.254  18.951  -9.739  1.00  4.91           C  
ATOM    873  C   VAL A  57     -14.334  17.868  -9.886  1.00  5.03           C  
ATOM    874  O   VAL A  57     -14.491  17.300 -10.978  1.00  5.19           O  
ATOM    875  CB  VAL A  57     -13.351  19.939 -10.898  1.00  6.92           C  
ATOM    876  CG1 VAL A  57     -14.713  20.504 -10.984  1.00  6.92           C  
ATOM    877  CG2 VAL A  57     -12.359  21.045 -10.695  1.00  6.92           C  
ATOM    878  H   VAL A  57     -11.615  17.709 -10.385  1.00  6.04           H  
ATOM    879  HA  VAL A  57     -13.381  19.515  -8.829  1.00  5.89           H  
ATOM    880  HB  VAL A  57     -13.140  19.429 -11.836  1.00  8.30           H  
ATOM    881 1HG1 VAL A  57     -14.698  21.174 -11.791  1.00  8.30           H  
ATOM    882 2HG1 VAL A  57     -15.439  19.737 -11.160  1.00  8.30           H  
ATOM    883 3HG1 VAL A  57     -14.953  21.041 -10.073  1.00  8.30           H  
ATOM    884 1HG2 VAL A  57     -12.435  21.738 -11.524  1.00  8.30           H  
ATOM    885 2HG2 VAL A  57     -12.573  21.566  -9.764  1.00  8.30           H  
ATOM    886 3HG2 VAL A  57     -11.368  20.641 -10.653  1.00  8.30           H  
ATOM    887  N   PRO A  58     -15.255  17.737  -8.904  1.00  5.39           N  
ATOM    888  CA  PRO A  58     -16.256  16.691  -8.837  1.00  5.93           C  
ATOM    889  C   PRO A  58     -17.224  16.644 -10.012  1.00  5.99           C  
ATOM    890  O   PRO A  58     -17.773  15.573 -10.280  1.00  5.96           O  
ATOM    891  CB  PRO A  58     -16.991  17.005  -7.523  1.00  8.91           C  
ATOM    892  CG  PRO A  58     -16.738  18.465  -7.256  1.00  8.91           C  
ATOM    893  CD  PRO A  58     -15.357  18.732  -7.799  1.00  8.91           C  
ATOM    894  HA  PRO A  58     -15.734  15.725  -8.751  1.00  7.12           H  
ATOM    895 1HB  PRO A  58     -18.061  16.783  -7.635  1.00 10.69           H  
ATOM    896 2HB  PRO A  58     -16.615  16.354  -6.719  1.00 10.69           H  
ATOM    897 1HG  PRO A  58     -17.515  19.076  -7.741  1.00 10.69           H  
ATOM    898 2HG  PRO A  58     -16.813  18.665  -6.174  1.00 10.69           H  
ATOM    899 1HD  PRO A  58     -15.367  19.766  -8.158  1.00 10.69           H  
ATOM    900 2HD  PRO A  58     -14.580  18.555  -7.032  1.00 10.69           H  
ATOM    901  N   ARG A  59     -17.427  17.754 -10.747  1.00  6.44           N  
ATOM    902  CA  ARG A  59     -18.327  17.651 -11.879  1.00  6.87           C  
ATOM    903  C   ARG A  59     -17.774  18.282 -13.163  1.00  7.09           C  
ATOM    904  O   ARG A  59     -18.525  18.872 -13.939  1.00  7.57           O  
ATOM    905  CB  ARG A  59     -19.658  18.324 -11.550  1.00  9.45           C  
ATOM    906  CG  ARG A  59     -20.480  17.676 -10.426  1.00  9.45           C  
ATOM    907  CD  ARG A  59     -21.027  16.339 -10.796  1.00  9.45           C  
ATOM    908  NE  ARG A  59     -21.838  15.788  -9.727  1.00  9.45           N  
ATOM    909  CZ  ARG A  59     -21.374  15.043  -8.694  1.00  9.45           C  
ATOM    910  NH1 ARG A  59     -20.086  14.749  -8.573  1.00  9.45           N  
ATOM    911  NH2 ARG A  59     -22.231  14.600  -7.783  1.00  9.45           N  
ATOM    912  H   ARG A  59     -17.014  18.651 -10.539  1.00  7.73           H  
ATOM    913  HA  ARG A  59     -18.498  16.599 -12.092  1.00  8.24           H  
ATOM    914 1HB  ARG A  59     -19.473  19.358 -11.266  1.00 11.34           H  
ATOM    915 2HB  ARG A  59     -20.288  18.338 -12.439  1.00 11.34           H  
ATOM    916 1HG  ARG A  59     -19.870  17.567  -9.536  1.00 11.34           H  
ATOM    917 2HG  ARG A  59     -21.325  18.322 -10.195  1.00 11.34           H  
ATOM    918 1HD  ARG A  59     -21.660  16.448 -11.677  1.00 11.34           H  
ATOM    919 2HD  ARG A  59     -20.235  15.638 -11.018  1.00 11.34           H  
ATOM    920  HE  ARG A  59     -22.831  15.974  -9.759  1.00 11.34           H  
ATOM    921 1HH1 ARG A  59     -19.384  15.073  -9.263  1.00 11.34           H  
ATOM    922 2HH1 ARG A  59     -19.771  14.192  -7.795  1.00 11.34           H  
ATOM    923 1HH2 ARG A  59     -23.215  14.818  -7.866  1.00 11.34           H  
ATOM    924 2HH2 ARG A  59     -21.905  14.043  -7.006  1.00 11.34           H  
ATOM    925  N   GLY A  60     -16.478  18.092 -13.430  1.00  7.02           N  
ATOM    926  CA  GLY A  60     -15.889  18.445 -14.733  1.00  7.53           C  
ATOM    927  C   GLY A  60     -15.529  19.904 -15.073  1.00  7.21           C  
ATOM    928  O   GLY A  60     -15.105  20.164 -16.202  1.00  7.61           O  
ATOM    929  H   GLY A  60     -15.877  17.662 -12.715  1.00  8.42           H  
ATOM    930 1HA  GLY A  60     -14.982  17.851 -14.843  1.00  9.04           H  
ATOM    931 2HA  GLY A  60     -16.561  18.079 -15.507  1.00  9.04           H  
ATOM    932  N   SER A  61     -15.718  20.852 -14.165  1.00  6.79           N  
ATOM    933  CA  SER A  61     -15.421  22.252 -14.463  1.00  6.82           C  
ATOM    934  C   SER A  61     -13.919  22.495 -14.363  1.00  6.66           C  
ATOM    935  O   SER A  61     -13.143  21.576 -14.093  1.00  6.80           O  
ATOM    936  CB  SER A  61     -16.215  23.212 -13.580  1.00  9.54           C  
ATOM    937  OG  SER A  61     -15.786  23.202 -12.259  1.00  9.54           O  
ATOM    938  H   SER A  61     -16.062  20.612 -13.249  1.00  8.15           H  
ATOM    939  HA  SER A  61     -15.719  22.450 -15.492  1.00  8.18           H  
ATOM    940 1HB  SER A  61     -16.134  24.219 -13.980  1.00 11.45           H  
ATOM    941 2HB  SER A  61     -17.267  22.934 -13.619  1.00 11.45           H  
ATOM    942  HG  SER A  61     -16.348  23.824 -11.789  1.00 11.45           H  
ATOM    943  N   ALA A  62     -13.476  23.702 -14.707  1.00  6.72           N  
ATOM    944  CA  ALA A  62     -12.046  23.981 -14.693  1.00  6.90           C  
ATOM    945  C   ALA A  62     -11.422  23.744 -13.326  1.00  6.89           C  
ATOM    946  O   ALA A  62     -11.945  24.169 -12.296  1.00  7.16           O  
ATOM    947  CB  ALA A  62     -11.787  25.415 -15.112  1.00  9.59           C  
ATOM    948  H   ALA A  62     -14.133  24.428 -14.947  1.00  8.06           H  
ATOM    949  HA  ALA A  62     -11.568  23.306 -15.402  1.00  8.28           H  
ATOM    950 1HB  ALA A  62     -10.711  25.596 -15.125  1.00 11.51           H  
ATOM    951 2HB  ALA A  62     -12.198  25.587 -16.105  1.00 11.51           H  
ATOM    952 3HB  ALA A  62     -12.259  26.090 -14.400  1.00 11.51           H  
ATOM    953  N   ALA A  63     -10.254  23.117 -13.349  1.00  6.94           N  
ATOM    954  CA  ALA A  63      -9.476  22.806 -12.161  1.00  7.28           C  
ATOM    955  C   ALA A  63      -8.286  23.729 -12.020  1.00  7.69           C  
ATOM    956  O   ALA A  63      -7.752  24.218 -13.018  1.00  8.06           O  
ATOM    957  CB  ALA A  63      -8.993  21.387 -12.233  1.00 10.06           C  
ATOM    958  H   ALA A  63      -9.902  22.815 -14.244  1.00  8.33           H  
ATOM    959  HA  ALA A  63     -10.110  22.938 -11.285  1.00  8.74           H  
ATOM    960 1HB  ALA A  63      -8.427  21.160 -11.357  1.00 12.07           H  
ATOM    961 2HB  ALA A  63      -9.838  20.722 -12.307  1.00 12.07           H  
ATOM    962 3HB  ALA A  63      -8.370  21.279 -13.106  1.00 12.07           H  
ATOM    963  N   ALA A  64      -7.851  23.928 -10.783  1.00  7.92           N  
ATOM    964  CA  ALA A  64      -6.666  24.716 -10.498  1.00  8.62           C  
ATOM    965  C   ALA A  64      -6.091  24.305  -9.153  1.00  9.18           C  
ATOM    966  O   ALA A  64      -4.900  24.473  -8.895  1.00  9.71           O  
ATOM    967  OXT ALA A  64      -6.838  23.814  -8.310  1.00 12.92           O  
ATOM    968  CB  ALA A  64      -7.004  26.195 -10.504  1.00 11.22           C  
ATOM    969  H   ALA A  64      -8.362  23.523 -10.010  1.00  9.50           H  
ATOM    970  HA  ALA A  64      -5.920  24.512 -11.266  1.00 10.34           H  
ATOM    971 1HB  ALA A  64      -6.103  26.773 -10.301  1.00 13.46           H  
ATOM    972 2HB  ALA A  64      -7.401  26.472 -11.484  1.00 13.46           H  
ATOM    973 3HB  ALA A  64      -7.750  26.402  -9.738  1.00 13.46           H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE best_scoring0001_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -321.757 35.2413 248.237 -20.2601 4.96505 16.9411 119.428 -137.211 -0.43787 -3.00931 -106.866 -22.0972 -28.5668 -11.2608 -15.2872 -9.79126 0 -0.06736 3.13074 25.1617 61.1554 -20.7744 8.91058 -10.2486 -6.99888 38.5693 -152.893
ASP:NtermProteinFull_1 -2.66729 0.04342 4.12682 -0.14117 0.02315 0.47628 2.0423 -1.66961 -0.01574 -0.14817 -3.19741 -1.19308 0 0 -1.12843 -0.95502 0 0.00549 0.04344 0 2.572 0 0 -2.3716 0 0.23517 -3.91944
VAL_2 -6.17629 1.18912 2.29531 -0.27287 0.19351 0.0517 1.2648 -1.83025 -0 -0 -1.28668 0.08159 0 0 -1.04334 0 0 -0.0793 0.06886 0.16244 0 -0.49275 0 1.9342 -0.20807 0.56347 -3.58456
SER_3 -4.47412 0.31779 6.2626 -0.04197 1e-05 0.0747 3.44008 -2.72186 -0.0118 -0.11245 -4.62449 -0.11923 0 0 -1.16076 -0.56 0 0.07569 0.00028 0.16136 0 -0.44423 1.74826 -0.77834 -0.46685 0.65024 -2.78509
GLU_4 -3.89013 0.25716 3.64306 -0.45955 0.26455 1.44802 1.87238 -1.86769 -0.02712 -0.16342 -1.29161 -3.01691 0 0 0 0 0 -0.0359 0.00656 0 4.04427 -0.19118 0 -2.7348 -0.51244 0.51253 -2.1422
GLU_5 -4.55836 0.35134 5.47354 -0.22021 0.02606 0.29649 2.16015 -2.49494 -0.02712 -0.16342 -2.04869 -0.6107 0 0 0 -0.59729 0 0.00575 0.09965 0 3.28094 -0.2386 0 -2.7348 -0.46505 0.34455 -2.1207
GLU_6 -6.97569 0.61857 7.83554 -0.2232 0.03892 0.33752 3.76517 -3.57764 -0.01529 -0.14694 -3.85617 -0.54634 0 0 -1.16076 -0.56 0 -0.0364 0.17793 0 3.6368 -0.28777 0 -2.7348 -0.50123 0.30614 -3.90564
ASP_7 -7.2833 0.56787 7.7966 -0.22058 0.01137 0.74574 3.59926 -3.77117 -0.00716 -0.08097 -5.6415 0.01276 0 0 0 -0.91286 0 0.00048 0.01062 0 4.09188 0.30868 0 -2.3716 -0.12899 0.46749 -2.8054
PHE_8 -7.21435 0.43126 5.11266 -0.58797 0.37327 0.31438 3.24408 -3.0521 -0.00419 -0.03025 -1.87076 -0.36974 0 0 0 0 0 0.05447 0.58351 0 3.3335 -0.1187 0 1.0402 0.07048 0.51704 1.82681
ARG_9 -7.00215 0.40125 8.11236 -0.68186 0.09673 0.42454 3.45362 -3.64614 -0 -0 -3.58486 0.29186 0 0 0 -0.59729 0 0.01562 0.2205 1.43793 0 -0.09776 0 -1.2888 -0.31101 0.47168 -2.28379
LEU_10 -9.09464 0.83157 5.83543 -0.46729 0.14394 0.10178 3.50014 -3.55306 -0 -0 -3.23963 0.20884 0 0 0 0 0 0.04743 0.00651 0.4073 0 -0.25772 0 0.18072 -0.35725 0.62201 -5.08389
ALA_11 -6.59774 0.39145 4.12186 -0.0196 0 0 3.03662 -3.08901 -0 -0 -2.21411 -0.35287 0 0 0 0 0 -0.03461 0 0 0 -0.08829 0 1.8394 -0.20302 0.55889 -2.65101
