REMARK ID 691851 DOMAINID 682966 MODEL 1 pep1_AB
MODEL     1
REMARK    Rerank model05.pdb to model01.pdb score: 22.658
REMARK    S_0000_0001
REMARK    SCORE             ref:           9.690
REMARK    SCORE     lk_ball_wtd:          -6.089
REMARK    SCORE     total_score:         -92.254
REMARK    SCORE         p_aa_pp:          -8.076
REMARK    SCORE           omega:          -0.525
REMARK    SCORE     hbond_lr_bb:          -1.338
REMARK    SCORE     rama_prepro:          -6.968
REMARK    SCORE fa_intra_sol_xover4:           7.947
REMARK    SCORE     description: best_scoring0001_0001_0001
REMARK    SCORE         fa_elec:         -61.747
REMARK    SCORE    fa_intra_rep:           0.465
REMARK    SCORE            time:           0.000
REMARK    SCORE          fa_atr:        -209.105
REMARK    SCORE     hbond_bb_sc:          -2.010
REMARK    SCORE          fa_rep:          23.203
REMARK    SCORE     hbond_sr_bb:         -24.594
REMARK    SCORE          fa_dun:          49.332
REMARK    SCORE     cart_bonded:          17.833
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE        hbond_sc:          -2.836
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE           score:         -92.254
REMARK    SCORE          fa_sol:         122.565
ATOM      1  N   ASP A   1      -0.007  -0.337  -0.249  1.00  2.38           N  
ATOM      2  CA  ASP A   1       1.448  -0.326  -0.152  1.00  1.95           C  
ATOM      3  C   ASP A   1       1.957   1.112  -0.094  1.00  1.69           C  
ATOM      4  O   ASP A   1       2.045   1.794  -1.126  1.00  1.51           O  
ATOM      5  CB  ASP A   1       2.065  -1.091  -1.338  1.00  2.90           C  
ATOM      6  CG  ASP A   1       3.596  -1.224  -1.285  1.00  2.90           C  
ATOM      7  OD1 ASP A   1       4.226  -0.483  -0.554  1.00  2.90           O  
ATOM      8  OD2 ASP A   1       4.120  -2.049  -1.979  1.00  2.90           O  
ATOM      9 1H   ASP A   1      -0.370  -1.147   0.232  1.00  2.86           H  
ATOM     10 2H   ASP A   1      -0.381   0.502   0.174  1.00  2.86           H  
ATOM     11 3H   ASP A   1      -0.280  -0.372  -1.221  1.00  2.86           H  
ATOM     12  HA  ASP A   1       1.740  -0.828   0.772  1.00  2.34           H  
ATOM     13 1HB  ASP A   1       1.636  -2.093  -1.381  1.00  3.48           H  
ATOM     14 2HB  ASP A   1       1.799  -0.587  -2.269  1.00  3.48           H  
ATOM     15  N   TRP A   2       2.230   1.592   1.128  1.00  1.81           N  
ATOM     16  CA  TRP A   2       2.707   2.959   1.303  1.00  1.74           C  
ATOM     17  C   TRP A   2       4.012   3.205   0.608  1.00  1.50           C  
ATOM     18  O   TRP A   2       4.168   4.232  -0.053  1.00  1.33           O  
ATOM     19  CB  TRP A   2       2.900   3.342   2.774  1.00  2.47           C  
ATOM     20  CG  TRP A   2       3.515   4.735   2.910  1.00  2.47           C  
ATOM     21  CD1 TRP A   2       2.839   5.914   2.902  1.00  2.47           C  
ATOM     22  CD2 TRP A   2       4.933   5.090   3.063  1.00  2.47           C  
ATOM     23  NE1 TRP A   2       3.718   6.966   3.022  1.00  2.47           N  
ATOM     24  CE2 TRP A   2       4.998   6.476   3.118  1.00  2.47           C  
ATOM     25  CE3 TRP A   2       6.123   4.349   3.150  1.00  2.47           C  