CYS_12 -6.01763 0.60803 4.76775 -0.04825 5e-05 0.01926 2.1368 -2.49767 -0.01313 -0.07628 -2.08391 -0.41648 0 0 0 0 0 -0.04288 0.01609 0.29984 0 0.28491 0 3.6196 -0.03651 0.38285 0.90243
ARG_13 -5.0451 0.45936 5.76859 -0.51171 0.11568 0.31234 1.76983 -2.37653 -0 -0 -2.64949 0.21338 0 0 0 -0.78272 0 -0.0425 0.00511 1.94288 0 -0.05459 0 -1.2888 -0.252 0.53742 -1.87886
HIS_14 -5.68844 0.52407 3.87159 -0.41554 0.22689 0.46311 1.78657 -2.42321 -0 -0 -2.05233 -0.20649 0 0 -0.75105 0 0 -0.07407 0.22852 0 2.94163 -0.43245 0 -0.45461 -0.49988 0.76981 -2.18588
GLU_15 -5.20724 0.53291 5.23135 -0.19331 0.02678 0.26945 1.84296 -2.27445 -0.00065 -0.01052 -2.48668 -0.42683 0 0 0 -0.78272 0 0.01376 0.05356 0 3.07493 0.02169 0 -2.7348 -0.23065 0.67491 -2.60553
ARG_16 -3.71462 0.12921 3.36212 -0.45819 0.04224 0.23094 1.06632 -1.48701 -0 -0 -2.24192 0.5249 0 0 0 -1.08775 0 -0.04659 0.02593 2.27201 0 -0.03698 0 -1.2888 -0.29502 0.69463 -2.30858
TYR_17 -8.80707 0.79003 3.40981 -0.57853 0.07037 0.25923 2.7167 -2.4734 -0.00203 -0.04305 -2.19689 -0.10264 0 0 -1.16755 -0.48201 0 0.50124 0.16676 0 2.10921 -0.37287 0.01555 1.2797 -0.08342 1.30112 -3.68973
PRO_18 -4.14898 0.66224 2.49358 -0.13633 0.00373 0.09849 1.02673 -1.18101 -0 -0 -0.90026 0.17897 0 0 0 0 0 -0.07167 0.0124 0.2033 0 -0.99648 0 -2.4119 -0.22703 1.14852 -4.24571
THR_19 -2.30203 0.18041 1.7143 -0.12307 0.0648 0.06197 0.6496 -0.95856 -0 -0 -0.44194 -1.12426 0 0 0 0 0 -0.01185 0.03669 0.06215 0 0.01378 2.26975 -1.0874 -0.51385 0.38692 -1.12258
ARG_20 -3.35649 0.39054 4.5079 -0.94743 0.18352 0.71309 2.17535 -1.86957 -0 -0 -3.00251 0.16351 0 0 0 -0.95502 0 -0.05795 0.08176 2.04462 0 -0.04013 0 -1.2888 -0.36291 0.48039 -1.14013
HIS_21 -6.4165 0.4699 6.60082 -0.60012 0.02159 0.5903 3.20724 -3.04313 -0.0005 -0.00269 -3.44067 -0.61148 0 0 -2.17177 -0.43085 0 -0.01309 0.00082 0 2.57861 -0.24744 0 -0.45461 0.01291 0.75629 -3.19435
GLN_22 -4.15586 0.68435 3.95503 -0.57255 0.05525 0.53106 1.21384 -1.96405 -0 -0 -1.51463 -0.1311 0 0 0 0 0 0.12238 0.00261 0 2.5915 0.11487 0 -0.18838 0.06891 1.16389 1.97713
PRO_23 -4.25653 0.79256 2.5833 -0.12618 0.00152 0.08987 0.99245 -1.20927 -0 -0 -0.85276 0.25631 0 0 -0.73749 0 0 0.10349 0.00044 0.13186 0 -1.11352 0 -2.4119 -0.56682 0.89299 -5.42967
HIS_D_24 -4.04334 0.37363 4.57658 -0.48842 0.02605 0.36227 1.63847 -2.12956 -0 -0 -1.6476 -0.27112 0 0 -0.9213 0 0 -0.06124 0.13422 0 1.51523 -0.00311 0 -0.45461 -0.47991 0.23531 -1.63844
MET_25 -6.20527 0.57138 3.12011 -0.21014 0.03031 0.06826 0.96429 -1.84685 -0 -0 -1.2919 0.01491 0 0 -0.9213 0 0 -0.06809 0.10053 2.00017 0 0.29138 0 0.60916 -0.34813 0.2179 -2.90328
GLY_26 -3.03425 0.15657 3.85844 -0.0015 0 0 1.63454 -1.84035 -0 -0 -1.01902 -0.33264 0 0 0 0 0 -0.04175 0 0 0 -1.47401 0 0.83697 0.15479 0.22666 -0.87556
ASP_27 -2.85871 0.37154 3.19821 -0.18678 0.16238 0.62365 1.09929 -1.50828 -0.00714 -0.0484 -1.52133 -2.57859 0 0 -0.26475 0 0 -0.05073 0.10067 0 4.32837 0.0172 0 -2.3716 0.16459 0.59188 -0.73855
SER_28 -2.34333 0.27749 2.85485 -0.03036 0.00093 0.04997 0.74745 -1.29447 -0.00714 -0.0484 -1.39066 -0.91102 0 0 -0.26475 0 0 -0.06323 6e-05 0.16794 0 -0.3079 0.60024 -0.77834 -0.53305 0.67874 -2.59498
TRP_29 -7.15701 1.08302 5.9504 -0.97908 0.09239 0.37657 2.62347 -2.8798 -0.01173 -0.13121 -0.83552 -0.23572 0 0 0 0 0 -0.07125 0.00186 0 1.81027 -0.01427 0 1.6906 0.64137 1.20908 3.16344
PRO_30 -3.06093 0.50488 2.41704 -0.06765 0 0.04191 1.2706 -1.00839 -0 -0 -1.2156 0.59923 0 0 0 0 0 -0.16269 0.02564 0.20175 0 -0.48378 0 -2.4119 1.04282 1.25191 -1.05516
ARG_31 -3.89645 0.43598 3.71409 -0.78132 0.26367 0.48026 1.47531 -1.85477 -0.02255 -0.15609 -0.18512 0.08074 0 0 0 0 0 -0.00446 0.01266 2.48988 0 -0.06519 0 -1.2888 0.40851 0.4821 1.58845
SER_32 -4.56711 0.52418 4.77422 -0.02447 0 0.02337 2.19673 -2.12842 -0.02932 -0.15502 -1.65931 -0.32598 0 0 -0.73749 0 0 0.00076 0.04055 1.11376 0 -0.01843 0.67873 -0.77834 -0.00809 0.57717 -0.50252
SER_33 -5.79133 0.47687 6.30351 -0.0329 0.00042 0.05697 3.1935 -3.10641 -0.00547 -0.07304 -2.57162 -1.03569 0 0 0 0 0 -0.10206 0.04663 0.14959 0 -0.34715 0.71553 -0.77834 -0.589 0.57297 -2.91702
ALA_34 -5.65589 0.92684 3.05724 -0.02425 0 0 2.67091 -2.65964 -0 -0 -1.85969 -0.38489 0 0 0 0 0 -0.06122 0 0 0 -0.38041 0 1.8394 -0.59487 0.37532 -2.75115
HIS_35 -8.00937 0.54811 6.54883 -0.69536 0.02398 0.68779 3.39388 -3.25518 -0.03184 -0.23628 -2.20615 -0.38178 0 0 -1.16755 0 0 0.00766 0.04178 0 1.54097 -0.33459 0 -0.45461 -0.14462 0.31213 -3.81219
GLU_36 -5.68607 0.30983 6.03318 -0.21122 0.03357 0.30158 2.12324 -2.88206 -0.03429 -0.22537 -1.75063 -0.6041 0 0 0 0 0 -0.04096 0.02494 0 3.0343 -0.28276 0 -2.7348 -0.06922 0.23617 -2.42468
ALA_37 -7.25411 1.38503 3.71066 -0.02326 0 0 3.07396 -3.11148 -0 -0 -2.72406 -0.34295 0 0 0 0 0 -0.00261 0 0 0 -0.146 0 1.8394 -0.37182 0.41437 -3.55289
ALA_38 -4.71602 0.28386 2.98225 -0.02112 0 0 1.78079 -2.29249 -0 -0 -1.3167 -0.34842 0 0 0 0 0 -0.00775 0 0 0 -0.17255 0 1.8394 -0.25406 0.49305 -1.74976
GLU_39 -3.99607 0.1337 5.33634 -0.4427 0.05483 0.86394 1.95406 -2.22504 -0.01066 -0.11273 -2.41205 -0.49149 0 0 0 -1.08775 0 -0.02837 0.01314 0 3.38373 -0.31639 0 -2.7348 -0.39835 0.29063 -2.22605
LEU_40 -4.79824 0.47619 3.65913 -0.49909 0.14928 0.13356 1.45724 -1.90936 -0 -0 -0.71429 0.18671 0 0 0 0 0 0.21837 0.14647 0.24797 0 -0.25567 0 0.18072 -0.37502 0.48789 -1.20814
ASN_41 -2.93522 0.25162 2.95643 -0.32674 0.0605 0.66788 1.66214 -1.55681 -0 -0 -1.02891 -0.8984 0 0 0 0 0 -0.00319 0.00847 0 1.66715 -1.01391 0 -0.93687 -0.51252 0.61395 -1.32444
ARG_42 -7.54606 0.5988 5.61165 -0.85236 0.21638 0.462 2.6138 -2.68414 -0 -0 -2.37079 0.39512 0 0 0 0 0 0.02575 0.11443 2.87746 0 0.0652 0 -1.2888 -0.3913 0.64702 -1.50582
GLN_43 -2.48136 0.23303 2.7449 -0.96475 0.21167 1.12469 1.06024 -1.34571 -0.01382 -0.0713 0.28817 -1.07238 0 0 0 0 0 -0.07692 0.02939 0 2.88447 -0.22264 0 -0.18838 -0.17903 0.62885 2.58912
CYS_44 -4.66747 0.42215 2.83298 -0.08966 0.00186 0.04717 0.88012 -1.51057 -0.01878 -0.09524 -1.38273 -0.36417 0 0 0 0 0 -0.03984 0.02869 0.56511 0 0.16268 0 3.6196 -0.43403 0.38874 0.34662
TRP_45 -12.2228 1.98319 5.31668 -0.70004 0.16686 0.41999 3.2329 -3.76625 -0.00911 -0.06017 -2.1103 -0.18278 0 0 0 0 0 -0.02642 0.00031 0 2.76479 -0.1683 0 1.6906 0.52991 0.47685 -2.66415
VAL_46 -6.68531 0.69792 2.2168 -0.29373 0.19787 0.07232 1.39835 -2.30477 -0.01382 -0.0713 -0.9437 -0.4525 0 0 0 0 0 -0.03098 0.0004 0.13544 0 -0.28415 0 1.9342 0.87296 0.46009 -3.09391
LEU_47 -7.55742 0.84896 3.8655 -0.45148 0.10479 0.13917 2.56969 -3.00347 -0 -0 -1.71687 -0.03539 0 0 0 0 0 -0.05581 0.05565 1.80508 0 -0.02834 0 0.18072 0.46617 0.68373 -2.12931
GLY_48 -2.46681 0.12973 1.78587 -0.00023 0 0 0.76107 -1.1546 -0 -0 -0.91585 -0.30094 0 0 -0.75105 0 0 -0.17308 0 0 0 -1.36929 0 0.83697 0.52902 0.59834 -2.49086
HIS_D_49 -4.39187 0.52018 2.76158 -0.44525 0.02978 0.58713 1.21449 -1.66399 -0.01313 -0.07628 -1.51904 -0.29626 0 0 0 0 0 0.32344 0.13296 0 1.59814 -0.65046 0 -0.45461 0.66724 0.3255 -1.35044
TRP_50 -10.6719 1.39338 4.84779 -0.93163 0.04756 0.21334 1.65632 -3.60403 -0.01592 -0.05555 -1.29461 -0.85947 0 0 0 0 0 -0.01843 0.00292 0 2.37267 -0.20085 0 1.6906 1.1738 0.66002 -3.59397
VAL_51 -8.41014 1.48281 1.01101 -0.27994 0.24165 0.05669 1.6909 -2.46121 -0 -0 -0.34235 -0.31938 0 0 0 0 0 -0.08041 0.00892 0.24773 0 -0.76272 0 1.9342 0.44 0.78091 -4.76133
GLY_52 -4.21878 0.29341 4.05608 -0.00248 0 0 2.34826 -2.25819 -0.00802 -0.0384 -2.29853 -0.41055 0 0 0 0 0 -0.11785 0 0 0 -1.53793 0 0.83697 0.09331 0.89399 -2.36871
THR_53 -2.67607 0.43316 2.81334 -0.17428 0.09453 0.06577 1.29195 -1.38842 -0.02084 -0.19138 -0.90608 -0.09521 0 0 0 0 0 -0.02469 0.02389 0.02957 0 0.16352 2.2823 -1.0874 0.37364 0.66579 1.67308
GLY_54 -3.64429 0.33301 3.64695 -5e-05 0 0 2.26005 -2.04068 -0 -0 -1.97934 -0.38487 0 0 0 0 0 -0.17743 0 0 0 -1.43405 0 0.83697 -0.44779 0.32145 -2.71007
GLY_55 -4.82919 0.77542 3.8833 -0.00019 0 0 1.35527 -2.32561 -0.01076 -0.05684 -0.70717 -0.27565 0 0 0 0 0 -0.07361 0 0 0 -1.32214 0 0.83697 -0.49182 0.36294 -2.87908
LEU_56 -6.36011 0.93224 3.22839 -0.52878 0.21194 0.1732 1.71745 -2.15167 -0.01592 -0.05555 -0.93152 0.12748 0 0 0 0 0 -0.04208 0.14552 0.10496 0 -0.13023 0 0.18072 -0.2641 0.78851 -2.86955
VAL_57 -6.61001 1.32646 3.66966 -0.29505 0.27542 0.07399 2.53568 -2.70897 -0 -0 -1.57913 -0.61305 0 0 0 0 0 0.07629 0.00019 0.20515 0 -0.626 0 1.9342 -0.24048 1.60816 -0.96747
PRO_58 -2.68188 0.56887 1.6276 -0.08536 4e-05 0.05318 0.74145 -0.73566 -0 -0 -0.58601 0.68501 0 0 -0.46892 0 0 -0.05591 0.00572 0.56689 0 -0.35341 0 -2.4119 -0.19356 1.51089 -1.81294
ARG_59 -2.52366 0.28612 2.50065 -0.96748 0.28215 0.7571 1.01694 -1.16834 -0.00644 -0.0363 -0.39887 -0.20173 0 0 -0.46892 0 0 0.84749 0.01197 2.97243 0 -0.23096 0 -1.2888 0.1742 0.70094 2.2585
GLY_60 -1.67418 0.03879 1.41357 -4e-05 0 0 0.51112 -0.84498 -0 -0 -0.88573 -0.34888 0 0 0 0 0 -0.19267 0 0 0 -1.4002 0 0.83697 -0.09461 0.85551 -1.78534
SER_61 -2.61246 0.47092 2.51309 -0.01956 0 0.04708 1.28471 -1.44777 -0.00644 -0.0363 0.11761 -0.66554 0 0 0 0 0 0.06453 0.02359 0.15511 0 -0.50663 0.60024 -0.77834 -0.60261 0.8463 -0.55247
ALA_62 -1.25939 0.11109 0.96195 -0.02568 0.00029 0 0.11217 -0.63728 -0 -0 0.3844 -0.24811 0 0 0 0 0 -0.0831 0 0 0 0.0081 0 1.8394 -0.508 0.32316 0.97899
ALA_63 -3.20677 0.55563 -0.08476 -0.02399 0 0 0.24351 -0.87653 -0 -0 0.10445 -0.25305 0 0 0 0 0 0.00817 0 0 0 0.12946 0 1.8394 -0.27795 0.19804 -1.6444
ALA:CtermProteinFull_64 -1.29931 0.09085 1.07949 -0.03422 0 0 0.00874 -0.60725 -0 -0 -0.82215 -0.36769 0 0 0 0 0 0 0 0 0 0 0 1.8394 0.14242 0.13741 0.16768
#END_POSE_ENERGIES_TABLE best_scoring0001_0001.pdb

ENDMDL

REMARK ID 142574 DOMAINID 138915 MODEL 5 2021-10-23_00000171_1_11
MODEL     5
REMARK    Rerank model04.pdb to model05.pdb score: 14.361
REMARK    CLUSTER 0004 t000_.out.valid.rescored.best_scoring.binary cluster_size: 19 cluster_threshold: 7.022263
REMARK    SCORE     description: cluster0004_0001
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE       dslf_fa13:          -1.028
REMARK    SCORE          fa_rep:          29.943
REMARK    SCORE          fa_dun:          81.083
REMARK    SCORE     hbond_lr_bb:          -5.000
REMARK    SCORE          fa_atr:        -305.187
REMARK    SCORE         p_aa_pp:         -11.045
REMARK    SCORE     total_score:         -97.064
REMARK    SCORE             ref:          13.118
REMARK    SCORE    fa_intra_rep:           0.508
REMARK    SCORE     cart_bonded:          34.395
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE          fa_sol:         222.628