ATOM     26  CZ2 TRP A   2       6.203   7.147   3.246  1.00  2.47           C  
ATOM     27  CZ3 TRP A   2       7.326   5.021   3.270  1.00  2.47           C  
ATOM     28  CH2 TRP A   2       7.365   6.382   3.315  1.00  2.47           C  
ATOM     29  H   TRP A   2       2.129   0.994   1.937  1.00  2.17           H  
ATOM     30  HA  TRP A   2       1.967   3.633   0.873  1.00  2.09           H  
ATOM     31 1HB  TRP A   2       1.942   3.334   3.290  1.00  2.96           H  
ATOM     32 2HB  TRP A   2       3.553   2.624   3.265  1.00  2.96           H  
ATOM     33  HD1 TRP A   2       1.761   6.011   2.804  1.00  2.96           H  
ATOM     34  HE1 TRP A   2       3.464   7.942   3.035  1.00  2.96           H  
ATOM     35  HE3 TRP A   2       6.103   3.265   3.117  1.00  2.96           H  
ATOM     36  HZ2 TRP A   2       6.261   8.233   3.284  1.00  2.96           H  
ATOM     37  HZ3 TRP A   2       8.242   4.436   3.331  1.00  2.96           H  
ATOM     38  HH2 TRP A   2       8.329   6.884   3.408  1.00  2.96           H  
ATOM     39  N   PHE A   3       4.976   2.300   0.784  1.00  1.61           N  
ATOM     40  CA  PHE A   3       6.262   2.554   0.187  1.00  1.57           C  
ATOM     41  C   PHE A   3       6.149   2.653  -1.303  1.00  1.28           C  
ATOM     42  O   PHE A   3       6.675   3.585  -1.899  1.00  1.20           O  
ATOM     43  CB  PHE A   3       7.336   1.552   0.540  1.00  2.22           C  
ATOM     44  CG  PHE A   3       8.572   1.951  -0.175  1.00  2.22           C  
ATOM     45  CD1 PHE A   3       9.318   3.041   0.275  1.00  2.22           C  
ATOM     46  CD2 PHE A   3       8.983   1.286  -1.308  1.00  2.22           C  
ATOM     47  CE1 PHE A   3      10.439   3.450  -0.400  1.00  2.22           C  
ATOM     48  CE2 PHE A   3      10.098   1.690  -1.969  1.00  2.22           C  
ATOM     49  CZ  PHE A   3      10.834   2.781  -1.514  1.00  2.22           C  
ATOM     50  H   PHE A   3       4.801   1.450   1.303  1.00  1.93           H  
ATOM     51  HA  PHE A   3       6.609   3.517   0.544  1.00  1.88           H  
ATOM     52 1HB  PHE A   3       7.525   1.541   1.613  1.00  2.66           H  
ATOM     53 2HB  PHE A   3       7.042   0.545   0.227  1.00  2.66           H  
ATOM     54  HD1 PHE A   3       9.000   3.577   1.168  1.00  2.66           H  
ATOM     55  HD2 PHE A   3       8.406   0.432  -1.675  1.00  2.66           H  
ATOM     56  HE1 PHE A   3      11.014   4.299  -0.042  1.00  2.66           H  
ATOM     57  HE2 PHE A   3      10.400   1.145  -2.843  1.00  2.66           H  
ATOM     58  HZ  PHE A   3      11.726   3.100  -2.035  1.00  2.66           H  
ATOM     59  N   LYS A   4       5.489   1.702  -1.957  1.00  1.27           N  
ATOM     60  CA  LYS A   4       5.444   1.844  -3.400  1.00  1.22           C  
ATOM     61  C   LYS A   4       4.856   3.195  -3.790  1.00  1.03           C  
ATOM     62  O   LYS A   4       5.413   3.865  -4.660  1.00  1.05           O  
ATOM     63  CB  LYS A   4       4.652   0.746  -4.094  1.00  1.73           C  
ATOM     64  CG  LYS A   4       4.666   0.897  -5.645  1.00  1.73           C  
ATOM     65  CD  LYS A   4       3.923  -0.228  -6.347  1.00  1.73           C  
ATOM     66  CE  LYS A   4       4.089  -0.166  -7.892  1.00  1.73           C  