REMARK    SCORE fa_intra_sol_xover4:          13.792
REMARK    SCORE     lk_ball_wtd:          -9.460
REMARK    SCORE           score:         -97.064
REMARK    SCORE        hbond_sc:          -7.783
REMARK    SCORE     rama_prepro:         -10.076
REMARK    SCORE           omega:          -0.994
REMARK    SCORE         fa_elec:         -96.066
REMARK    SCORE     hbond_bb_sc:         -24.557
REMARK    SCORE     hbond_sr_bb:         -21.334
REMARK    SCORE            time:           0.000
SSBOND     CYS A   12    CYS A   44                                       2.04  
ATOM      1  N   ASP A   1      -0.006  -0.339  -0.340  1.00  8.820          N  
ATOM      2  CA  ASP A   1       1.436  -0.227  -0.161  1.00  8.530          C  
ATOM      3  C   ASP A   1       1.909   1.213   0.048  1.00  7.790          C  
ATOM      4  O   ASP A   1       1.883   2.071  -0.848  1.00  7.920          O  
ATOM      5  CB  ASP A   1       2.188  -0.936  -1.307  1.00 12.060          C  
ATOM      6  CG  ASP A   1       3.727  -0.984  -1.132  1.00 12.060          C  
ATOM      7  OD1 ASP A   1       4.278  -0.084  -0.499  1.00 12.060          O  
ATOM      8  OD2 ASP A   1       4.327  -1.948  -1.536  1.00 12.060          O  
ATOM      9 1H   ASP A   1      -0.182  -1.338  -0.395  1.00 10.580          H  
ATOM     10 2H   ASP A   1      -0.493  -0.002   0.486  1.00 10.580          H  
ATOM     11 3H   ASP A   1      -0.329   0.132  -1.171  1.00 10.580          H  
ATOM     12  HA  ASP A   1       1.686  -0.768   0.748  1.00 10.240          H  
ATOM     13 1HB  ASP A   1       1.822  -1.955  -1.402  1.00 14.470          H  
ATOM     14 2HB  ASP A   1       1.970  -0.426  -2.252  1.00 14.470          H  
ATOM     15  N   VAL A   2       2.307   1.442   1.288  1.00  7.300          N  
ATOM     16  CA  VAL A   2       2.767   2.695   1.866  1.00  6.870          C  
ATOM     17  C   VAL A   2       4.001   3.287   1.191  1.00  6.770          C  
ATOM     18  O   VAL A   2       4.294   4.459   1.399  1.00  7.010          O  
ATOM     19  CB  VAL A   2       2.992   2.460   3.379  1.00  9.790          C  
ATOM     20  CG1 VAL A   2       3.648   3.665   4.064  1.00  9.790          C  
ATOM     21  CG2 VAL A   2       1.631   2.154   4.019  1.00  9.790          C  
ATOM     22  H   VAL A   2       2.269   0.645   1.904  1.00  8.760          H  
ATOM     23  HA  VAL A   2       1.976   3.429   1.768  1.00  8.240          H  
ATOM     24  HB  VAL A   2       3.648   1.608   3.514  1.00 11.750          H  
ATOM     25 1HG1 VAL A   2       3.771   3.447   5.120  1.00 11.750          H  
ATOM     26 2HG1 VAL A   2       4.625   3.870   3.647  1.00 11.750          H  
ATOM     27 3HG1 VAL A   2       3.013   4.541   3.948  1.00 11.750          H  
ATOM     28 1HG2 VAL A   2       1.775   1.957   5.071  1.00 11.750          H  
ATOM     29 2HG2 VAL A   2       0.968   3.013   3.892  1.00 11.750          H  
ATOM     30 3HG2 VAL A   2       1.182   1.283   3.552  1.00 11.750          H  
ATOM     31  N   SER A   3       4.796   2.471   0.496  1.00  6.750          N  
ATOM     32  CA  SER A   3       5.992   2.988  -0.159  1.00  6.940          C  
ATOM     33  C   SER A   3       5.666   3.600  -1.522  1.00  6.670          C  
ATOM     34  O   SER A   3       6.505   4.277  -2.121  1.00  6.560          O  
ATOM     35  CB  SER A   3       7.037   1.895  -0.328  1.00  9.640          C  
ATOM     36  OG  SER A   3       6.663   0.957  -1.305  1.00  9.640          O  
ATOM     37  H   SER A   3       4.518   1.499   0.321  1.00  8.100          H  
ATOM     38  HA  SER A   3       6.415   3.771   0.471  1.00  8.330          H  
ATOM     39 1HB  SER A   3       7.986   2.349  -0.605  1.00 11.570          H  
ATOM     40 2HB  SER A   3       7.184   1.390   0.622  1.00 11.570          H  
ATOM     41  HG  SER A   3       5.891   0.463  -0.955  1.00 11.570          H  
ATOM     42  N   GLU A   4       4.444   3.361  -2.019  1.00  6.940          N  
ATOM     43  CA  GLU A   4       4.021   3.862  -3.318  1.00  7.110          C  
ATOM     44  C   GLU A   4       3.164   5.096  -3.097  1.00  6.800          C  
ATOM     45  O   GLU A   4       3.348   6.126  -3.749  1.00  6.920          O  
ATOM     46  CB  GLU A   4       3.247   2.776  -4.076  1.00  9.890          C  
ATOM     47  CG  GLU A   4       4.099   1.559  -4.481  1.00  9.890          C  
ATOM     48  CD  GLU A   4       3.288   0.413  -5.076  1.00  9.890          C  
ATOM     49  OE1 GLU A   4       2.080   0.440  -4.975  1.00  9.890          O  
ATOM     50  OE2 GLU A   4       3.875  -0.489  -5.635  1.00  9.890          O  
ATOM     51  H   GLU A   4       3.763   2.837  -1.470  1.00  8.330          H  
ATOM     52  HA  GLU A   4       4.900   4.144  -3.898  1.00  8.530          H  
ATOM     53 1HB  GLU A   4       2.430   2.414  -3.451  1.00 11.860          H  
ATOM     54 2HB  GLU A   4       2.807   3.203  -4.976  1.00 11.860          H  
ATOM     55 1HG  GLU A   4       4.848   1.879  -5.203  1.00 11.860          H  
ATOM     56 2HG  GLU A   4       4.624   1.196  -3.593  1.00 11.860          H  
ATOM     57  N   GLU A   5       2.236   4.993  -2.148  1.00  6.780          N  
ATOM     58  CA  GLU A   5       1.372   6.111  -1.802  1.00  6.860          C  
ATOM     59  C   GLU A   5       1.585   6.435  -0.329  1.00  6.220          C  
ATOM     60  O   GLU A   5       0.893   5.924   0.552  1.00  6.080          O  
ATOM     61  CB  GLU A   5      -0.094   5.800  -2.145  1.00  9.570          C  
ATOM     62  CG  GLU A   5      -0.341   5.619  -3.656  1.00  9.570          C  
ATOM     63  CD  GLU A   5      -1.794   5.381  -4.034  1.00  9.570          C  
ATOM     64  OE1 GLU A   5      -2.620   5.320  -3.160  1.00  9.570          O  
ATOM     65  OE2 GLU A   5      -2.067   5.257  -5.207  1.00  9.570          O  
ATOM     66  H   GLU A   5       2.121   4.098  -1.665  1.00  8.140          H  
ATOM     67  HA  GLU A   5       1.670   6.986  -2.378  1.00  8.230          H  
ATOM     68 1HB  GLU A   5      -0.387   4.877  -1.661  1.00 11.490          H  
ATOM     69 2HB  GLU A   5      -0.743   6.588  -1.784  1.00 11.490          H  
ATOM     70 1HG  GLU A   5       0.013   6.513  -4.169  1.00 11.490          H  
ATOM     71 2HG  GLU A   5       0.257   4.779  -4.006  1.00 11.490          H  
ATOM     72  N   GLU A   6       2.565   7.283  -0.064  1.00  6.180          N  
ATOM     73  CA  GLU A   6       2.961   7.571   1.304  1.00  6.040          C  
ATOM     74  C   GLU A   6       1.886   8.319   2.079  1.00  5.470          C  
ATOM     75  O   GLU A   6       1.307   9.281   1.577  1.00  5.620          O  
ATOM     76  CB  GLU A   6       4.263   8.381   1.307  1.00  8.510          C  
ATOM     77  CG  GLU A   6       5.507   7.618   0.786  1.00  8.510          C  
ATOM     78  CD  GLU A   6       6.775   8.452   0.828  1.00  8.510          C  
ATOM     79  OE1 GLU A   6       6.695   9.573   1.268  1.00  8.510          O  
ATOM     80  OE2 GLU A   6       7.814   7.982   0.417  1.00  8.510          O  
ATOM     81  H   GLU A   6       3.079   7.701  -0.829  1.00  7.420          H  
ATOM     82  HA  GLU A   6       3.142   6.623   1.814  1.00  7.250          H  
ATOM     83 1HB  GLU A   6       4.135   9.272   0.696  1.00 10.210          H  
ATOM     84 2HB  GLU A   6       4.475   8.713   2.327  1.00 10.210          H  
ATOM     85 1HG  GLU A   6       5.651   6.730   1.403  1.00 10.210          H  
ATOM     86 2HG  GLU A   6       5.323   7.282  -0.235  1.00 10.210          H  
ATOM     87  N   ASP A   7       1.706   7.912   3.331  1.00  5.250          N  
ATOM     88  CA  ASP A   7       0.798   8.474   4.330  1.00  5.140          C  
ATOM     89  C   ASP A   7      -0.702   8.554   3.957  1.00  4.670          C  
ATOM     90  O   ASP A   7      -1.384   9.521   4.305  1.00  4.570          O  
ATOM     91  CB  ASP A   7       1.318   9.853   4.721  1.00  7.240          C  
ATOM     92  CG  ASP A   7       2.760   9.768   5.254  1.00  7.240          C  
ATOM     93  OD1 ASP A   7       3.192   8.676   5.583  1.00  7.240          O  
ATOM     94  OD2 ASP A   7       3.406  10.781   5.347  1.00  7.240          O  
ATOM     95  H   ASP A   7       2.280   7.134   3.619  1.00  6.300          H  
ATOM     96  HA  ASP A   7       0.867   7.840   5.214  1.00  6.170          H  
ATOM     97 1HB  ASP A   7       1.286  10.524   3.861  1.00  8.690          H  
ATOM     98 2HB  ASP A   7       0.680  10.280   5.500  1.00  8.690          H  
ATOM     99  N   PHE A   8      -1.228   7.519   3.304  1.00  4.820          N  
ATOM    100  CA  PHE A   8      -2.654   7.457   2.957  1.00  4.830          C  
ATOM    101  C   PHE A   8      -3.373   6.332   3.694  1.00  4.730          C  
ATOM    102  O   PHE A   8      -2.773   5.293   3.996  1.00  4.820          O  
ATOM    103  CB  PHE A   8      -2.869   7.264   1.457  1.00  6.760          C  
ATOM    104  CG  PHE A   8      -2.523   8.426   0.609  1.00  6.760          C  
ATOM    105  CD1 PHE A   8      -1.258   8.587   0.171  1.00  6.760          C  
ATOM    106  CD2 PHE A   8      -3.485   9.352   0.226  1.00  6.760          C  
ATOM    107  CE1 PHE A   8      -0.901   9.634  -0.631  1.00  6.760          C  
ATOM    108  CE2 PHE A   8      -3.146  10.416  -0.585  1.00  6.760          C  
ATOM    109  CZ  PHE A   8      -1.843  10.555  -1.014  1.00  6.760          C  
ATOM    110  H   PHE A   8      -0.619   6.758   3.035  1.00  5.780          H  
ATOM    111  HA  PHE A   8      -3.117   8.402   3.246  1.00  5.800          H  
ATOM    112 1HB  PHE A   8      -2.259   6.439   1.121  1.00  8.110          H  
ATOM    113 2HB  PHE A   8      -3.902   7.003   1.265  1.00  8.110          H  
ATOM    114  HD1 PHE A   8      -0.524   7.872   0.475  1.00  8.110          H  
ATOM    115  HD2 PHE A   8      -4.513   9.235   0.566  1.00  8.110          H  
ATOM    116  HE1 PHE A   8       0.136   9.730  -0.954  1.00  8.110          H  
ATOM    117  HE2 PHE A   8      -3.902  11.143  -0.886  1.00  8.110          H  
ATOM    118  HZ  PHE A   8      -1.560  11.389  -1.650  1.00  8.110          H  
ATOM    119  N   ARG A   9      -4.673   6.526   3.954  1.00  4.960          N  
ATOM    120  CA  ARG A   9      -5.483   5.487   4.593  1.00  5.370          C  
ATOM    121  C   ARG A   9      -5.553   4.224   3.744  1.00  5.060          C  
ATOM    122  O   ARG A   9      -5.415   3.115   4.252  1.00  5.440          O  
ATOM    123  CB  ARG A   9      -6.901   5.987   4.843  1.00  7.350          C  
ATOM    124  CG  ARG A   9      -7.044   7.038   5.941  1.00  7.350          C  
ATOM    125  CD  ARG A   9      -8.473   7.266   6.332  1.00  7.350          C  
ATOM    126  NE  ARG A   9      -9.274   7.823   5.232  1.00  7.350          N  
ATOM    127  CZ  ARG A   9      -9.403   9.142   4.935  1.00  7.350          C  
ATOM    128  NH1 ARG A   9      -8.774  10.061   5.645  1.00  7.350          N  
ATOM    129  NH2 ARG A   9     -10.167   9.508   3.918  1.00  7.350          N  
ATOM    130  H   ARG A   9      -5.095   7.411   3.702  1.00  5.950          H  
ATOM    131  HA  ARG A   9      -5.025   5.226   5.547  1.00  6.440          H  
ATOM    132 1HB  ARG A   9      -7.301   6.414   3.926  1.00  8.820          H  
ATOM    133 2HB  ARG A   9      -7.535   5.142   5.111  1.00  8.820          H  
ATOM    134 1HG  ARG A   9      -6.517   6.700   6.825  1.00  8.820          H  
ATOM    135 2HG  ARG A   9      -6.615   7.980   5.602  1.00  8.820          H  
ATOM    136 1HD  ARG A   9      -8.915   6.312   6.619  1.00  8.820          H  
ATOM    137 2HD  ARG A   9      -8.521   7.944   7.181  1.00  8.820          H  
ATOM    138  HE  ARG A   9      -9.786   7.167   4.656  1.00  8.820          H  
ATOM    139 1HH1 ARG A   9      -8.191   9.795   6.422  1.00  8.820          H  
ATOM    140 2HH1 ARG A   9      -8.879  11.039   5.412  1.00  8.820          H  
ATOM    141 1HH2 ARG A   9     -10.649   8.809   3.370  1.00  8.820          H  
ATOM    142 2HH2 ARG A   9     -10.270  10.486   3.686  1.00  8.820          H  
ATOM    143  N   LEU A  10      -5.746   4.372   2.434  1.00  4.770          N  
ATOM    144  CA  LEU A  10      -5.798   3.171   1.618  1.00  4.960          C  
ATOM    145  C   LEU A  10      -4.441   2.516   1.574  1.00  4.670          C  
ATOM    146  O   LEU A  10      -4.320   1.295   1.581  1.00  5.050          O  
ATOM    147  CB  LEU A  10      -6.288   3.428   0.191  1.00  6.870          C  
ATOM    148  CG  LEU A  10      -6.370   2.137  -0.739  1.00  6.870          C  
ATOM    149  CD1 LEU A  10      -7.302   1.055  -0.120  1.00  6.870          C  
ATOM    150  CD2 LEU A  10      -6.890   2.551  -2.107  1.00  6.870          C  
ATOM    151  H   LEU A  10      -5.881   5.286   2.031  1.00  5.720          H  
ATOM    152  HA  LEU A  10      -6.494   2.490   2.094  1.00  5.950          H  
ATOM    153 1HB  LEU A  10      -7.278   3.875   0.237  1.00  8.240          H  
ATOM    154 2HB  LEU A  10      -5.608   4.136  -0.286  1.00  8.240          H  
ATOM    155  HG  LEU A  10      -5.374   1.706  -0.852  1.00  8.240          H  
ATOM    156 1HD1 LEU A  10      -7.340   0.193  -0.782  1.00  8.240          H  
ATOM    157 2HD1 LEU A  10      -6.935   0.729   0.849  1.00  8.240          H  
ATOM    158 3HD1 LEU A  10      -8.293   1.465  -0.013  1.00  8.240          H  
ATOM    159 1HD2 LEU A  10      -6.933   1.677  -2.758  1.00  8.240          H  
ATOM    160 2HD2 LEU A  10      -7.888   2.979  -2.008  1.00  8.240          H  
ATOM    161 3HD2 LEU A  10      -6.217   3.294  -2.543  1.00  8.240          H  
ATOM    162  N   ALA A  11      -3.385   3.311   1.487  1.00  4.410          N  
ATOM    163  CA  ALA A  11      -2.074   2.713   1.360  1.00  4.410          C  
ATOM    164  C   ALA A  11      -1.772   1.778   2.527  1.00  4.060          C  
ATOM    165  O   ALA A  11      -1.257   0.677   2.306  1.00  4.010          O  
ATOM    166  CB  ALA A  11      -1.023   3.790   1.282  1.00  6.170          C  
ATOM    167  H   ALA A  11      -3.501   4.310   1.477  1.00  5.290          H  
ATOM    168  HA  ALA A  11      -2.058   2.136   0.440  1.00  5.290          H  
ATOM    169 1HB  ALA A  11      -0.073   3.336   1.145  1.00  7.410          H  
ATOM    170 2HB  ALA A  11      -1.234   4.433   0.439  1.00  7.410          H  
ATOM    171 3HB  ALA A  11      -1.022   4.377   2.195  1.00  7.410          H  
ATOM    172  N   CYS A  12      -2.174   2.153   3.757  1.00  4.310          N  
ATOM    173  CA  CYS A  12      -1.909   1.263   4.883  1.00  4.550          C  
ATOM    174  C   CYS A  12      -3.040   0.265   5.143  1.00  4.660          C  
ATOM    175  O   CYS A  12      -2.858  -0.696   5.891  1.00  5.190          O  
ATOM    176  CB  CYS A  12      -1.654   2.057   6.159  1.00  6.270          C  
ATOM    177  SG  CYS A  12      -3.086   2.878   6.849  1.00  6.270          S  
ATOM    178  H   CYS A  12      -2.568   3.080   3.910  1.00  5.170          H  
ATOM    179  HA  CYS A  12      -1.008   0.698   4.659  1.00  5.460          H  
ATOM    180 1HB  CYS A  12      -1.277   1.379   6.908  1.00  7.530          H  
ATOM    181 2HB  CYS A  12      -0.889   2.809   5.976  1.00  7.530          H  
ATOM    182  N   ARG A  13      -4.220   0.453   4.545  1.00  4.530          N  