ATOM     67  NZ  LYS A   4       3.391   1.019  -8.548  1.00  1.73           N  
ATOM     68  H   LYS A   4       5.049   0.910  -1.460  1.00  1.52           H  
ATOM     69  HA  LYS A   4       6.466   1.807  -3.776  1.00  1.46           H  
ATOM     70 1HB  LYS A   4       5.067  -0.230  -3.830  1.00  2.08           H  
ATOM     71 2HB  LYS A   4       3.618   0.770  -3.750  1.00  2.08           H  
ATOM     72 1HG  LYS A   4       4.198   1.845  -5.926  1.00  2.08           H  
ATOM     73 2HG  LYS A   4       5.699   0.920  -5.993  1.00  2.08           H  
ATOM     74 1HD  LYS A   4       4.295  -1.189  -5.987  1.00  2.08           H  
ATOM     75 2HD  LYS A   4       2.862  -0.158  -6.104  1.00  2.08           H  
ATOM     76 1HE  LYS A   4       5.151  -0.119  -8.130  1.00  2.08           H  
ATOM     77 2HE  LYS A   4       3.675  -1.083  -8.310  1.00  2.08           H  
ATOM     78 1HZ  LYS A   4       3.537   0.974  -9.542  1.00  2.08           H  
ATOM     79 2HZ  LYS A   4       2.407   0.984  -8.356  1.00  2.08           H  
ATOM     80 3HZ  LYS A   4       3.755   1.942  -8.224  1.00  2.08           H  
ATOM     81  N   ALA A   5       3.734   3.608  -3.169  1.00  1.03           N  
ATOM     82  CA  ALA A   5       3.137   4.885  -3.551  1.00  1.08           C  
ATOM     83  C   ALA A   5       4.109   6.036  -3.321  1.00  0.88           C  
ATOM     84  O   ALA A   5       4.269   6.913  -4.178  1.00  0.97           O  
ATOM     85  CB  ALA A   5       1.872   5.120  -2.750  1.00  1.49           C  
ATOM     86  H   ALA A   5       3.293   3.030  -2.442  1.00  1.24           H  
ATOM     87  HA  ALA A   5       2.900   4.843  -4.614  1.00  1.30           H  
ATOM     88 1HB  ALA A   5       1.420   6.061  -3.050  1.00  1.79           H  
ATOM     89 2HB  ALA A   5       1.175   4.302  -2.929  1.00  1.79           H  
ATOM     90 3HB  ALA A   5       2.125   5.154  -1.687  1.00  1.79           H  
ATOM     91  N   PHE A   6       4.801   5.996  -2.187  1.00  0.82           N  
ATOM     92  CA  PHE A   6       5.788   6.987  -1.831  1.00  0.92           C  
ATOM     93  C   PHE A   6       6.881   7.068  -2.863  1.00  0.87           C  
ATOM     94  O   PHE A   6       7.184   8.158  -3.354  1.00  0.81           O  
ATOM     95  CB  PHE A   6       6.360   6.652  -0.468  1.00  1.24           C  
ATOM     96  CG  PHE A   6       7.549   7.396  -0.095  1.00  1.24           C  
ATOM     97  CD1 PHE A   6       7.503   8.700   0.333  1.00  1.24           C  
ATOM     98  CD2 PHE A   6       8.756   6.749  -0.155  1.00  1.24           C  
ATOM     99  CE1 PHE A   6       8.665   9.343   0.689  1.00  1.24           C  
ATOM    100  CE2 PHE A   6       9.902   7.370   0.198  1.00  1.24           C  
ATOM    101  CZ  PHE A   6       9.869   8.673   0.621  1.00  1.24           C  
ATOM    102  H   PHE A   6       4.611   5.250  -1.513  1.00  0.98           H  
ATOM    103  HA  PHE A   6       5.295   7.956  -1.775  1.00  1.10           H  
ATOM    104 1HB  PHE A   6       5.597   6.816   0.283  1.00  1.49           H  
ATOM    105 2HB  PHE A   6       6.600   5.607  -0.435  1.00  1.49           H  
ATOM    106  HD1 PHE A   6       6.547   9.218   0.386  1.00  1.49           H  