ATOM    183  CA  ARG A  13      -5.317  -0.491   4.745  1.00  5.030          C  
ATOM    184  C   ARG A  13      -5.240  -1.648   3.731  1.00  4.590          C  
ATOM    185  O   ARG A  13      -5.565  -2.795   4.050  1.00  5.120          O  
ATOM    186  CB  ARG A  13      -6.652   0.235   4.661  1.00  6.840          C  
ATOM    187  CG  ARG A  13      -7.878  -0.618   4.890  1.00  6.840          C  
ATOM    188  CD  ARG A  13      -9.115   0.204   5.062  1.00  6.840          C  
ATOM    189  NE  ARG A  13      -9.446   1.007   3.878  1.00  6.840          N  
ATOM    190  CZ  ARG A  13     -10.126   0.589   2.779  1.00  6.840          C  
ATOM    191  NH1 ARG A  13     -10.585  -0.639   2.668  1.00  6.840          N  
ATOM    192  NH2 ARG A  13     -10.341   1.449   1.795  1.00  6.840          N  
ATOM    193  H   ARG A  13      -4.401   1.298   4.002  1.00  5.440          H  
ATOM    194  HA  ARG A  13      -5.228  -0.908   5.747  1.00  6.040          H  
ATOM    195 1HB  ARG A  13      -6.662   1.046   5.387  1.00  8.210          H  
ATOM    196 2HB  ARG A  13      -6.746   0.681   3.676  1.00  8.210          H  
ATOM    197 1HG  ARG A  13      -8.024  -1.265   4.045  1.00  8.210          H  
ATOM    198 2HG  ARG A  13      -7.725  -1.215   5.781  1.00  8.210          H  
ATOM    199 1HD  ARG A  13      -9.951  -0.454   5.278  1.00  8.210          H  
ATOM    200 2HD  ARG A  13      -8.976   0.883   5.904  1.00  8.210          H  
ATOM    201  HE  ARG A  13      -9.142   1.971   3.888  1.00  8.210          H  
ATOM    202 1HH1 ARG A  13     -10.459  -1.329   3.424  1.00  8.210          H  
ATOM    203 2HH1 ARG A  13     -11.093  -0.912   1.842  1.00  8.210          H  
ATOM    204 1HH2 ARG A  13      -9.999   2.398   1.866  1.00  8.210          H  
ATOM    205 2HH2 ARG A  13     -10.850   1.158   0.972  1.00  8.210          H  
ATOM    206  N   HIS A  14      -4.812  -1.327   2.512  1.00  3.970          N  
ATOM    207  CA  HIS A  14      -4.702  -2.229   1.373  1.00  3.950          C  
ATOM    208  C   HIS A  14      -3.779  -3.412   1.668  1.00  3.960          C  
ATOM    209  O   HIS A  14      -2.774  -3.276   2.361  1.00  4.340          O  
ATOM    210  CB  HIS A  14      -4.209  -1.455   0.150  1.00  5.540          C  
ATOM    211  CG  HIS A  14      -4.315  -2.205  -1.118  1.00  5.540          C  
ATOM    212  ND1 HIS A  14      -3.402  -3.170  -1.507  1.00  5.540          N  
ATOM    213  CD2 HIS A  14      -5.245  -2.138  -2.097  1.00  5.540          C  
ATOM    214  CE1 HIS A  14      -3.794  -3.671  -2.678  1.00  5.540          C  
ATOM    215  NE2 HIS A  14      -4.899  -3.055  -3.049  1.00  5.540          N  
ATOM    216  H   HIS A  14      -4.564  -0.355   2.334  1.00  4.760          H  
ATOM    217  HA  HIS A  14      -5.679  -2.627   1.126  1.00  4.740          H  
ATOM    218 1HB  HIS A  14      -4.795  -0.557   0.042  1.00  6.650          H  
ATOM    219 2HB  HIS A  14      -3.172  -1.151   0.303  1.00  6.650          H  
ATOM    220  HD2 HIS A  14      -6.114  -1.482  -2.120  1.00  6.650          H  
ATOM    221  HE1 HIS A  14      -3.303  -4.449  -3.246  1.00  6.650          H  
ATOM    222  HE2 HIS A  14      -5.420  -3.232  -3.900  1.00  6.650          H  
ATOM    223  N   GLU A  15      -4.117  -4.588   1.122  1.00  4.080          N  
ATOM    224  CA  GLU A  15      -3.355  -5.825   1.325  1.00  4.610          C  
ATOM    225  C   GLU A  15      -1.874  -5.831   0.907  1.00  4.470          C  
ATOM    226  O   GLU A  15      -1.101  -6.645   1.421  1.00  5.040          O  
ATOM    227  CB  GLU A  15      -4.052  -6.971   0.594  1.00  6.240          C  
ATOM    228  CG  GLU A  15      -5.405  -7.355   1.171  1.00  6.240          C  
ATOM    229  CD  GLU A  15      -6.547  -6.517   0.684  1.00  6.240          C  
ATOM    230  OE1 GLU A  15      -6.338  -5.567  -0.036  1.00  6.240          O  
ATOM    231  OE2 GLU A  15      -7.651  -6.850   1.040  1.00  6.240          O  
ATOM    232  H   GLU A  15      -4.965  -4.650   0.551  1.00  4.900          H  
ATOM    233  HA  GLU A  15      -3.387  -6.039   2.392  1.00  5.530          H  
ATOM    234 1HB  GLU A  15      -4.193  -6.698  -0.453  1.00  7.490          H  
ATOM    235 2HB  GLU A  15      -3.415  -7.854   0.617  1.00  7.490          H  
ATOM    236 1HG  GLU A  15      -5.605  -8.396   0.922  1.00  7.490          H  
ATOM    237 2HG  GLU A  15      -5.353  -7.279   2.260  1.00  7.490          H  
ATOM    238  N   ARG A  16      -1.465  -5.004  -0.050  1.00  4.070          N  
ATOM    239  CA  ARG A  16      -0.054  -5.002  -0.438  1.00  4.250          C  
ATOM    240  C   ARG A  16       0.766  -4.134   0.512  1.00  3.860          C  
ATOM    241  O   ARG A  16       0.538  -2.933   0.637  1.00  4.130          O  
ATOM    242  CB  ARG A  16       0.111  -4.525  -1.877  1.00  5.880          C  
ATOM    243  CG  ARG A  16      -0.455  -5.476  -2.933  1.00  5.880          C  
ATOM    244  CD  ARG A  16      -0.461  -4.895  -4.327  1.00  5.880          C  
ATOM    245  NE  ARG A  16       0.888  -4.595  -4.840  1.00  5.880          N  
ATOM    246  CZ  ARG A  16       1.416  -3.345  -5.045  1.00  5.880          C  
ATOM    247  NH1 ARG A  16       0.721  -2.246  -4.798  1.00  5.880          N  
ATOM    248  NH2 ARG A  16       2.650  -3.225  -5.506  1.00  5.880          N  
ATOM    249  H   ARG A  16      -2.135  -4.374  -0.506  1.00  4.880          H  
ATOM    250  HA  ARG A  16       0.322  -6.023  -0.377  1.00  5.100          H  
ATOM    251 1HB  ARG A  16      -0.382  -3.561  -1.997  1.00  7.050          H  
ATOM    252 2HB  ARG A  16       1.170  -4.383  -2.087  1.00  7.050          H  
ATOM    253 1HG  ARG A  16       0.164  -6.369  -2.955  1.00  7.050          H  
ATOM    254 2HG  ARG A  16      -1.466  -5.759  -2.657  1.00  7.050          H  
ATOM    255 1HD  ARG A  16      -0.921  -5.619  -4.999  1.00  7.050          H  
ATOM    256 2HD  ARG A  16      -1.053  -3.990  -4.334  1.00  7.050          H  
ATOM    257  HE  ARG A  16       1.480  -5.389  -5.058  1.00  7.050          H  
ATOM    258 1HH1 ARG A  16      -0.218  -2.296  -4.454  1.00  7.050          H  
ATOM    259 2HH1 ARG A  16       1.158  -1.318  -4.965  1.00  7.050          H  
ATOM    260 1HH2 ARG A  16       3.205  -4.042  -5.699  1.00  7.050          H  
ATOM    261 2HH2 ARG A  16       3.054  -2.282  -5.655  1.00  7.050          H  
ATOM    262  N   TYR A  17       1.772  -4.718   1.165  1.00  3.610          N  
ATOM    263  CA  TYR A  17       2.584  -3.953   2.114  1.00  3.680          C  
ATOM    264  C   TYR A  17       4.078  -4.047   1.773  1.00  3.800          C  
ATOM    265  O   TYR A  17       4.533  -5.109   1.325  1.00  3.900          O  
ATOM    266  CB  TYR A  17       2.400  -4.501   3.530  1.00  5.120          C  
ATOM    267  CG  TYR A  17       1.033  -4.433   4.110  1.00  5.120          C  
ATOM    268  CD1 TYR A  17       0.191  -5.506   3.933  1.00  5.120          C  
ATOM    269  CD2 TYR A  17       0.615  -3.334   4.836  1.00  5.120          C  
ATOM    270  CE1 TYR A  17      -1.069  -5.499   4.465  1.00  5.120          C  
ATOM    271  CE2 TYR A  17      -0.663  -3.327   5.381  1.00  5.120          C  
ATOM    272  CZ  TYR A  17      -1.500  -4.413   5.188  1.00  5.120          C  
ATOM    273  OH  TYR A  17      -2.760  -4.428   5.723  1.00  5.120          O  
ATOM    274  H   TYR A  17       1.944  -5.705   1.026  1.00  4.330          H  
ATOM    275  HA  TYR A  17       2.251  -2.923   2.074  1.00  4.420          H  
ATOM    276 1HB  TYR A  17       2.650  -5.532   3.488  1.00  6.150          H  
ATOM    277 2HB  TYR A  17       3.100  -4.022   4.221  1.00  6.150          H  
ATOM    278  HD1 TYR A  17       0.526  -6.370   3.362  1.00  6.150          H  
ATOM    279  HD2 TYR A  17       1.281  -2.485   4.988  1.00  6.150          H  
ATOM    280  HE1 TYR A  17      -1.724  -6.354   4.313  1.00  6.150          H  
ATOM    281  HE2 TYR A  17      -1.008  -2.467   5.963  1.00  6.150          H  
ATOM    282  HH  TYR A  17      -3.260  -5.158   5.353  1.00  6.150          H  
ATOM    283  N   PRO A  18       4.873  -2.981   2.001  1.00  4.320          N  
ATOM    284  CA  PRO A  18       6.311  -2.960   1.857  1.00  4.910          C  
ATOM    285  C   PRO A  18       6.843  -3.678   3.062  1.00  5.040          C  
ATOM    286  O   PRO A  18       6.239  -3.521   4.125  1.00  5.140          O  
ATOM    287  CB  PRO A  18       6.637  -1.472   1.905  1.00  7.370          C  
ATOM    288  CG  PRO A  18       5.560  -0.898   2.802  1.00  7.370          C  
ATOM    289  CD  PRO A  18       4.313  -1.719   2.496  1.00  7.370          C  
ATOM    290  HA  PRO A  18       6.611  -3.438   0.912  1.00  5.890          H  
ATOM    291 1HB  PRO A  18       7.654  -1.313   2.280  1.00  8.840          H  
ATOM    292 2HB  PRO A  18       6.596  -1.058   0.878  1.00  8.840          H  
ATOM    293 1HG  PRO A  18       5.871  -0.971   3.848  1.00  8.840          H  
ATOM    294 2HG  PRO A  18       5.431   0.170   2.578  1.00  8.840          H  
ATOM    295 1HD  PRO A  18       3.740  -1.869   3.412  1.00  8.840          H  
ATOM    296 2HD  PRO A  18       3.745  -1.228   1.714  1.00  8.840          H  
ATOM    297  N   THR A  19       8.010  -4.305   2.967  1.00  5.490          N  
ATOM    298  CA  THR A  19       8.660  -4.955   4.108  1.00  6.020          C  
ATOM    299  C   THR A  19       8.463  -4.185   5.419  1.00  6.160          C  
ATOM    300  O   THR A  19       8.030  -4.735   6.435  1.00  6.270          O  
ATOM    301  CB  THR A  19      10.170  -5.124   3.828  1.00  8.220          C  
ATOM    302  OG1 THR A  19      10.345  -5.902   2.631  1.00  8.220          O  
ATOM    303  CG2 THR A  19      10.833  -5.854   4.990  1.00  8.220          C  
ATOM    304  H   THR A  19       8.465  -4.390   2.065  1.00  6.590          H  
ATOM    305  HA  THR A  19       8.223  -5.946   4.231  1.00  7.220          H  
ATOM    306  HB  THR A  19      10.633  -4.148   3.693  1.00  9.860          H  
ATOM    307  HG1 THR A  19      11.276  -5.896   2.377  1.00  9.860          H  
ATOM    308 1HG2 THR A  19      11.893  -5.981   4.777  1.00  9.860          H  
ATOM    309 2HG2 THR A  19      10.721  -5.285   5.911  1.00  9.860          H  
ATOM    310 3HG2 THR A  19      10.368  -6.832   5.111  1.00  9.860          H  
ATOM    311  N   ARG A  20       8.796  -2.892   5.388  1.00  6.460          N  
ATOM    312  CA  ARG A  20       8.777  -2.015   6.556  1.00  6.940          C  
ATOM    313  C   ARG A  20       7.452  -1.996   7.320  1.00  6.860          C  
ATOM    314  O   ARG A  20       7.447  -1.738   8.526  1.00  7.230          O  
ATOM    315  CB  ARG A  20       9.128  -0.586   6.151  1.00  9.520          C  
ATOM    316  CG  ARG A  20       9.274   0.407   7.324  1.00  9.520          C  
ATOM    317  CD  ARG A  20       9.838   1.727   6.891  1.00  9.520          C  
ATOM    318  NE  ARG A  20       8.911   2.502   6.057  1.00  9.520          N  
ATOM    319  CZ  ARG A  20       9.261   3.426   5.129  1.00  9.520          C  
ATOM    320  NH1 ARG A  20      10.533   3.691   4.875  1.00  9.520          N  
ATOM    321  NH2 ARG A  20       8.311   4.072   4.471  1.00  9.520          N  
ATOM    322  H   ARG A  20       9.120  -2.524   4.508  1.00  7.750          H  
ATOM    323  HA  ARG A  20       9.550  -2.365   7.240  1.00  8.330          H  
ATOM    324 1HB  ARG A  20      10.059  -0.582   5.592  1.00 11.430          H  
ATOM    325 2HB  ARG A  20       8.349  -0.202   5.493  1.00 11.430          H  
ATOM    326 1HG  ARG A  20       8.296   0.598   7.762  1.00 11.430          H  
ATOM    327 2HG  ARG A  20       9.928  -0.019   8.083  1.00 11.430          H  
ATOM    328 1HD  ARG A  20      10.071   2.318   7.777  1.00 11.430          H  
ATOM    329 2HD  ARG A  20      10.747   1.543   6.327  1.00 11.430          H  
ATOM    330  HE  ARG A  20       7.909   2.372   6.226  1.00 11.430          H  
ATOM    331 1HH1 ARG A  20      11.264   3.207   5.372  1.00 11.430          H  
ATOM    332 2HH1 ARG A  20      10.776   4.384   4.181  1.00 11.430          H  
ATOM    333 1HH2 ARG A  20       7.334   3.871   4.667  1.00 11.430          H  
ATOM    334 2HH2 ARG A  20       8.549   4.765   3.777  1.00 11.430          H  
ATOM    335  N   HIS A  21       6.331  -2.169   6.619  1.00  6.700          N  
ATOM    336  CA  HIS A  21       5.026  -2.094   7.245  1.00  6.960          C  
ATOM    337  C   HIS A  21       4.260  -3.413   7.194  1.00  6.670          C  
ATOM    338  O   HIS A  21       3.041  -3.429   7.330  1.00  6.990          O  
ATOM    339  CB  HIS A  21       4.215  -0.956   6.627  1.00  9.640          C  
ATOM    340  CG  HIS A  21       4.896   0.356   6.840  1.00  9.640          C  
ATOM    341  ND1 HIS A  21       4.992   0.937   8.076  1.00  9.640          N  
ATOM    342  CD2 HIS A  21       5.538   1.175   5.986  1.00  9.640          C  
ATOM    343  CE1 HIS A  21       5.669   2.059   7.979  1.00  9.640          C  
ATOM    344  NE2 HIS A  21       6.022   2.225   6.714  1.00  9.640          N  
ATOM    345  H   HIS A  21       6.376  -2.424   5.632  1.00  8.040          H  
ATOM    346  HA  HIS A  21       5.150  -1.853   8.302  1.00  8.350          H  
ATOM    347 1HB  HIS A  21       4.083  -1.122   5.573  1.00 11.570          H  
ATOM    348 2HB  HIS A  21       3.227  -0.916   7.089  1.00 11.570          H  
ATOM    349  HD1 HIS A  21       4.583   0.544   8.931  1.00 11.570          H  
ATOM    350  HD2 HIS A  21       5.733   1.134   4.922  1.00 11.570          H  
ATOM    351  HE1 HIS A  21       5.859   2.666   8.857  1.00 11.570          H  
ATOM    352  N   GLN A  22       4.942  -4.531   6.970  1.00  6.360          N  
ATOM    353  CA  GLN A  22       4.207  -5.785   6.984  1.00  6.330          C  
ATOM    354  C   GLN A  22       3.967  -6.170   8.444  1.00  5.940          C  
ATOM    355  O   GLN A  22       4.839  -5.928   9.279  1.00  5.770          O  
ATOM    356  CB  GLN A  22       4.977  -6.886   6.237  1.00  8.870          C  
ATOM    357  CG  GLN A  22       5.023  -6.681   4.743  1.00  8.870          C  
ATOM    358  CD  GLN A  22       5.872  -7.654   4.002  1.00  8.870          C  
ATOM    359  OE1 GLN A  22       6.454  -8.569   4.595  1.00  8.870          O  
ATOM    360  NE2 GLN A  22       5.959  -7.474   2.685  1.00  8.870          N  
ATOM    361  H   GLN A  22       5.961  -4.511   6.830  1.00  7.630          H  
ATOM    362  HA  GLN A  22       3.266  -5.617   6.474  1.00  7.600          H  
ATOM    363 1HB  GLN A  22       6.009  -6.905   6.597  1.00 10.650          H  
ATOM    364 2HB  GLN A  22       4.536  -7.859   6.447  1.00 10.650          H  
ATOM    365 1HG  GLN A  22       4.032  -6.845   4.396  1.00 10.650          H  
ATOM    366 2HG  GLN A  22       5.339  -5.688   4.519  1.00 10.650          H  
ATOM    367 1HE2 GLN A  22       6.514  -8.096   2.132  1.00 10.650          H  
ATOM    368 2HE2 GLN A  22       5.461  -6.697   2.220  1.00 10.650          H  
ATOM    369  N   PRO A  23       2.795  -6.718   8.805  1.00  6.140          N  
ATOM    370  CA  PRO A  23       2.496  -7.201  10.138  1.00  6.140          C  
ATOM    371  C   PRO A  23       3.300  -8.447  10.426  1.00  5.630          C  
ATOM    372  O   PRO A  23       3.554  -9.240   9.516  1.00  5.860          O  
ATOM    373  CB  PRO A  23       1.001  -7.506  10.064  1.00  9.210          C  
ATOM    374  CG  PRO A  23       0.726  -7.778   8.593  1.00  9.210          C  
ATOM    375  CD  PRO A  23       1.694  -6.873   7.833  1.00  9.210          C  
ATOM    376  HA  PRO A  23       2.714  -6.418  10.880  1.00  7.370          H  
ATOM    377 1HB  PRO A  23       0.770  -8.370  10.709  1.00 11.050          H  
ATOM    378 2HB  PRO A  23       0.452  -6.672  10.453  1.00 11.050          H  
ATOM    379 1HG  PRO A  23       0.889  -8.848   8.374  1.00 11.050          H  
ATOM    380 2HG  PRO A  23      -0.329  -7.560   8.360  1.00 11.050          H  
ATOM    381 1HD  PRO A  23       2.029  -7.408   6.933  1.00 11.050          H  
ATOM    382 2HD  PRO A  23       1.229  -5.889   7.602  1.00 11.050          H  
ATOM    383  N   HIS A  24       3.643  -8.654  11.689  1.00  5.320          N  
ATOM    384  CA  HIS A  24       4.306  -9.892  12.087  1.00  5.210          C  
ATOM    385  C   HIS A  24       3.277 -11.033  12.136  1.00  4.970          C  
ATOM    386  O   HIS A  24       2.123 -10.836  12.520  1.00  5.220          O  
ATOM    387  CB  HIS A  24       5.057  -9.752  13.419  1.00  7.340          C  
ATOM    388  CG  HIS A  24       6.016 -10.882  13.677  1.00  7.340          C  
ATOM    389  ND1 HIS A  24       5.621 -12.129  14.137  1.00  7.340          N  
ATOM    390  CD2 HIS A  24       7.360 -10.945  13.524  1.00  7.340          C  
ATOM    391  CE1 HIS A  24       6.693 -12.909  14.246  1.00  7.340          C  
ATOM    392  NE2 HIS A  24       7.753 -12.210  13.883  1.00  7.340          N  
ATOM    393  H   HIS A  24       3.416  -7.946  12.411  1.00  6.380          H  
ATOM    394  HA  HIS A  24       5.046 -10.160  11.335  1.00  6.250          H  
ATOM    395 1HB  HIS A  24       5.610  -8.814  13.425  1.00  8.810          H  
ATOM    396 2HB  HIS A  24       4.365  -9.723  14.245  1.00  8.810          H  
ATOM    397  HD2 HIS A  24       8.009 -10.140  13.176  1.00  8.810          H  
ATOM    398  HE1 HIS A  24       6.700 -13.947  14.583  1.00  8.810          H  
ATOM    399  HE2 HIS A  24       8.709 -12.548  13.869  1.00  8.810          H  
ATOM    400  N   MET A  25       3.665 -12.247  11.784  1.00  4.870          N  
ATOM    401  CA  MET A  25       2.693 -13.342  11.863  1.00  4.970          C  
ATOM    402  C   MET A  25       2.128 -13.547  13.284  1.00  4.750          C  
ATOM    403  O   MET A  25       0.997 -14.013  13.446  1.00  5.060          O  
ATOM    404  CB  MET A  25       3.336 -14.637  11.380  1.00  6.920          C  
ATOM    405  CG  MET A  25       3.621 -14.691   9.875  1.00  6.920          C  
ATOM    406  SD  MET A  25       2.140 -14.469   8.842  1.00  6.920          S  
ATOM    407  CE  MET A  25       1.174 -15.939   9.205  1.00  6.920          C  
ATOM    408  H   MET A  25       4.607 -12.410  11.460  1.00  5.840          H  
ATOM    409  HA  MET A  25       1.856 -13.096  11.214  1.00  5.960          H  
ATOM    410 1HB  MET A  25       4.290 -14.764  11.892  1.00  8.300          H  
ATOM    411 2HB  MET A  25       2.714 -15.480  11.661  1.00  8.300          H  
ATOM    412 1HG  MET A  25       4.330 -13.907   9.618  1.00  8.300          H  
ATOM    413 2HG  MET A  25       4.071 -15.652   9.627  1.00  8.300          H  
ATOM    414 1HE  MET A  25       0.253 -15.917   8.623  1.00  8.300          H  
ATOM    415 2HE  MET A  25       1.748 -16.828   8.942  1.00  8.300          H  
ATOM    416 3HE  MET A  25       0.925 -15.966  10.264  1.00  8.300          H  
ATOM    417  N   GLY A  26       2.913 -13.194  14.308  1.00  4.640          N  
ATOM    418  CA  GLY A  26       2.543 -13.292  15.716  1.00  4.800          C  
ATOM    419  C   GLY A  26       2.216 -11.917  16.332  1.00  4.450          C  
ATOM    420  O   GLY A  26       2.361 -11.731  17.544  1.00  4.670          O  
ATOM    421  H   GLY A  26       3.854 -12.840  14.126  1.00  5.570          H  
ATOM    422 1HA  GLY A  26       1.685 -13.954  15.819  1.00  5.760          H  
ATOM    423 2HA  GLY A  26       3.365 -13.746  16.266  1.00  5.760          H  
ATOM    424  N   ASP A  27       1.802 -10.947  15.508  1.00  4.400          N  
ATOM    425  CA  ASP A  27       1.567  -9.573  15.961  1.00  4.700          C  
ATOM    426  C   ASP A  27       0.243  -9.382  16.698  1.00  4.750          C  
ATOM    427  O   ASP A  27      -0.537 -10.319  16.894  1.00  5.290          O  
ATOM    428  CB  ASP A  27       1.584  -8.683  14.693  1.00  6.460          C  
ATOM    429  CG  ASP A  27       1.959  -7.223  14.807  1.00  6.460          C  
ATOM    430  OD1 ASP A  27       1.507  -6.549  15.728  1.00  6.460          O  
ATOM    431  OD2 ASP A  27       2.738  -6.793  13.954  1.00  6.460          O  
ATOM    432  H   ASP A  27       1.705 -11.141  14.509  1.00  5.280          H  
ATOM    433  HA  ASP A  27       2.381  -9.287  16.627  1.00  5.640          H  
ATOM    434 1HB  ASP A  27       2.243  -9.097  14.024  1.00  7.750          H  
ATOM    435 2HB  ASP A  27       0.598  -8.744  14.222  1.00  7.750          H  
ATOM    436  N   SER A  28       0.012  -8.143  17.131  1.00  4.560          N  
ATOM    437  CA  SER A  28      -1.195  -7.758  17.846  1.00  4.940          C  
ATOM    438  C   SER A  28      -2.124  -7.017  16.905  1.00  4.670          C  
ATOM    439  O   SER A  28      -3.340  -6.980  17.112  1.00  5.070          O  
ATOM    440  CB  SER A  28      -0.859  -6.877  19.037  1.00  6.760          C  
ATOM    441  OG  SER A  28      -0.103  -7.567  20.001  1.00  6.760          O  
ATOM    442  H   SER A  28       0.705  -7.430  16.934  1.00  5.470          H  
ATOM    443  HA  SER A  28      -1.697  -8.658  18.200  1.00  5.930          H  
ATOM    444 1HB  SER A  28      -0.294  -6.019  18.687  1.00  8.120          H  
ATOM    445 2HB  SER A  28      -1.779  -6.507  19.484  1.00  8.120          H  
ATOM    446  HG  SER A  28       0.027  -6.951  20.723  1.00  8.120          H  
ATOM    447  N   TRP A  29      -1.547  -6.414  15.868  1.00  4.220          N  
ATOM    448  CA  TRP A  29      -2.343  -5.679  14.899  1.00  4.120          C  
ATOM    449  C   TRP A  29      -3.163  -6.724  14.112  1.00  3.860          C  
ATOM    450  O   TRP A  29      -2.594  -7.760  13.774  1.00  3.740          O  
ATOM    451  CB  TRP A  29      -1.444  -4.863  13.981  1.00  5.810          C  
ATOM    452  CG  TRP A  29      -2.205  -3.992  13.074  1.00  5.810          C  
ATOM    453  CD1 TRP A  29      -2.833  -2.871  13.443  1.00  5.810          C  
ATOM    454  CD2 TRP A  29      -2.425  -4.125  11.672  1.00  5.810          C  
ATOM    455  NE1 TRP A  29      -3.441  -2.295  12.407  1.00  5.810          N  
ATOM    456  CE2 TRP A  29      -3.197  -3.043  11.290  1.00  5.810          C  
ATOM    457  CE3 TRP A  29      -2.037  -5.054  10.729  1.00  5.810          C  
ATOM    458  CZ2 TRP A  29      -3.598  -2.858   9.988  1.00  5.810          C  
ATOM    459  CZ3 TRP A  29      -2.421  -4.878   9.418  1.00  5.810          C  
ATOM    460  CH2 TRP A  29      -3.185  -3.803   9.058  1.00  5.810          C  
ATOM    461  H   TRP A  29      -0.521  -6.455  15.768  1.00  5.060          H  
ATOM    462  HA  TRP A  29      -2.970  -4.986  15.441  1.00  4.940          H  
ATOM    463 1HB  TRP A  29      -0.776  -4.253  14.571  1.00  6.970          H  
ATOM    464 2HB  TRP A  29      -0.824  -5.533  13.387  1.00  6.970          H  
ATOM    465  HD1 TRP A  29      -2.867  -2.509  14.423  1.00  6.970          H  
ATOM    466  HE1 TRP A  29      -4.002  -1.415  12.482  1.00  6.970          H  
ATOM    467  HE3 TRP A  29      -1.454  -5.904  11.022  1.00  6.970          H  
ATOM    468  HZ2 TRP A  29      -4.208  -2.012   9.678  1.00  6.970          H  
ATOM    469  HZ3 TRP A  29      -2.108  -5.614   8.683  1.00  6.970          H  
ATOM    470  HH2 TRP A  29      -3.477  -3.685   8.020  1.00  6.970          H  
ATOM    471  N   PRO A  30      -4.470  -6.520  13.816  1.00  4.160          N  
ATOM    472  CA  PRO A  30      -5.346  -7.422  13.064  1.00  4.320          C  
ATOM    473  C   PRO A  30      -4.852  -7.811  11.679  1.00  4.010          C  
ATOM    474  O   PRO A  30      -4.219  -7.029  10.985  1.00  3.920          O  
ATOM    475  CB  PRO A  30      -6.642  -6.611  12.949  1.00  6.480          C  
ATOM    476  CG  PRO A  30      -6.628  -5.695  14.134  1.00  6.480          C  
ATOM    477  CD  PRO A  30      -5.188  -5.329  14.337  1.00  6.480          C  
ATOM    478  HA  PRO A  30      -5.513  -8.327  13.672  1.00  5.180          H  
ATOM    479 1HB  PRO A  30      -6.647  -6.062  11.990  1.00  7.780          H  
ATOM    480 2HB  PRO A  30      -7.510  -7.284  12.936  1.00  7.780          H  
ATOM    481 1HG  PRO A  30      -7.255  -4.818  13.936  1.00  7.780          H  
ATOM    482 2HG  PRO A  30      -7.058  -6.202  15.013  1.00  7.780          H  
ATOM    483 1HD  PRO A  30      -4.966  -4.444  13.758  1.00  7.780          H  
ATOM    484 2HD  PRO A  30      -5.042  -5.197  15.417  1.00  7.780          H  
ATOM    485  N   ARG A  31      -5.180  -9.031  11.271  1.00  4.280          N  
ATOM    486  CA  ARG A  31      -4.787  -9.570   9.975  1.00  4.410          C  
ATOM    487  C   ARG A  31      -6.029 -10.000   9.203  1.00  4.470          C  
ATOM    488  O   ARG A  31      -6.468 -11.150   9.287  1.00  4.770          O  
ATOM    489  CB  ARG A  31      -3.823 -10.750  10.130  1.00  6.120          C  
ATOM    490  CG  ARG A  31      -2.331 -10.376  10.384  1.00  6.120          C  
ATOM    491  CD  ARG A  31      -2.028 -10.162  11.830  1.00  6.120          C  
ATOM    492  NE  ARG A  31      -2.020 -11.399  12.607  1.00  6.120          N  
ATOM    493  CZ  ARG A  31      -2.213 -11.477  13.950  1.00  6.120          C  
ATOM    494  NH1 ARG A  31      -2.461 -10.400  14.671  1.00  6.120          N  
ATOM    495  NH2 ARG A  31      -2.157 -12.655  14.550  1.00  6.120          N  
ATOM    496  H   ARG A  31      -5.722  -9.620  11.888  1.00  5.140          H  
ATOM    497  HA  ARG A  31      -4.285  -8.785   9.405  1.00  5.290          H  
ATOM    498 1HB  ARG A  31      -4.152 -11.374  10.959  1.00  7.350          H  
ATOM    499 2HB  ARG A  31      -3.858 -11.363   9.229  1.00  7.350          H  
ATOM    500 1HG  ARG A  31      -1.685 -11.173  10.020  1.00  7.350          H  
ATOM    501 2HG  ARG A  31      -2.098  -9.448   9.860  1.00  7.350          H  
ATOM    502 1HD  ARG A  31      -1.049  -9.689  11.936  1.00  7.350          H  
ATOM    503 2HD  ARG A  31      -2.763  -9.531  12.234  1.00  7.350          H  
ATOM    504  HE  ARG A  31      -1.823 -12.263  12.120  1.00  7.350          H  
ATOM    505 1HH1 ARG A  31      -2.511  -9.473  14.234  1.00  7.350          H  
ATOM    506 2HH1 ARG A  31      -2.599 -10.484  15.674  1.00  7.350          H  
ATOM    507 1HH2 ARG A  31      -1.966 -13.491  14.010  1.00  7.350          H  
ATOM    508 2HH2 ARG A  31      -2.294 -12.717  15.549  1.00  7.350          H  
ATOM    509  N   SER A  32      -6.615  -9.041   8.493  1.00  4.520          N  
ATOM    510  CA  SER A  32      -7.884  -9.178   7.781  1.00  4.810          C  
ATOM    511  C   SER A  32      -7.780  -8.401   6.468  1.00  4.460          C  
ATOM    512  O   SER A  32      -6.766  -7.727   6.237  1.00  4.560          O  
ATOM    513  CB  SER A  32      -9.017  -8.632   8.633  1.00  6.620          C  
ATOM    514  OG  SER A  32      -8.909  -7.244   8.773  1.00  6.620          O  
ATOM    515  H   SER A  32      -6.172  -8.131   8.465  1.00  5.420          H  
ATOM    516  HA  SER A  32      -8.069 -10.230   7.557  1.00  5.770          H  
ATOM    517 1HB  SER A  32      -9.964  -8.880   8.179  1.00  7.940          H  
ATOM    518 2HB  SER A  32      -8.995  -9.104   9.612  1.00  7.940          H  
ATOM    519  HG  SER A  32      -9.683  -6.971   9.273  1.00  7.940          H  
ATOM    520  N   SER A  33      -8.784  -8.524   5.587  1.00  4.470          N  
ATOM    521  CA  SER A  33      -8.742  -7.831   4.289  1.00  4.510          C  
ATOM    522  C   SER A  33      -8.964  -6.335   4.431  1.00  4.070          C  
ATOM    523  O   SER A  33      -9.429  -5.858   5.472  1.00  3.950          O  
ATOM    524  CB  SER A  33      -9.788  -8.386   3.334  1.00  6.300          C  
ATOM    525  OG  SER A  33     -11.102  -8.036   3.720  1.00  6.300          O  
ATOM    526  H   SER A  33      -9.602  -9.105   5.822  1.00  5.360          H  
ATOM    527  HA  SER A  33      -7.755  -7.985   3.845  1.00  5.410          H  
ATOM    528 1HB  SER A  33      -9.593  -8.019   2.327  1.00  7.560          H  
ATOM    529 2HB  SER A  33      -9.700  -9.469   3.306  1.00  7.560          H  
ATOM    530  HG  SER A  33     -11.682  -8.561   3.152  1.00  7.560          H  
ATOM    531  N   ALA A  34      -8.646  -5.584   3.372  1.00  4.290          N  
ATOM    532  CA  ALA A  34      -8.849  -4.140   3.393  1.00  4.360          C  
ATOM    533  C   ALA A  34     -10.321  -3.815   3.590  1.00  4.130          C  
ATOM    534  O   ALA A  34     -10.675  -2.859   4.293  1.00  4.030          O  
ATOM    535  CB  ALA A  34      -8.337  -3.526   2.105  1.00  6.080          C  
ATOM    536  H   ALA A  34      -8.252  -6.034   2.538  1.00  5.150          H  
ATOM    537  HA  ALA A  34      -8.286  -3.731   4.231  1.00  5.230          H  
ATOM    538 1HB  ALA A  34      -8.450  -2.452   2.114  1.00  7.290          H  
ATOM    539 2HB  ALA A  34      -7.293  -3.785   2.022  1.00  7.290          H  
ATOM    540 3HB  ALA A  34      -8.880  -3.941   1.260  1.00  7.290          H  
ATOM    541  N   HIS A  35     -11.188  -4.626   2.981  1.00  4.370          N  
ATOM    542  CA  HIS A  35     -12.624  -4.447   3.102  1.00  4.590          C  
ATOM    543  C   HIS A  35     -13.036  -4.611   4.555  1.00  3.990          C  
ATOM    544  O   HIS A  35     -13.754  -3.767   5.106  1.00  4.150          O  
ATOM    545  CB  HIS A  35     -13.402  -5.461   2.264  1.00  6.340          C  
ATOM    546  CG  HIS A  35     -14.860  -5.232   2.364  1.00  6.340          C  
ATOM    547  ND1 HIS A  35     -15.517  -4.276   1.616  1.00  6.340          N  
ATOM    548  CD2 HIS A  35     -15.786  -5.772   3.181  1.00  6.340          C  
ATOM    549  CE1 HIS A  35     -16.790  -4.254   1.964  1.00  6.340          C  
ATOM    550  NE2 HIS A  35     -16.973  -5.146   2.914  1.00  6.340          N  
ATOM    551  H   HIS A  35     -10.826  -5.370   2.402  1.00  5.240          H  
ATOM    552  HA  HIS A  35     -12.905  -3.446   2.782  1.00  5.510          H  
ATOM    553 1HB  HIS A  35     -13.104  -5.387   1.219  1.00  7.610          H  
ATOM    554 2HB  HIS A  35     -13.185  -6.472   2.605  1.00  7.610          H  
ATOM    555  HD2 HIS A  35     -15.620  -6.543   3.937  1.00  7.610          H  
ATOM    556  HE1 HIS A  35     -17.553  -3.595   1.555  1.00  7.610          H  
ATOM    557  HE2 HIS A  35     -17.854  -5.340   3.425  1.00  7.610          H  
ATOM    558  N   GLU A  36     -12.594  -5.714   5.173  1.00  3.610          N  
ATOM    559  CA  GLU A  36     -12.950  -5.989   6.553  1.00  3.410          C  
ATOM    560  C   GLU A  36     -12.442  -4.897   7.478  1.00  2.790          C  