ATOM    107  HD2 PHE A   6       8.772   5.715  -0.493  1.00  1.49           H  
ATOM    108  HE1 PHE A   6       8.633  10.377   1.025  1.00  1.49           H  
ATOM    109  HE2 PHE A   6      10.834   6.834   0.148  1.00  1.49           H  
ATOM    110  HZ  PHE A   6      10.790   9.178   0.907  1.00  1.49           H  
ATOM    111  N   TYR A   7       7.449   5.911  -3.200  1.00  1.03           N  
ATOM    112  CA  TYR A   7       8.529   5.806  -4.148  1.00  1.19           C  
ATOM    113  C   TYR A   7       8.112   6.396  -5.466  1.00  1.04           C  
ATOM    114  O   TYR A   7       8.810   7.241  -6.011  1.00  1.08           O  
ATOM    115  CB  TYR A   7       8.958   4.379  -4.384  1.00  1.60           C  
ATOM    116  CG  TYR A   7      10.130   4.299  -5.332  1.00  1.60           C  
ATOM    117  CD1 TYR A   7      11.389   4.524  -4.833  1.00  1.60           C  
ATOM    118  CD2 TYR A   7       9.965   4.001  -6.683  1.00  1.60           C  
ATOM    119  CE1 TYR A   7      12.497   4.443  -5.651  1.00  1.60           C  
ATOM    120  CE2 TYR A   7      11.083   3.922  -7.505  1.00  1.60           C  
ATOM    121  CZ  TYR A   7      12.348   4.134  -6.977  1.00  1.60           C  
ATOM    122  OH  TYR A   7      13.480   4.032  -7.767  1.00  1.60           O  
ATOM    123  H   TYR A   7       7.114   5.063  -2.754  1.00  1.24           H  
ATOM    124  HA  TYR A   7       9.382   6.341  -3.762  1.00  1.43           H  
ATOM    125 1HB  TYR A   7       9.224   3.931  -3.449  1.00  1.92           H  
ATOM    126 2HB  TYR A   7       8.128   3.803  -4.799  1.00  1.92           H  
ATOM    127  HD1 TYR A   7      11.497   4.759  -3.785  1.00  1.92           H  
ATOM    128  HD2 TYR A   7       8.964   3.822  -7.093  1.00  1.92           H  
ATOM    129  HE1 TYR A   7      13.499   4.610  -5.259  1.00  1.92           H  
ATOM    130  HE2 TYR A   7      10.965   3.679  -8.558  1.00  1.92           H  
ATOM    131  HH  TYR A   7      14.262   3.885  -7.186  1.00  1.92           H  
ATOM    132  N   ASP A   8       6.949   5.982  -5.978  1.00  1.01           N  
ATOM    133  CA  ASP A   8       6.493   6.465  -7.271  1.00  1.11           C  
ATOM    134  C   ASP A   8       6.415   7.992  -7.282  1.00  0.99           C  
ATOM    135  O   ASP A   8       6.705   8.621  -8.302  1.00  1.13           O  
ATOM    136  CB  ASP A   8       5.121   5.868  -7.627  1.00  1.51           C  
ATOM    137  CG  ASP A   8       5.137   4.339  -8.025  1.00  1.51           C  
ATOM    138  OD1 ASP A   8       6.186   3.797  -8.277  1.00  1.51           O  
ATOM    139  OD2 ASP A   8       4.065   3.748  -8.083  1.00  1.51           O  
ATOM    140  H   ASP A   8       6.406   5.277  -5.470  1.00  1.21           H  
ATOM    141  HA  ASP A   8       7.211   6.152  -8.026  1.00  1.33           H  
ATOM    142 1HB  ASP A   8       4.462   5.982  -6.760  1.00  1.81           H  
ATOM    143 2HB  ASP A   8       4.681   6.440  -8.442  1.00  1.81           H  
ATOM    144  N   LYS A   9       6.008   8.598  -6.159  1.00  0.83           N  
ATOM    145  CA  LYS A   9       5.924  10.053  -6.067  1.00  0.87           C  
ATOM    146  C   LYS A   9       7.310  10.715  -6.027  1.00  0.81           C  
ATOM    147  O   LYS A   9       7.544  11.717  -6.709  1.00  0.92           O  