ATOM    561  O   GLU A  36     -13.166  -4.473   8.381  1.00  2.680          O  
ATOM    562  CB  GLU A  36     -12.364  -7.338   6.985  1.00  4.850          C  
ATOM    563  CG  GLU A  36     -13.048  -8.562   6.357  1.00  4.850          C  
ATOM    564  CD  GLU A  36     -12.357  -9.909   6.643  1.00  4.850          C  
ATOM    565  OE1 GLU A  36     -11.160 -10.069   6.392  1.00  4.850          O  
ATOM    566  OE2 GLU A  36     -13.043 -10.780   7.124  1.00  4.850          O  
ATOM    567  H   GLU A  36     -12.016  -6.380   4.660  1.00  4.330          H  
ATOM    568  HA  GLU A  36     -14.037  -6.030   6.629  1.00  4.090          H  
ATOM    569 1HB  GLU A  36     -11.309  -7.370   6.713  1.00  5.820          H  
ATOM    570 2HB  GLU A  36     -12.425  -7.432   8.070  1.00  5.820          H  
ATOM    571 1HG  GLU A  36     -14.065  -8.611   6.747  1.00  5.820          H  
ATOM    572 2HG  GLU A  36     -13.120  -8.412   5.286  1.00  5.820          H  
ATOM    573  N   ALA A  37     -11.224  -4.405   7.233  1.00  2.870          N  
ATOM    574  CA  ALA A  37     -10.671  -3.354   8.059  1.00  2.950          C  
ATOM    575  C   ALA A  37     -11.559  -2.124   7.995  1.00  2.920          C  
ATOM    576  O   ALA A  37     -11.810  -1.469   9.014  1.00  3.000          O  
ATOM    577  CB  ALA A  37      -9.274  -3.022   7.582  1.00  4.100          C  
ATOM    578  H   ALA A  37     -10.651  -4.817   6.489  1.00  3.440          H  
ATOM    579  HA  ALA A  37     -10.637  -3.705   9.086  1.00  3.540          H  
ATOM    580 1HB  ALA A  37      -8.842  -2.239   8.197  1.00  4.920          H  
ATOM    581 2HB  ALA A  37      -8.651  -3.919   7.633  1.00  4.920          H  
ATOM    582 3HB  ALA A  37      -9.336  -2.690   6.557  1.00  4.920          H  
ATOM    583  N   ALA A  38     -12.067  -1.801   6.804  1.00  3.310          N  
ATOM    584  CA  ALA A  38     -12.957  -0.663   6.685  1.00  3.880          C  
ATOM    585  C   ALA A  38     -14.264  -0.876   7.456  1.00  3.720          C  
ATOM    586  O   ALA A  38     -14.678  -0.005   8.219  1.00  4.180          O  
ATOM    587  CB  ALA A  38     -13.267  -0.395   5.228  1.00  5.200          C  
ATOM    588  H   ALA A  38     -11.763  -2.317   5.969  1.00  3.970          H  
ATOM    589  HA  ALA A  38     -12.451   0.204   7.109  1.00  4.660          H  
ATOM    590 1HB  ALA A  38     -13.909   0.478   5.147  1.00  6.240          H  
ATOM    591 2HB  ALA A  38     -12.350  -0.218   4.700  1.00  6.240          H  
ATOM    592 3HB  ALA A  38     -13.771  -1.259   4.799  1.00  6.240          H  
ATOM    593  N   GLU A  39     -14.888  -2.056   7.331  1.00  3.470          N  
ATOM    594  CA  GLU A  39     -16.164  -2.298   8.025  1.00  3.860          C  
ATOM    595  C   GLU A  39     -16.025  -2.230   9.537  1.00  3.600          C  
ATOM    596  O   GLU A  39     -16.910  -1.743  10.244  1.00  4.120          O  
ATOM    597  CB  GLU A  39     -16.782  -3.657   7.660  1.00  5.250          C  
ATOM    598  CG  GLU A  39     -17.370  -3.774   6.250  1.00  5.250          C  
ATOM    599  CD  GLU A  39     -17.989  -5.150   5.996  1.00  5.250          C  
ATOM    600  OE1 GLU A  39     -17.729  -6.034   6.774  1.00  5.250          O  
ATOM    601  OE2 GLU A  39     -18.742  -5.300   5.042  1.00  5.250          O  
ATOM    602  H   GLU A  39     -14.495  -2.762   6.696  1.00  4.160          H  
ATOM    603  HA  GLU A  39     -16.861  -1.520   7.721  1.00  4.630          H  
ATOM    604 1HB  GLU A  39     -16.010  -4.427   7.755  1.00  6.300          H  
ATOM    605 2HB  GLU A  39     -17.568  -3.899   8.374  1.00  6.300          H  
ATOM    606 1HG  GLU A  39     -18.132  -3.009   6.114  1.00  6.300          H  
ATOM    607 2HG  GLU A  39     -16.574  -3.593   5.524  1.00  6.300          H  
ATOM    608  N   LEU A  40     -14.893  -2.707  10.021  1.00  3.200          N  
ATOM    609  CA  LEU A  40     -14.574  -2.767  11.431  1.00  3.560          C  
ATOM    610  C   LEU A  40     -13.920  -1.492  11.962  1.00  3.630          C  
ATOM    611  O   LEU A  40     -13.525  -1.445  13.135  1.00  4.250          O  
ATOM    612  CB  LEU A  40     -13.639  -3.958  11.655  1.00  4.840          C  
ATOM    613  CG  LEU A  40     -14.198  -5.373  11.355  1.00  4.840          C  
ATOM    614  CD1 LEU A  40     -13.047  -6.365  11.458  1.00  4.840          C  
ATOM    615  CD2 LEU A  40     -15.308  -5.738  12.351  1.00  4.840          C  
ATOM    616  H   LEU A  40     -14.230  -3.125   9.357  1.00  3.840          H  
ATOM    617  HA  LEU A  40     -15.498  -2.911  11.980  1.00  4.270          H  
ATOM    618 1HB  LEU A  40     -12.801  -3.827  10.981  1.00  5.810          H  
ATOM    619 2HB  LEU A  40     -13.279  -3.944  12.677  1.00  5.810          H  
ATOM    620  HG  LEU A  40     -14.597  -5.407  10.337  1.00  5.810          H  
ATOM    621 1HD1 LEU A  40     -13.409  -7.369  11.238  1.00  5.810          H  
ATOM    622 2HD1 LEU A  40     -12.276  -6.091  10.736  1.00  5.810          H  
ATOM    623 3HD1 LEU A  40     -12.632  -6.340  12.464  1.00  5.810          H  
ATOM    624 1HD2 LEU A  40     -15.673  -6.741  12.128  1.00  5.810          H  
ATOM    625 2HD2 LEU A  40     -14.911  -5.713  13.366  1.00  5.810          H  
ATOM    626 3HD2 LEU A  40     -16.133  -5.038  12.268  1.00  5.810          H  
ATOM    627  N   ASN A  41     -13.765  -0.468  11.110  1.00  3.500          N  
ATOM    628  CA  ASN A  41     -13.130   0.789  11.486  1.00  4.040          C  
ATOM    629  C   ASN A  41     -11.740   0.586  12.086  1.00  3.940          C  
ATOM    630  O   ASN A  41     -11.394   1.213  13.094  1.00  4.450          O  
ATOM    631  CB  ASN A  41     -14.015   1.555  12.458  1.00  5.440          C  
ATOM    632  CG  ASN A  41     -15.333   1.937  11.862  1.00  5.440          C  
ATOM    633  OD1 ASN A  41     -15.416   2.406  10.719  1.00  5.440          O  
ATOM    634  ND2 ASN A  41     -16.384   1.744  12.620  1.00  5.440          N  
ATOM    635  H   ASN A  41     -14.122  -0.537  10.150  1.00  4.200          H  
ATOM    636  HA  ASN A  41     -13.006   1.383  10.578  1.00  4.850          H  
ATOM    637 1HB  ASN A  41     -14.193   0.963  13.352  1.00  6.530          H  
ATOM    638 2HB  ASN A  41     -13.504   2.465  12.770  1.00  6.530          H  
ATOM    639 1HD2 ASN A  41     -17.295   1.975  12.279  1.00  6.530          H  
ATOM    640 2HD2 ASN A  41     -16.275   1.361  13.538  1.00  6.530          H  
ATOM    641  N   ARG A  42     -10.940  -0.297  11.492  1.00  3.750          N  
ATOM    642  CA  ARG A  42      -9.607  -0.544  12.017  1.00  4.170          C  
ATOM    643  C   ARG A  42      -8.588   0.492  11.557  1.00  4.330          C  
ATOM    644  O   ARG A  42      -8.508   0.851  10.380  1.00  4.640          O  
ATOM    645  CB  ARG A  42      -9.097  -1.918  11.612  1.00  5.670          C  
ATOM    646  CG  ARG A  42      -9.931  -3.116  12.068  1.00  5.670          C  
ATOM    647  CD  ARG A  42      -9.958  -3.323  13.548  1.00  5.670          C  
ATOM    648  NE  ARG A  42     -11.098  -2.655  14.176  1.00  5.670          N  
ATOM    649  CZ  ARG A  42     -11.295  -2.484  15.493  1.00  5.670          C  
ATOM    650  NH1 ARG A  42     -10.427  -2.913  16.396  1.00  5.670          N  
ATOM    651  NH2 ARG A  42     -12.402  -1.874  15.849  1.00  5.670          N  
ATOM    652  H   ARG A  42     -11.272  -0.781  10.652  1.00  4.500          H  
ATOM    653  HA  ARG A  42      -9.658  -0.500  13.104  1.00  5.000          H  
ATOM    654 1HB  ARG A  42      -9.044  -1.961  10.534  1.00  6.800          H  
ATOM    655 2HB  ARG A  42      -8.083  -2.053  11.993  1.00  6.800          H  
ATOM    656 1HG  ARG A  42     -10.941  -2.926  11.760  1.00  6.800          H  
ATOM    657 2HG  ARG A  42      -9.570  -4.028  11.592  1.00  6.800          H  
ATOM    658 1HD  ARG A  42     -10.031  -4.390  13.758  1.00  6.800          H  
ATOM    659 2HD  ARG A  42      -9.044  -2.925  13.982  1.00  6.800          H  
ATOM    660  HE  ARG A  42     -11.853  -2.283  13.572  1.00  6.800          H  
ATOM    661 1HH1 ARG A  42      -9.584  -3.385  16.111  1.00  6.800          H  
ATOM    662 2HH1 ARG A  42     -10.611  -2.770  17.380  1.00  6.800          H  
ATOM    663 1HH2 ARG A  42     -13.039  -1.575  15.087  1.00  6.800          H  
ATOM    664 2HH2 ARG A  42     -12.621  -1.710  16.818  1.00  6.800          H  
ATOM    665  N   GLN A  43      -7.787   0.954  12.505  1.00  4.540          N  
ATOM    666  CA  GLN A  43      -6.695   1.890  12.257  1.00  4.970          C  
ATOM    667  C   GLN A  43      -5.379   1.150  12.037  1.00  4.670          C  
ATOM    668  O   GLN A  43      -5.029   0.258  12.819  1.00  4.880          O  
ATOM    669  CB  GLN A  43      -6.583   2.891  13.423  1.00  6.790          C  
ATOM    670  CG  GLN A  43      -5.364   3.838  13.391  1.00  6.790          C  
ATOM    671  CD  GLN A  43      -5.341   4.886  12.257  1.00  6.790          C  
ATOM    672  OE1 GLN A  43      -6.272   5.672  12.074  1.00  6.790          O  
ATOM    673  NE2 GLN A  43      -4.237   4.895  11.503  1.00  6.790          N  
ATOM    674  H   GLN A  43      -7.944   0.630  13.448  1.00  5.450          H  
ATOM    675  HA  GLN A  43      -6.920   2.450  11.349  1.00  5.960          H  
ATOM    676 1HB  GLN A  43      -7.476   3.513  13.445  1.00  8.140          H  
ATOM    677 2HB  GLN A  43      -6.548   2.346  14.366  1.00  8.140          H  
ATOM    678 1HG  GLN A  43      -5.343   4.380  14.323  1.00  8.140          H  
ATOM    679 2HG  GLN A  43      -4.472   3.249  13.334  1.00  8.140          H  
ATOM    680 1HE2 GLN A  43      -4.102   5.581  10.720  1.00  8.140          H  
ATOM    681 2HE2 GLN A  43      -3.496   4.213  11.713  1.00  8.140          H  
ATOM    682  N   CYS A  44      -4.659   1.514  10.979  1.00  4.580          N  
ATOM    683  CA  CYS A  44      -3.344   0.937  10.734  1.00  4.620          C  
ATOM    684  C   CYS A  44      -2.328   1.559  11.691  1.00  4.480          C  
ATOM    685  O   CYS A  44      -2.492   2.693  12.152  1.00  4.560          O  
ATOM    686  CB  CYS A  44      -2.942   1.140   9.289  1.00  6.450          C  
ATOM    687  SG  CYS A  44      -2.670   2.851   8.841  1.00  6.450          S  
ATOM    688  H   CYS A  44      -5.036   2.204  10.339  1.00  5.500          H  
ATOM    689  HA  CYS A  44      -3.383  -0.124  10.917  1.00  5.540          H  
ATOM    690 1HB  CYS A  44      -2.022   0.579   9.096  1.00  7.740          H  
ATOM    691 2HB  CYS A  44      -3.711   0.728   8.636  1.00  7.740          H  
ATOM    692  N   TRP A  45      -1.223   0.872  11.946  1.00  4.720          N  
ATOM    693  CA  TRP A  45      -0.239   1.371  12.889  1.00  4.960          C  
ATOM    694  C   TRP A  45       0.933   2.044  12.205  1.00  4.890          C  
ATOM    695  O   TRP A  45       1.927   2.375  12.845  1.00  5.460          O  
ATOM    696  CB  TRP A  45       0.214   0.228  13.808  1.00  6.850          C  
ATOM    697  CG  TRP A  45      -0.855  -0.255  14.823  1.00  6.850          C  
ATOM    698  CD1 TRP A  45      -2.127   0.228  14.987  1.00  6.850          C  
ATOM    699  CD2 TRP A  45      -0.714  -1.305  15.816  1.00  6.850          C  
ATOM    700  NE1 TRP A  45      -2.757  -0.425  16.003  1.00  6.850          N  
ATOM    701  CE2 TRP A  45      -1.923  -1.367  16.518  1.00  6.850          C  
ATOM    702  CE3 TRP A  45       0.311  -2.180  16.160  1.00  6.850          C  
ATOM    703  CZ2 TRP A  45      -2.135  -2.275  17.532  1.00  6.850          C  
ATOM    704  CZ3 TRP A  45       0.090  -3.097  17.179  1.00  6.850          C  
ATOM    705  CH2 TRP A  45      -1.105  -3.138  17.844  1.00  6.850          C  
ATOM    706  H   TRP A  45      -1.030  -0.028  11.498  1.00  5.660          H  
ATOM    707  HA  TRP A  45      -0.715   2.120  13.507  1.00  5.950          H  
ATOM    708 1HB  TRP A  45       0.478  -0.629  13.189  1.00  8.220          H  
ATOM    709 2HB  TRP A  45       1.109   0.516  14.351  1.00  8.220          H  
ATOM    710  HD1 TRP A  45      -2.588   1.019  14.406  1.00  8.220          H  
ATOM    711  HE1 TRP A  45      -3.707  -0.240  16.313  1.00  8.220          H  
ATOM    712  HE3 TRP A  45       1.260  -2.158  15.639  1.00  8.220          H  
ATOM    713  HZ2 TRP A  45      -3.079  -2.324  18.073  1.00  8.220          H  
ATOM    714  HZ3 TRP A  45       0.894  -3.788  17.432  1.00  8.220          H  
ATOM    715  HH2 TRP A  45      -1.246  -3.866  18.635  1.00  8.220          H  
ATOM    716  N   VAL A  46       0.770   2.296  10.920  1.00  4.650          N  
ATOM    717  CA  VAL A  46       1.751   2.920  10.050  1.00  5.000          C  
ATOM    718  C   VAL A  46       2.165   4.311  10.523  1.00  5.070          C  
ATOM    719  O   VAL A  46       1.328   5.147  10.854  1.00  5.300          O  
ATOM    720  CB  VAL A  46       1.224   2.912   8.608  1.00  6.860          C  
ATOM    721  CG1 VAL A  46       2.088   3.722   7.675  1.00  6.860          C  
ATOM    722  CG2 VAL A  46       1.227   1.461   8.161  1.00  6.860          C  
ATOM    723  H   VAL A  46      -0.106   1.989  10.512  1.00  5.580          H  
ATOM    724  HA  VAL A  46       2.626   2.284  10.038  1.00  6.000          H  
ATOM    725  HB  VAL A  46       0.223   3.328   8.574  1.00  8.230          H  
ATOM    726 1HG1 VAL A  46       1.677   3.662   6.674  1.00  8.230          H  
ATOM    727 2HG1 VAL A  46       2.094   4.750   7.980  1.00  8.230          H  
ATOM    728 3HG1 VAL A  46       3.099   3.331   7.672  1.00  8.230          H  
ATOM    729 1HG2 VAL A  46       0.884   1.371   7.157  1.00  8.230          H  
ATOM    730 2HG2 VAL A  46       2.232   1.071   8.218  1.00  8.230          H  
ATOM    731 3HG2 VAL A  46       0.588   0.867   8.815  1.00  8.230          H  
ATOM    732  N   LEU A  47       3.477   4.561  10.475  1.00  5.330          N  
ATOM    733  CA  LEU A  47       4.134   5.767  10.978  1.00  5.900          C  
ATOM    734  C   LEU A  47       3.582   7.064  10.409  1.00  6.010          C  
ATOM    735  O   LEU A  47       3.561   8.085  11.089  1.00  6.420          O  
ATOM    736  CB  LEU A  47       5.629   5.707  10.632  1.00  8.030          C  
ATOM    737  CG  LEU A  47       6.480   4.609  11.328  1.00  8.030          C  
ATOM    738  CD1 LEU A  47       7.877   4.607  10.722  1.00  8.030          C  
ATOM    739  CD2 LEU A  47       6.542   4.855  12.831  1.00  8.030          C  
ATOM    740  H   LEU A  47       4.063   3.818  10.126  1.00  6.400          H  
ATOM    741  HA  LEU A  47       4.006   5.796  12.051  1.00  7.080          H  
ATOM    742 1HB  LEU A  47       5.723   5.561   9.557  1.00  9.640          H  
ATOM    743 2HB  LEU A  47       6.073   6.672  10.881  1.00  9.640          H  
ATOM    744  HG  LEU A  47       6.040   3.647  11.148  1.00  9.640          H  
ATOM    745 1HD1 LEU A  47       8.478   3.827  11.190  1.00  9.640          H  
ATOM    746 2HD1 LEU A  47       7.814   4.414   9.648  1.00  9.640          H  
ATOM    747 3HD1 LEU A  47       8.351   5.575  10.886  1.00  9.640          H  
ATOM    748 1HD2 LEU A  47       7.142   4.077  13.302  1.00  9.640          H  
ATOM    749 2HD2 LEU A  47       6.992   5.827  13.030  1.00  9.640          H  
ATOM    750 3HD2 LEU A  47       5.558   4.828  13.249  1.00  9.640          H  
ATOM    751  N   GLY A  48       3.097   7.037   9.181  1.00  6.010          N  
ATOM    752  CA  GLY A  48       2.533   8.222   8.537  1.00  6.480          C  
ATOM    753  C   GLY A  48       1.311   8.788   9.275  1.00  6.150          C  
ATOM    754  O   GLY A  48       0.901   9.927   9.047  1.00  6.410          O  
ATOM    755  H   GLY A  48       3.153   6.185   8.645  1.00  7.210          H  
ATOM    756 1HA  GLY A  48       3.299   8.990   8.435  1.00  7.780          H  
ATOM    757 2HA  GLY A  48       2.229   7.945   7.534  1.00  7.780          H  
ATOM    758  N   HIS A  49       0.720   7.986  10.164  1.00  5.950          N  
ATOM    759  CA  HIS A  49      -0.449   8.373  10.928  1.00  6.040          C  
ATOM    760  C   HIS A  49      -0.108   8.818  12.360  1.00  5.760          C  
ATOM    761  O   HIS A  49      -1.003   9.197  13.134  1.00  5.990          O  
ATOM    762  CB  HIS A  49      -1.384   7.157  10.973  1.00  8.420          C  
ATOM    763  CG  HIS A  49      -1.912   6.742   9.615  1.00  8.420          C  
ATOM    764  ND1 HIS A  49      -3.245   6.872   9.250  1.00  8.420          N  
ATOM    765  CD2 HIS A  49      -1.267   6.251   8.515  1.00  8.420          C  
ATOM    766  CE1 HIS A  49      -3.386   6.478   7.987  1.00  8.420          C  
ATOM    767  NE2 HIS A  49      -2.206   6.107   7.527  1.00  8.420          N  
ATOM    768  H   HIS A  49       1.095   7.048  10.324  1.00  7.140          H  
ATOM    769  HA  HIS A  49      -0.959   9.195  10.428  1.00  7.250          H  
ATOM    770 1HB  HIS A  49      -0.865   6.310  11.420  1.00 10.100          H  
ATOM    771 2HB  HIS A  49      -2.220   7.389  11.591  1.00 10.100          H  
ATOM    772  HD2 HIS A  49      -0.206   6.027   8.424  1.00 10.100          H  
ATOM    773  HE1 HIS A  49      -4.302   6.469   7.428  1.00 10.100          H  
ATOM    774  HE2 HIS A  49      -2.016   5.765   6.585  1.00 10.100          H  
ATOM    775  N   TRP A  50       1.180   8.815  12.706  1.00  5.700          N  
ATOM    776  CA  TRP A  50       1.582   9.179  14.053  1.00  5.910          C  
ATOM    777  C   TRP A  50       1.759  10.710  14.087  1.00  5.890          C  
ATOM    778  O   TRP A  50       2.064  11.305  13.058  1.00  6.050          O  
ATOM    779  CB  TRP A  50       2.895   8.476  14.437  1.00  8.190          C  
ATOM    780  CG  TRP A  50       2.843   6.930  14.524  1.00  8.190          C  
ATOM    781  CD1 TRP A  50       1.968   6.068  13.908  1.00  8.190          C  
ATOM    782  CD2 TRP A  50       3.753   6.080  15.268  1.00  8.190          C  
ATOM    783  NE1 TRP A  50       2.301   4.779  14.200  1.00  8.190          N  
ATOM    784  CE2 TRP A  50       3.366   4.759  15.026  1.00  8.190          C  
ATOM    785  CE3 TRP A  50       4.852   6.325  16.098  1.00  8.190          C  
ATOM    786  CZ2 TRP A  50       4.040   3.677  15.578  1.00  8.190          C  
ATOM    787  CZ3 TRP A  50       5.524   5.237  16.658  1.00  8.190          C  
ATOM    788  CH2 TRP A  50       5.124   3.946  16.402  1.00  8.190          C  
ATOM    789  H   TRP A  50       1.902   8.547  12.028  1.00  6.840          H  
ATOM    790  HA  TRP A  50       0.789   8.864  14.725  1.00  7.090          H  
ATOM    791 1HB  TRP A  50       3.652   8.730  13.694  1.00  9.830          H  
ATOM    792 2HB  TRP A  50       3.245   8.850  15.383  1.00  9.830          H  
ATOM    793  HD1 TRP A  50       1.151   6.333  13.255  1.00  9.830          H  
ATOM    794  HE1 TRP A  50       1.850   3.918  13.845  1.00  9.830          H  
ATOM    795  HE3 TRP A  50       5.178   7.341  16.303  1.00  9.830          H  
ATOM    796  HZ2 TRP A  50       3.738   2.641  15.381  1.00  9.830          H  
ATOM    797  HZ3 TRP A  50       6.378   5.438  17.303  1.00  9.830          H  
ATOM    798  HH2 TRP A  50       5.670   3.110  16.846  1.00  9.830          H  
ATOM    799  N   VAL A  51       1.533  11.395  15.223  1.00  6.120          N  
ATOM    800  CA  VAL A  51       1.155  10.839  16.522  1.00  6.370          C  
ATOM    801  C   VAL A  51      -0.317  11.087  16.799  1.00  6.530          C  
ATOM    802  O   VAL A  51      -0.790  10.844  17.905  1.00  6.890          O  
ATOM    803  CB  VAL A  51       2.016  11.435  17.657  1.00  8.820          C  
ATOM    804  CG1 VAL A  51       3.481  11.086  17.422  1.00  8.820          C  
ATOM    805  CG2 VAL A  51       1.824  12.949  17.739  1.00  8.820          C  
ATOM    806  H   VAL A  51       1.636  12.398  15.160  1.00  7.340          H  
ATOM    807  HA  VAL A  51       1.331   9.771  16.539  1.00  7.640          H  
ATOM    808  HB  VAL A  51       1.715  10.983  18.605  1.00 10.580          H  
ATOM    809 1HG1 VAL A  51       4.086  11.487  18.236  1.00 10.580          H  
ATOM    810 2HG1 VAL A  51       3.596  10.007  17.391  1.00 10.580          H  
ATOM    811 3HG1 VAL A  51       3.816  11.515  16.479  1.00 10.580          H  
ATOM    812 1HG2 VAL A  51       2.432  13.339  18.554  1.00 10.580          H  
ATOM    813 2HG2 VAL A  51       2.134  13.416  16.811  1.00 10.580          H  
ATOM    814 3HG2 VAL A  51       0.778  13.185  17.932  1.00 10.580          H  
ATOM    815  N   GLY A  52      -1.059  11.533  15.782  1.00  6.620          N  
ATOM    816  CA  GLY A  52      -2.499  11.769  15.906  1.00  7.170          C  
ATOM    817  C   GLY A  52      -3.213  10.495  16.347  1.00  7.100          C  
ATOM    818  O   GLY A  52      -4.180  10.536  17.111  1.00  7.700          O  
ATOM    819  H   GLY A  52      -0.609  11.716  14.894  1.00  7.940          H  
ATOM    820 1HA  GLY A  52      -2.680  12.566  16.628  1.00  8.600          H  
ATOM    821 2HA  GLY A  52      -2.897  12.101  14.949  1.00  8.600          H  
ATOM    822  N   THR A  53      -2.677   9.352  15.924  1.00  6.670          N  
ATOM    823  CA  THR A  53      -3.195   8.046  16.264  1.00  6.950          C  
ATOM    824  C   THR A  53      -2.471   7.455  17.474  1.00  6.810          C  
ATOM    825  O   THR A  53      -2.588   6.266  17.757  1.00  7.010          O  
ATOM    826  CB  THR A  53      -3.078   7.106  15.069  1.00  9.620          C  
ATOM    827  OG1 THR A  53      -1.699   7.003  14.684  1.00  9.620          O  
ATOM    828  CG2 THR A  53      -3.881   7.672  13.931  1.00  9.620          C  
ATOM    829  H   THR A  53      -1.912   9.372  15.238  1.00  8.000          H  
ATOM    830  HA  THR A  53      -4.249   8.148  16.518  1.00  8.340          H  
ATOM    831  HB  THR A  53      -3.457   6.129  15.323  1.00 11.540          H  
ATOM    832  HG1 THR A  53      -1.587   6.267  14.073  1.00 11.540          H  
ATOM    833 1HG2 THR A  53      -3.801   7.026  13.095  1.00 11.540          H  
ATOM    834 2HG2 THR A  53      -4.925   7.758  14.219  1.00 11.540          H  
ATOM    835 3HG2 THR A  53      -3.504   8.653  13.662  1.00 11.540          H  
ATOM    836  N   GLY A  54      -1.734   8.271  18.231  1.00  6.780          N  
ATOM    837  CA  GLY A  54      -1.007   7.797  19.409  1.00  7.050          C  
ATOM    838  C   GLY A  54      -1.912   7.095  20.424  1.00  6.880          C  
ATOM    839  O   GLY A  54      -1.482   6.170  21.108  1.00  7.340          O  
ATOM    840  H   GLY A  54      -1.636   9.254  17.987  1.00  8.140          H  
ATOM    841 1HA  GLY A  54      -0.218   7.113  19.094  1.00  8.460          H  
ATOM    842 2HA  GLY A  54      -0.517   8.649  19.882  1.00  8.460          H  
ATOM    843  N   GLY A  55      -3.181   7.501  20.519  1.00  6.550          N  
ATOM    844  CA  GLY A  55      -4.110   6.851  21.443  1.00  6.800          C  
ATOM    845  C   GLY A  55      -4.706   5.558  20.861  1.00  6.560          C  
ATOM    846  O   GLY A  55      -5.489   4.876  21.525  1.00  6.870          O  
ATOM    847  H   GLY A  55      -3.488   8.303  19.980  1.00  7.860          H  
ATOM    848 1HA  GLY A  55      -3.592   6.628  22.376  1.00  8.160          H  
ATOM    849 2HA  GLY A  55      -4.915   7.543  21.685  1.00  8.160          H  
ATOM    850  N   LEU A  56      -4.370   5.252  19.607  1.00  6.330          N  
ATOM    851  CA  LEU A  56      -4.860   4.074  18.904  1.00  6.470          C  
ATOM    852  C   LEU A  56      -3.737   3.052  18.668  1.00  6.030          C  
ATOM    853  O   LEU A  56      -3.977   1.842  18.672  1.00  6.390          O  
ATOM    854  CB  LEU A  56      -5.441   4.506  17.552  1.00  9.000          C  
ATOM    855  CG  LEU A  56      -6.610   5.532  17.597  1.00  9.000          C  
ATOM    856  CD1 LEU A  56      -6.974   5.914  16.178  1.00  9.000          C  
ATOM    857  CD2 LEU A  56      -7.818   4.945  18.324  1.00  9.000          C  
ATOM    858  H   LEU A  56      -3.715   5.852  19.122  1.00  7.600          H  
ATOM    859  HA  LEU A  56      -5.621   3.591  19.509  1.00  7.760          H  
ATOM    860 1HB  LEU A  56      -4.644   4.939  16.968  1.00 10.800          H  
ATOM    861 2HB  LEU A  56      -5.796   3.615  17.034  1.00 10.800          H  
ATOM    862  HG  LEU A  56      -6.279   6.434  18.114  1.00 10.800          H  
ATOM    863 1HD1 LEU A  56      -7.777   6.651  16.195  1.00 10.800          H  
ATOM    864 2HD1 LEU A  56      -6.113   6.339  15.683  1.00 10.800          H  
ATOM    865 3HD1 LEU A  56      -7.307   5.034  15.636  1.00 10.800          H  
ATOM    866 1HD2 LEU A  56      -8.622   5.680  18.337  1.00 10.800          H  
ATOM    867 2HD2 LEU A  56      -8.157   4.048  17.805  1.00 10.800          H  
ATOM    868 3HD2 LEU A  56      -7.556   4.693  19.349  1.00 10.800          H  
ATOM    869  N   VAL A  57      -2.516   3.554  18.445  1.00  5.540          N  
ATOM    870  CA  VAL A  57      -1.346   2.742  18.132  1.00  5.440          C  
ATOM    871  C   VAL A  57      -0.414   2.686  19.336  1.00  5.450          C  
ATOM    872  O   VAL A  57       0.259   3.678  19.608  1.00  5.450          O  
ATOM    873  CB  VAL A  57      -0.534   3.403  17.001  1.00  7.660          C  
ATOM    874  CG1 VAL A  57       0.678   2.532  16.679  1.00  7.660          C  
ATOM    875  CG2 VAL A  57      -1.421   3.661  15.812  1.00  7.660          C  
ATOM    876  H   VAL A  57      -2.417   4.567  18.443  1.00  6.650          H  
ATOM    877  HA  VAL A  57      -1.668   1.758  17.811  1.00  6.530          H  
ATOM    878  HB  VAL A  57      -0.150   4.368  17.344  1.00  9.190          H  
ATOM    879 1HG1 VAL A  57       1.246   2.988  15.901  1.00  9.190          H  
ATOM    880 2HG1 VAL A  57       1.315   2.408  17.551  1.00  9.190          H  
ATOM    881 3HG1 VAL A  57       0.351   1.573  16.360  1.00  9.190          H  
ATOM    882 1HG2 VAL A  57      -0.844   4.145  15.025  1.00  9.190          H  
ATOM    883 2HG2 VAL A  57      -1.818   2.770  15.456  1.00  9.190          H  
ATOM    884 3HG2 VAL A  57      -2.232   4.305  16.105  1.00  9.190          H  
ATOM    885  N   PRO A  58      -0.243   1.551  20.026  1.00  5.860          N  
ATOM    886  CA  PRO A  58       0.582   1.474  21.211  1.00  6.330          C  
ATOM    887  C   PRO A  58       1.974   1.977  20.860  1.00  6.460          C  
ATOM    888  O   PRO A  58       2.553   1.542  19.850  1.00  6.380          O  
ATOM    889  CB  PRO A  58       0.576  -0.027  21.518  1.00  9.500          C  
ATOM    890  CG  PRO A  58      -0.721  -0.527  20.913  1.00  9.500          C  
ATOM    891  CD  PRO A  58      -0.892   0.296  19.642  1.00  9.500          C  
ATOM    892  HA  PRO A  58       0.131   2.070  22.019  1.00  7.600          H  
ATOM    893 1HB  PRO A  58       1.461  -0.495  21.107  1.00 11.390          H  
ATOM    894 2HB  PRO A  58       0.620  -0.182  22.606  1.00 11.390          H  
ATOM    895 1HG  PRO A  58      -0.654  -1.606  20.705  1.00 11.390          H  
ATOM    896 2HG  PRO A  58      -1.554  -0.390  21.620  1.00 11.390          H  
ATOM    897 1HD  PRO A  58      -0.360  -0.160  18.789  1.00 11.390          H  
ATOM    898 2HD  PRO A  58      -1.969   0.424  19.458  1.00 11.390          H  
ATOM    899  N   ARG A  59       2.543   2.806  21.725  1.00  6.990          N  
ATOM    900  CA  ARG A  59       3.858   3.343  21.445  1.00  7.410          C  
ATOM    901  C   ARG A  59       4.877   2.228  21.454  1.00  7.750          C  
ATOM    902  O   ARG A  59       4.895   1.396  22.358  1.00  8.430          O  
ATOM    903  CB  ARG A  59       4.241   4.406  22.466  1.00 10.210          C  
ATOM    904  CG  ARG A  59       5.557   5.129  22.190  1.00 10.210          C  
ATOM    905  CD  ARG A  59       5.799   6.218  23.164  1.00 10.210          C  
ATOM    906  NE  ARG A  59       7.067   6.895  22.911  1.00 10.210          N  
ATOM    907  CZ  ARG A  59       7.541   7.952  23.609  1.00 10.210          C  
ATOM    908  NH1 ARG A  59       6.847   8.459  24.610  1.00 10.210          N  
ATOM    909  NH2 ARG A  59       8.710   8.479  23.281  1.00 10.210          N  
ATOM    910  H   ARG A  59       2.034   3.107  22.545  1.00  8.390          H  
ATOM    911  HA  ARG A  59       3.842   3.800  20.454  1.00  8.890          H  
ATOM    912 1HB  ARG A  59       3.454   5.157  22.516  1.00 12.250          H  
ATOM    913 2HB  ARG A  59       4.320   3.948  23.453  1.00 12.250          H  
ATOM    914 1HG  ARG A  59       6.388   4.428  22.268  1.00 12.250          H  
ATOM    915 2HG  ARG A  59       5.536   5.562  21.190  1.00 12.250          H  
ATOM    916 1HD  ARG A  59       4.995   6.951  23.090  1.00 12.250          H  
ATOM    917 2HD  ARG A  59       5.826   5.799  24.169  1.00 12.250          H  
ATOM    918  HE  ARG A  59       7.638   6.544  22.153  1.00 12.250          H  
ATOM    919 1HH1 ARG A  59       5.955   8.063  24.864  1.00 12.250          H  
ATOM    920 2HH1 ARG A  59       7.209   9.248  25.127  1.00 12.250          H  
ATOM    921 1HH2 ARG A  59       9.243   8.091  22.514  1.00 12.250          H  
ATOM    922 2HH2 ARG A  59       9.073   9.268  23.795  1.00 12.250          H  
ATOM    923  N   GLY A  60       5.730   2.213  20.439  1.00  7.510          N  
ATOM    924  CA  GLY A  60       6.780   1.213  20.326  1.00  8.020          C  
ATOM    925  C   GLY A  60       6.353  -0.039  19.556  1.00  7.790          C  
ATOM    926  O   GLY A  60       7.189  -0.903  19.281  1.00  8.050          O  
ATOM    927  H   GLY A  60       5.648   2.920  19.722  1.00  9.010          H  
ATOM    928 1HA  GLY A  60       7.643   1.660  19.832  1.00  9.620          H  
ATOM    929 2HA  GLY A  60       7.106   0.926  21.325  1.00  9.620          H  
ATOM    930  N   SER A  61       5.065  -0.150  19.217  1.00  7.590          N  
ATOM    931  CA  SER A  61       4.586  -1.316  18.488  1.00  7.700          C  
ATOM    932  C   SER A  61       5.012  -1.260  17.036  1.00  7.370          C  
ATOM    933  O   SER A  61       5.383  -0.199  16.529  1.00  7.670          O  
ATOM    934  CB  SER A  61       3.081  -1.418  18.581  1.00 10.740          C  
ATOM    935  OG  SER A  61       2.451  -0.355  17.919  1.00 10.740          O  
ATOM    936  H   SER A  61       4.394   0.575  19.477  1.00  9.110          H  
ATOM    937  HA  SER A  61       5.021  -2.207  18.938  1.00  9.240          H  
ATOM    938 1HB  SER A  61       2.768  -2.354  18.137  1.00 12.880          H  