ATOM    148  CB  LYS A   9       5.101  10.460  -4.844  1.00  1.20           C  
ATOM    149  CG  LYS A   9       3.606  10.154  -4.974  1.00  1.20           C  
ATOM    150  CD  LYS A   9       2.840  10.526  -3.706  1.00  1.20           C  
ATOM    151  CE  LYS A   9       1.357  10.191  -3.835  1.00  1.20           C  
ATOM    152  NZ  LYS A   9       0.597  10.524  -2.592  1.00  1.20           N  
ATOM    153  H   LYS A   9       5.727   8.021  -5.357  1.00  1.00           H  
ATOM    154  HA  LYS A   9       5.412  10.417  -6.956  1.00  1.04           H  
ATOM    155 1HB  LYS A   9       5.472   9.934  -3.966  1.00  1.44           H  
ATOM    156 2HB  LYS A   9       5.220  11.526  -4.663  1.00  1.44           H  
ATOM    157 1HG  LYS A   9       3.201  10.718  -5.812  1.00  1.44           H  
ATOM    158 2HG  LYS A   9       3.473   9.095  -5.178  1.00  1.44           H  
ATOM    159 1HD  LYS A   9       3.255   9.968  -2.864  1.00  1.44           H  
ATOM    160 2HD  LYS A   9       2.951  11.591  -3.508  1.00  1.44           H  
ATOM    161 1HE  LYS A   9       0.936  10.751  -4.668  1.00  1.44           H  
ATOM    162 2HE  LYS A   9       1.251   9.123  -4.038  1.00  1.44           H  
ATOM    163 1HZ  LYS A   9      -0.378  10.287  -2.717  1.00  1.44           H  
ATOM    164 2HZ  LYS A   9       0.973   9.999  -1.815  1.00  1.44           H  
ATOM    165 3HZ  LYS A   9       0.679  11.513  -2.400  1.00  1.44           H  
ATOM    166  N   VAL A  10       8.252  10.141  -5.264  1.00  0.78           N  
ATOM    167  CA  VAL A  10       9.594  10.729  -5.174  1.00  0.91           C  
ATOM    168  C   VAL A  10      10.506  10.298  -6.328  1.00  0.91           C  
ATOM    169  O   VAL A  10      11.543  10.930  -6.573  1.00  0.95           O  
ATOM    170  CB  VAL A  10      10.292  10.408  -3.817  1.00  1.23           C  
ATOM    171  CG1 VAL A  10       9.457  10.940  -2.662  1.00  1.23           C  
ATOM    172  CG2 VAL A  10      10.490   8.916  -3.639  1.00  1.23           C  
ATOM    173  H   VAL A  10       7.982   9.330  -4.694  1.00  0.94           H  
ATOM    174  HA  VAL A  10       9.482  11.812  -5.223  1.00  1.09           H  
ATOM    175  HB  VAL A  10      11.256  10.909  -3.796  1.00  1.48           H  
ATOM    176 1HG1 VAL A  10       9.963  10.734  -1.721  1.00  1.48           H  
ATOM    177 2HG1 VAL A  10       9.324  12.013  -2.776  1.00  1.48           H  
ATOM    178 3HG1 VAL A  10       8.480  10.450  -2.661  1.00  1.48           H  
ATOM    179 1HG2 VAL A  10      10.976   8.718  -2.688  1.00  1.48           H  
ATOM    180 2HG2 VAL A  10       9.536   8.473  -3.645  1.00  1.48           H  
ATOM    181 3HG2 VAL A  10      11.088   8.500  -4.443  1.00  1.48           H  
ATOM    182  N   ALA A  11      10.089   9.275  -7.075  1.00  0.98           N  
ATOM    183  CA  ALA A  11      10.856   8.689  -8.162  1.00  1.10           C  
ATOM    184  C   ALA A  11      11.240   9.716  -9.208  1.00  1.03           C  
ATOM    185  O   ALA A  11      12.325   9.621  -9.773  1.00  1.06           O  
ATOM    186  CB  ALA A  11      10.091   7.573  -8.833  1.00  1.50           C  
ATOM    187  H   ALA A  11       9.223   8.810  -6.807  1.00  1.18           H  
ATOM    188  HA  ALA A  11      11.757   8.266  -7.735  1.00  1.32           H  