ATOM    939 2HB  SER A  61       2.787  -1.437  19.612  1.00 12.880          H  
ATOM    940  HG  SER A  61       2.526   0.417  18.519  1.00 12.880          H  
ATOM    941  N   ALA A  62       4.945  -2.403  16.349  1.00  7.030          N  
ATOM    942  CA  ALA A  62       5.289  -2.428  14.938  1.00  6.930          C  
ATOM    943  C   ALA A  62       4.363  -1.524  14.167  1.00  7.150          C  
ATOM    944  O   ALA A  62       3.150  -1.564  14.362  1.00  7.380          O  
ATOM    945  CB  ALA A  62       5.190  -3.838  14.380  1.00  9.740          C  
ATOM    946  H   ALA A  62       4.644  -3.250  16.810  1.00  8.440          H  
ATOM    947  HA  ALA A  62       6.307  -2.056  14.827  1.00  8.320          H  
ATOM    948 1HB  ALA A  62       5.458  -3.830  13.322  1.00 11.690          H  
ATOM    949 2HB  ALA A  62       5.869  -4.492  14.922  1.00 11.690          H  
ATOM    950 3HB  ALA A  62       4.166  -4.210  14.490  1.00 11.690          H  
ATOM    951  N   ALA A  63       4.895  -0.799  13.196  1.00  7.430          N  
ATOM    952  CA  ALA A  63       4.045   0.064  12.394  1.00  8.000          C  
ATOM    953  C   ALA A  63       3.388  -0.723  11.256  1.00  8.550          C  
ATOM    954  O   ALA A  63       3.618  -0.445  10.079  1.00  8.890          O  
ATOM    955  CB  ALA A  63       4.869   1.222  11.868  1.00 10.970          C  
ATOM    956  H   ALA A  63       5.894  -0.810  13.045  1.00  8.920          H  
ATOM    957  HA  ALA A  63       3.258   0.441  13.040  1.00  9.600          H  
ATOM    958 1HB  ALA A  63       4.257   1.878  11.321  1.00 13.170          H  
ATOM    959 2HB  ALA A  63       5.299   1.761  12.715  1.00 13.170          H  
ATOM    960 3HB  ALA A  63       5.667   0.846  11.230  1.00 13.170          H  
ATOM    961  N   ALA A  64       2.567  -1.697  11.641  1.00  8.900          N  
ATOM    962  CA  ALA A  64       1.868  -2.608  10.742  1.00  9.660          C  
ATOM    963  C   ALA A  64       0.785  -1.887   9.950  1.00 10.290          C  
ATOM    964  O   ALA A  64       0.293  -2.434   8.969  1.00 10.810          O  
ATOM    965  OXT ALA A  64       0.113  -1.043  10.541  1.00 14.490          O  
ATOM    966  CB  ALA A  64       1.261  -3.746  11.537  1.00 12.590          C  
ATOM    967  H   ALA A  64       2.474  -1.814  12.653  1.00 10.680          H  
ATOM    968  HA  ALA A  64       2.593  -3.012  10.030  1.00 11.590          H  
ATOM    969 1HB  ALA A  64       0.770  -4.419  10.855  1.00 15.100          H  
ATOM    970 2HB  ALA A  64       2.044  -4.277  12.081  1.00 15.100          H  
ATOM    971 3HB  ALA A  64       0.543  -3.342  12.242  1.00 15.100          H  
TER                                                                             
# All scores below are weighted scores, not raw scores.
#BEGIN_POSE_ENERGIES_TABLE model01_0001.pdb
label fa_atr fa_rep fa_sol fa_intra_atr_xover4 fa_intra_rep_xover4 fa_intra_sol_xover4 lk_ball lk_ball_iso lk_ball_bridge lk_ball_bridge_uncpl fa_elec fa_intra_elec hbond_sr_bb hbond_lr_bb hbond_bb_sc hbond_sc dslf_fa13 omega fa_dun_dev fa_dun_rot fa_dun_semi p_aa_pp hxl_tors ref rama_prepro cart_bonded total
weights 1 0.55 1 1 0.55 1 0.92 -0.38 -0.33 -0.33 1 1 1 1 1 1 1.25 0.48 0.69 0.76 0.78 0.61 1 1 0.5 0.5 NA
pose -304.973 29.8838 258.552 -20.7142 5.13133 15.7994 118.64 -133.345 -0.59128 -4.0068 -102.355 -20.9539 -24.1679 -5.67052 -25.349 -7.83174 -1.02719 -1.1825 3.08934 28.8706 58.9772 -11.2228 10.1651 -10.2486 -11.2075 34.2675 -121.471
ASP:NtermProteinFull_1 -7.45768 0.46928 10.4997 -0.22903 0.08817 0.72135 5.04465 -4.3523 -0.05747 -0.32955 -7.51061 -0.5059 0 0 -0.65401 -0.64734 0 -0.07132 0.04447 0 2.30045 0 0 -2.3716 0 0.67453 -4.3442
VAL_2 -6.4104 0.49034 2.74218 -0.33167 0.52295 0.07663 1.50668 -2.19267 -0.03222 -0.20612 0.03786 -0.50191 0 0 0 0 0 -0.13595 0.00193 1.40171 0 0.43426 0 1.9342 -0.09531 1.12132 0.36382
SER_3 -3.09032 0.17437 4.02364 -0.04039 0.0003 0.05537 1.56535 -1.64985 -0.01511 -0.13495 -2.37963 -0.27062 0 0 -0.65401 -0.64734 0 -0.0416 0.08494 0.33088 0 -0.26775 1.90482 -0.77834 -0.43276 0.54523 -1.71778
GLU_4 -3.70555 0.15171 5.54222 -0.19277 0.03755 0.28753 2.24086 -2.13545 -0.02065 -0.14551 -2.36126 -0.53236 0 0 0 -1.59303 0 0.14392 0.09335 0 3.12993 0.02117 0 -2.7348 -0.06663 0.19049 -1.64928
GLU_5 -4.0164 0.43974 3.31572 -0.21479 0.0298 0.34257 1.39869 -1.79711 -0.00113 -0.00303 -1.10947 -0.56039 0 0 0 0 0 0.00354 0.02533 0 3.06576 0.18599 0 -2.7348 1.0226 0.26681 -0.34055
GLU_6 -3.24608 0.29247 3.22174 -0.21682 0.02534 0.30998 0.66016 -1.57301 -0.01511 -0.13495 -0.44341 -0.45272 0 0 0 0 0 -0.03038 0.00256 0 3.47553 -0.03119 0 -2.7348 0.48328 0.43771 0.0303
ASP_7 -2.60656 0.26305 2.55086 -0.13005 0.03417 0.43985 0.37143 -1.27711 -0.01014 -0.0629 -0.74335 -0.8957 0 0 0 0 0 -0.06358 0.17994 0 2.76478 -0.56462 0 -2.3716 -0.52785 0.56865 -2.0807
PHE_8 -5.49087 0.5363 4.09244 -0.55677 0.04453 0.2509 1.96174 -2.40658 -0.00113 -0.00303 -0.44897 0.09008 0 0 0 0 0 0.00802 0.09808 0 1.95333 -0.36213 0 1.0402 -0.41553 0.43961 0.83025
ARG_9 -3.23193 0.23012 3.31314 -0.77121 0.10345 0.50904 1.49025 -1.61208 -0 -0 -0.42319 0.38098 0 0 0 0 0 0.01706 0.00373 1.44404 0 -0.06263 0 -1.2888 -0.32285 0.28267 0.0618
LEU_10 -4.76451 0.47952 3.83175 -0.70842 0.30482 0.31693 1.61329 -2.1109 -0.00617 -0.04415 -0.89195 0.04117 0 0 0 0 0 -0.03071 0.04681 1.03576 0 -0.27596 0 0.18072 -0.29109 0.43519 -0.83788
ALA_11 -5.54711 0.56793 3.68113 -0.02165 0 0 2.31902 -2.66583 -0.03186 -0.18557 -0.20802 -0.36219 0 0 0 0 0 -0.00277 0 0 0 -0.34543 0 1.8394 -0.36897 0.53768 -0.79424
CYS:disulfide_12 -5.95866 0.59437 3.71579 -0.07249 0.00099 0.04895 1.53099 -2.15304 -0.01441 -0.13785 -0.20722 -0.5071 0 0 0 0 -0.5136 0.07973 0.05153 0.54357 0 0.18766 0 3.6196 -0.42753 0.57164 0.95294
ARG_13 -7.13675 0.49417 5.43452 -0.91583 0.1049 0.59854 2.41025 -3.03405 -0.02666 -0.11634 -1.43301 0.04888 0 0 0 0 0 -0.0451 0.15694 2.8015 0 -0.12172 0 -1.2888 -0.1644 0.49829 -1.73466
HIS_14 -6.47466 0.44524 6.83529 -0.50909 0.03487 0.3556 3.10572 -3.31578 -0.0443 -0.21411 -1.54286 -0.95768 0 0 -1.20576 0 0 0.01332 0.0568 0 1.59207 -0.02833 0 -0.45461 -0.19456 0.36996 -2.13287
GLU_15 -4.26483 0.19911 4.81192 -0.45529 0.1719 1.39075 1.51106 -2.30679 -0.03065 -0.20116 -2.45407 -2.91534 0 0 -0.57263 0 0 -0.07705 0.0113 0 3.69424 -0.30525 0 -2.7348 -0.52739 0.57059 -4.48439
ARG_16 -4.83027 0.43836 6.29914 -0.90032 0.16343 0.61403 3.25195 -2.67562 -0.04822 -0.3221 -3.68813 0.29481 0 0 -1.20576 -1.59303 0 -0.06969 0.2938 3.24728 0 0.03719 0 -1.2888 -0.32127 0.68284 -1.6204
TYR_17 -7.30969 0.7337 4.22933 -0.5897 0.0428 0.31399 1.53311 -2.43483 -0 -0 -0.60277 -0.17719 0 0 -0.56107 0 0 0.09534 0.00358 0 1.86475 -0.30103 0.07722 1.2797 0.08679 1.03988 -0.67607
PRO_18 -6.61992 0.92632 5.60903 -0.231 0.09781 0.17108 1.99842 -2.14607 -0 -0 -1.0484 -0.28454 0 0 0 0 0 0.0078 0.02568 0.30257 0 -0.66642 0 -2.4119 -0.00357 1.3517 -2.92143
THR_19 -2.72802 0.28192 2.91053 -0.19049 0.10511 0.06802 0.90034 -1.41696 -0.02225 -0.14574 -0.58887 -0.71015 0 0 0 0 0 -0.02812 0.02633 0.02579 0 -0.0074 2.29119 -1.0874 0.71882 0.67729 1.07994
ARG_20 -3.90916 0.23946 3.65015 -0.777 0.17679 0.56397 1.21208 -1.70251 -0 -0 -0.30738 0.08615 0 0 0 -0.7282 0 -0.094 0.22376 2.81822 0 -0.18178 0 -1.2888 0.69774 0.36505 1.04455
HIS_D_21 -9.59092 0.522 6.51688 -0.4465 0.03207 0.59675 3.44436 -3.39026 -0.00037 -0.0018 -2.80528 -0.28387 0 0 -0.75388 -0.7282 0 0.00055 0.02332 0 1.55518 -0.44799 0 -0.45461 -0.28859 0.55585 -5.94531
GLN_22 -5.22119 0.65388 4.62744 -0.25889 0.0297 0.20746 1.32388 -2.1743 -0.02225 -0.14574 -1.62099 -0.44917 0 0 -0.56107 0 0 0.00783 0.22392 0 3.29152 0.00018 0 -0.18838 -0.4217 1.12165 0.42379
PRO_23 -3.82511 0.41943 1.56025 -0.19659 0.00389 0.14303 0.41642 -0.66896 -0 -0 -0.65465 -0.00952 0 0 0 0 0 0.03929 0.01028 0.5433 0 -0.85751 0 -2.4119 -0.50545 0.98084 -5.01296
HIS_24 -4.4669 0.68835 5.5794 -0.46487 0.02297 0.30224 2.81516 -2.46867 -0 -0 -3.38316 -1.00331 0 0 -2.27771 0 0 0.00053 0.14781 0 1.847 -0.07838 0 -0.45461 -0.45506 0.43622 -3.213
MET_25 -1.92427 0.08765 2.35824 -0.6569 0.16573 0.18046 0.71639 -1.09275 -0.00573 -0.03965 0.04345 0.0325 0 0 0 0 0 -0.03263 0.00427 0.93794 0 -0.09474 0 0.60916 -0.31931 0.40156 1.37138
GLY_26 -1.81206 0.20442 2.18707 -9e-05 0 0 0.99503 -1.07459 -0 -0 -0.77573 -0.36144 0 0 -1.16685 0 0 0.04051 0 0 0 0.53434 0 0.83697 0.26426 0.27506 0.1469
ASP_27 -5.47581 0.58699 7.74943 -0.10509 0.00175 0.29906 3.87342 -3.28204 -2e-05 -0.00044 -6.25722 -1.01241 0 0 -2.63095 0 0 -0.02815 0.06157 0 3.16058 -0.32483 0 -2.3716 0.27293 0.68308 -4.79976
SER_28 -2.16626 0.17322 2.29553 -0.02514 0.00021 0.02343 0.92826 -1.06177 -0 -0 -1.07431 0.05889 0 0 -0.84287 0 0 0.07354 0.00597 0.47778 0 0.07656 0.60326 -0.77834 0.0177 0.59171 -0.62262
TRP_29 -10.3086 1.7354 6.1081 -1.03031 0.03934 0.17209 3.28933 -3.40847 -0 -0 -2.68253 -0.56868 0 0 -1.98506 0 0 -0.03608 0.05759 0 2.83736 -0.14566 0 1.6906 -0.11153 1.25053 -3.09657
PRO_30 -3.7916 0.75071 2.12011 -0.11141 0.00098 0.08119 0.9448 -0.93466 -0 -0 0.19138 0.31009 0 0 0 0 0 -0.07454 0.02184 0.11517 0 -1.16454 0 -2.4119 -0.5107 1.42422 -3.03888
ARG_31 -4.13118 0.29851 4.64114 -0.95372 0.28367 0.92053 1.49099 -1.99059 -0.00571 -0.03921 -2.09395 -0.08473 0 0 -0.46889 0 0 0.00151 0.15408 3.56666 0 -0.16922 0 -1.2888 0.47329 0.41961 1.024
SER_32 -2.16833 0.09172 2.5196 -0.02472 0 0.05878 0.53956 -1.06859 -0.00342 -0.01425 -0.84438 -0.57544 0 0 0 0 0 0.03637 0.00746 0.13071 0 -0.49569 0.60668 -0.77834 0.74999 0.33019 -0.9021
SER_33 -4.38366 0.22383 5.91084 -0.02722 0 0.06418 3.5274 -2.57262 -0 -0 -3.27751 -0.46467 0 0 -1.81836 0 0 -0.02538 0.04497 0.15206 0 -0.45301 0.65604 -0.77834 -0.27776 0.22642 -3.27279
ALA_34 -5.31217 0.41599 4.33227 -0.02192 0 0 2.42914 -2.69757 -0 -0 -2.76655 -0.37949 0 0 -0.57263 0 0 0.01443 0 0 0 -0.32769 0 1.8394 -0.58603 0.1686 -3.46423
HIS_35 -4.65905 0.38486 5.54572 -0.77508 0.04956 0.82895 2.25117 -2.62157 -0.02272 -0.13363 -1.85709 -0.32839 0 0 0 -0.39089 0 -0.00581 0.00926 0 1.68628 -0.23413 0 -0.45461 -0.21973 0.27072 -0.6762
GLU_36 -6.38394 0.35426 7.47192 -0.19503 0.01915 0.26756 3.50888 -3.32901 -0.00285 -0.04601 -3.26409 -0.4835 0 0 -1.81836 0 0 -0.00103 0.05753 0 3.77804 -0.23132 0 -2.7348 -0.19929 0.35097 -2.88094
ALA_37 -5.63327 0.27869 5.01621 -0.02152 0 0 2.84489 -2.90147 -0.00342 -0.01425 -2.54361 -0.37736 0 0 0 0 0 0.07448 0 0 0 -0.2679 0 1.8394 -0.50098 0.33629 -1.87381
ALA_38 -4.18579 0.35586 4.245 -0.02059 0 0 2.11789 -2.42043 -0.02666 -0.11634 -1.26667 -0.33711 0 0 0 0 0 -0.02778 0 0 0 -0.02022 0 1.8394 -0.21781 0.34776 0.26651
GLU_39 -3.90414 0.2227 4.81866 -0.20896 0.01721 0.26936 1.81734 -2.14672 -0.00285 -0.04601 -1.80369 -0.54166 0 0 0 -0.39089 0 -0.06232 0.07887 0 3.02898 -0.32757 0 -2.7348 -0.33084 0.38026 -1.86706
LEU_40 -5.18538 0.426 4.90311 -0.51686 0.20849 0.15341 2.08004 -2.30896 -0 -0 -2.42407 0.118 0 0 -0.75254 0 0 -0.07972 0.07629 0.07624 0 -0.11501 0 0.18072 -0.60962 0.42496 -3.34491
ASN_41 -2.93312 0.16868 3.92074 -0.19508 0.03303 0.33295 1.47866 -1.8703 -0 -0 -1.20522 -1.02435 0 0 0 0 0 -0.08671 0.01579 0 1.92868 -1.03119 0 -0.93687 -0.7845 0.28555 -1.90324
ARG_42 -4.81123 0.27661 4.45235 -1.15978 0.15078 0.84731 1.80971 -1.93427 -0.00376 -0.01132 -2.36618 0.13904 0 0 -0.75254 0 0 0.01319 0.11981 4.00141 0 -0.07627 0 -1.2888 -0.64969 0.43104 -0.8126
GLN_43 -5.08626 0.40287 3.92767 -0.62782 0.06874 0.39102 1.82201 -1.91928 -0.00302 -0.02607 -2.40663 -0.22837 0 0 -1.78116 -0.5564 0 0.07973 0.15866 0 3.04961 0.11472 0 -0.18838 -0.20837 0.63297 -2.38377
CYS:disulfide_44 -6.20098 0.66789 3.70343 -0.06997 0.00483 0.0695 1.7308 -2.06914 -0.0065 -0.06566 -1.66181 -0.22119 0 0 -0.94221 0 -0.5136 0.2219 0.03728 1.19027 0 0.24562 0 3.6196 -0.29222 0.55843 0.00629
TRP_45 -12.1213 1.68677 5.45009 -0.66431 0.15661 0.36874 3.30289 -3.74071 -0 -0 -3.5676 -0.48321 0 0 -0.30837 0 0 -0.06666 0.0557 0 2.82005 -0.02461 0 1.6906 -0.35291 0.53618 -5.26209
VAL_46 -8.71631 1.0234 3.76907 -0.28064 0.1838 0.05496 2.16092 -2.9359 -0 -0 -1.53923 0.33814 0 0 0 0 0 0.18579 0.03049 0.22881 0 -0.00533 0 1.9342 -0.41723 0.77 -3.21506
LEU_47 -5.11627 0.66346 2.29999 -0.50526 0.24681 0.12522 1.60325 -1.77955 -0.01742 -0.11134 -0.37912 0.2994 0 0 0 0 0 -0.06939 0.03362 0.37265 0 -0.16462 0 0.18072 -0.3362 0.63733 -2.01672
GLY_48 -2.58045 0.40481 2.41876 -4e-05 0 0 0.78549 -1.31661 -0 -0 -0.01335 -0.42029 0 0 0 0 0 -0.16071 0 0 0 0.35817 0 0.83697 0.08094 0.24732 0.641
HIS_49 -7.5494 0.69758 6.15964 -0.45642 0.13971 0.50982 2.89601 -3.20067 -0.00302 -0.02607 -2.83398 -0.24683 0 0 0 -0.5564 0 -0.04947 0.00256 0 3.13723 -0.24673 0 -0.45461 -0.13698 0.31697 -1.90108
TRP_50 -7.79662 0.80119 4.10073 -0.64038 0.30678 0.33996 2.5757 -2.82824 -0.01106 -0.05136 -1.11991 -0.3568 0 0 -0.30837 0 0 0.01888 0.08432 0 3.01581 -0.37289 0 1.6906 -0.34103 0.92706 0.03438
VAL_51 -2.48921 0.60511 1.79754 -0.31289 0.17957 0.06807 0.76375 -1.09256 -0.00566 -0.04226 -0.72409 -0.13169 0 0 0 0 0 -0.02779 0.00026 0.11255 0 0.35005 0 1.9342 -0.08288 0.76998 1.67203
GLY_52 -1.56581 0.13627 1.88991 -4e-05 0 0 0.9202 -0.99847 -0 -0 -0.29468 -0.42785 0 0 0 0 0 -0.08516 0 0 0 0.40086 0 0.83697 0.11768 0.2475 1.17738
THR_53 -6.3876 0.88664 5.24938 -0.13403 0.09588 0.08285 2.98237 -2.78355 -0.00274 -0.05434 -2.53813 -1.18431 0 0 0 0 0 -0.06889 6e-05 0.03027 0 -0.09495 2.2529 -1.0874 0.13428 0.35924 -2.26206
GLY_54 -2.32294 0.2508 3.04867 -4e-05 0 0 1.59572 -1.5068 -0 -0 -0.77665 -0.41347 0 0 0 0 0 -0.10772 0 0 0 0.3785 0 0.83697 0.15994 0.32597 1.46894
GLY_55 -1.32565 0.17938 1.55305 -5e-05 0 0 0.16238 -0.80077 -0.00566 -0.04226 0.08139 -0.40794 0 0 0 0 0 -0.10577 0 0 0 0.29996 0 0.83697 0.1098 0.17042 0.70525
LEU_56 -4.29316 0.36329 2.52662 -0.48335 0.21232 0.11571 1.4325 -1.38328 -0 -0 -1.13486 0.13862 0 0 0 0 0 -0.02976 0.06586 0.4286 0 -0.17824 0 0.18072 0.12819 0.1825 -1.72769
VAL_57 -7.06438 1.12201 2.8342 -0.31035 0.31965 0.07852 1.81106 -2.27129 -0 -0 -0.91823 -0.40176 0 0 0 0 0 -0.04668 0.02515 0.16789 0 -0.44927 0 1.9342 0.04465 1.26806 -1.85656
PRO_58 -4.00306 0.53113 2.90396 -0.13395 0.00658 0.09632 1.45154 -1.25481 -0.00914 -0.07798 -2.68488 0.17494 0 0 0 0 0 -0.10665 0.02589 0.14288 0 -0.84046 0 -2.4119 -0.45306 1.42769 -5.21495
ARG_59 -1.37244 0.11213 1.6075 -0.4912 0.05361 0.25026 0.54683 -0.75765 -0 -0 0.33985 0.63147 0 0 0 0 0 -0.05477 0.00412 2.05299 0 -0.05543 0 -1.2888 -0.58943 0.3314 1.32045
GLY_60 -1.12027 0.04199 1.44564 -6e-05 0 0 0.41954 -0.68665 -0 -0 0.04184 -0.3875 0 0 0 0 0 -0.15443 0 0 0 -1.4985 0 0.83697 -0.74199 0.11269 -1.69073
SER_61 -3.61841 0.264 3.71024 -0.03727 0 0.06469 1.97563 -1.71185 -0.00914 -0.07798 -1.6587 -0.11516 0 0 0 0 0 -0.02347 0.01387 0.19113 0 -0.39728 1.77303 -0.77834 -0.80135 0.16173 -1.07464
ALA_62 -2.21259 0.33484 2.03635 -0.02584 0.00053 0 1.30385 -1.2059 -0.00977 -0.11809 -1.06757 -0.25794 0 0 0 0 0 -0.06395 0 0 0 -0.03805 0 1.8394 -0.78321 0.25174 -0.01618
ALA_63 -4.73702 0.50815 2.00555 -0.03031 0.00713 0 1.75315 -1.85141 -0.00673 -0.06178 -1.01648 -0.50806 0 0 -0.75388 0 0 0.01192 0 0 0 -0.09712 0 1.8394 -0.27593 0.34049 -2.87293
ALA:CtermProteinFull_64 -6.21989 0.43278 4.9239 -0.03898 0.00056 0 2.37544 -2.8728 -0.02418 -0.25594 -3.39492 -0.02577 0 0 0 0 0 0 0 0 0 0 0 1.8394 0.19064 0.37162 -2.69813
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