ATOM    189 1HB  ALA A  11      10.707   7.139  -9.619  1.00  1.80           H  
ATOM    190 2HB  ALA A  11       9.846   6.805  -8.115  1.00  1.80           H  
ATOM    191 3HB  ALA A  11       9.172   7.970  -9.265  1.00  1.80           H  
ATOM    192  N   GLU A  12      10.421  10.740  -9.448  1.00  1.00           N  
ATOM    193  CA  GLU A  12      10.796  11.717 -10.460  1.00  1.07           C  
ATOM    194  C   GLU A  12      12.106  12.424 -10.101  1.00  0.95           C  
ATOM    195  O   GLU A  12      12.831  12.872 -10.991  1.00  1.02           O  
ATOM    196  CB  GLU A  12       9.682  12.740 -10.679  1.00  1.47           C  
ATOM    197  CG  GLU A  12       8.432  12.169 -11.350  1.00  1.47           C  
ATOM    198  CD  GLU A  12       8.691  11.636 -12.745  1.00  1.47           C  
ATOM    199  OE1 GLU A  12       9.342  12.297 -13.507  1.00  1.47           O  
ATOM    200  OE2 GLU A  12       8.242  10.545 -13.038  1.00  1.47           O  
ATOM    201  H   GLU A  12       9.520  10.827  -8.984  1.00  1.20           H  
ATOM    202  HA  GLU A  12      10.954  11.191 -11.399  1.00  1.28           H  
ATOM    203 1HB  GLU A  12       9.384  13.162  -9.718  1.00  1.76           H  
ATOM    204 2HB  GLU A  12      10.055  13.558 -11.296  1.00  1.76           H  
ATOM    205 1HG  GLU A  12       8.044  11.357 -10.734  1.00  1.76           H  
ATOM    206 2HG  GLU A  12       7.670  12.946 -11.397  1.00  1.76           H  
ATOM    207  N   LYS A  13      12.416  12.559  -8.800  1.00  0.86           N  
ATOM    208  CA  LYS A  13      13.669  13.177  -8.411  1.00  0.90           C  
ATOM    209  C   LYS A  13      14.766  12.151  -8.626  1.00  0.85           C  
ATOM    210  O   LYS A  13      15.800  12.454  -9.225  1.00  0.93           O  
ATOM    211  CB  LYS A  13      13.662  13.646  -6.956  1.00  1.25           C  
ATOM    212  CG  LYS A  13      14.954  14.361  -6.538  1.00  1.25           C  
ATOM    213  CD  LYS A  13      14.874  14.927  -5.125  1.00  1.25           C  
ATOM    214  CE  LYS A  13      16.170  15.639  -4.738  1.00  1.25           C  
ATOM    215  NZ  LYS A  13      16.100  16.220  -3.363  1.00  1.25           N  
ATOM    216  H   LYS A  13      11.808  12.188  -8.067  1.00  1.03           H  
ATOM    217  HA  LYS A  13      13.866  14.029  -9.060  1.00  1.08           H  
ATOM    218 1HB  LYS A  13      12.825  14.326  -6.797  1.00  1.50           H  
ATOM    219 2HB  LYS A  13      13.519  12.787  -6.297  1.00  1.50           H  
ATOM    220 1HG  LYS A  13      15.772  13.655  -6.580  1.00  1.50           H  
ATOM    221 2HG  LYS A  13      15.167  15.169  -7.238  1.00  1.50           H  
ATOM    222 1HD  LYS A  13      14.044  15.633  -5.059  1.00  1.50           H  
ATOM    223 2HD  LYS A  13      14.692  14.113  -4.421  1.00  1.50           H  
ATOM    224 1HE  LYS A  13      16.994  14.926  -4.781  1.00  1.50           H  
ATOM    225 2HE  LYS A  13      16.360  16.440  -5.451  1.00  1.50           H  
ATOM    226 1HZ  LYS A  13      16.973  16.683  -3.145  1.00  1.50           H  
ATOM    227 2HZ  LYS A  13      15.345  16.891  -3.316  1.00  1.50           H  
ATOM    228 3HZ  LYS A  13      15.936  15.484  -2.690  1.00  1.50           H  
ATOM    229  N   PHE A  14      14.494  10.904  -8.224  1.00  0.84           N  
ATOM    230  CA  PHE A  14      15.478   9.823  -8.331  1.00  0.95           C  
ATOM    231  C   PHE A  14      15.961   9.636  -9.751  1.00  0.89           C  
ATOM    232  O   PHE A  14      17.165   9.524  -9.996  1.00  0.93           O  
ATOM    233  CB  PHE A  14      14.927   8.513  -7.793  1.00  1.29           C  
ATOM    234  CG  PHE A  14      14.995   8.400  -6.298  1.00  1.29           C  
ATOM    235  CD1 PHE A  14      13.998   8.874  -5.491  1.00  1.29           C  
ATOM    236  CD2 PHE A  14      16.076   7.795  -5.704  1.00  1.29           C  
ATOM    237  CE1 PHE A  14      14.100   8.769  -4.127  1.00  1.29           C  
ATOM    238  CE2 PHE A  14      16.171   7.677  -4.351  1.00  1.29           C  
ATOM    239  CZ  PHE A  14      15.186   8.176  -3.567  1.00  1.29           C  
ATOM    240  H   PHE A  14      13.590  10.739  -7.774  1.00  1.01           H  
ATOM    241  HA  PHE A  14      16.318  10.071  -7.732  1.00  1.14           H  
ATOM    242 1HB  PHE A  14      13.915   8.394  -8.106  1.00  1.55           H  
ATOM    243 2HB  PHE A  14      15.486   7.709  -8.221  1.00  1.55           H  
ATOM    244  HD1 PHE A  14      13.138   9.343  -5.927  1.00  1.55           H  
ATOM    245  HD2 PHE A  14      16.869   7.420  -6.325  1.00  1.55           H  
ATOM    246  HE1 PHE A  14      13.317   9.160  -3.488  1.00  1.55           H  
ATOM    247  HE2 PHE A  14      17.040   7.198  -3.895  1.00  1.55           H  
ATOM    248  HZ  PHE A  14      15.265   8.099  -2.491  1.00  1.55           H  
ATOM    249  N   LYS A  15      15.046   9.746 -10.701  1.00  0.91           N  
ATOM    250  CA  LYS A  15      15.363   9.581 -12.113  1.00  0.99           C  
ATOM    251  C   LYS A  15      16.495  10.491 -12.612  1.00  0.97           C  
ATOM    252  O   LYS A  15      17.118  10.172 -13.630  1.00  1.09           O  
ATOM    253  CB  LYS A  15      14.117   9.817 -12.969  1.00  1.35           C  
ATOM    254  CG  LYS A  15      13.068   8.706 -12.893  1.00  1.35           C  
ATOM    255  CD  LYS A  15      11.830   9.049 -13.719  1.00  1.35           C  
ATOM    256  CE  LYS A  15      10.765   7.963 -13.613  1.00  1.35           C  
ATOM    257  NZ  LYS A  15       9.513   8.330 -14.368  1.00  1.35           N  
ATOM    258  H   LYS A  15      14.070   9.869 -10.414  1.00  1.09           H  
ATOM    259  HA  LYS A  15      15.673   8.555 -12.257  1.00  1.19           H  
ATOM    260 1HB  LYS A  15      13.635  10.744 -12.647  1.00  1.62           H  
ATOM    261 2HB  LYS A  15      14.409   9.946 -14.011  1.00  1.62           H  
ATOM    262 1HG  LYS A  15      13.506   7.788 -13.285  1.00  1.62           H  
ATOM    263 2HG  LYS A  15      12.783   8.530 -11.871  1.00  1.62           H  
ATOM    264 1HD  LYS A  15      11.403   9.992 -13.374  1.00  1.62           H  
ATOM    265 2HD  LYS A  15      12.110   9.164 -14.763  1.00  1.62           H  
ATOM    266 1HE  LYS A  15      11.165   7.037 -14.019  1.00  1.62           H  
ATOM    267 2HE  LYS A  15      10.511   7.810 -12.562  1.00  1.62           H  
ATOM    268 1HZ  LYS A  15       8.833   7.594 -14.279  1.00  1.62           H  
ATOM    269 2HZ  LYS A  15       9.109   9.206 -13.972  1.00  1.62           H  
ATOM    270 3HZ  LYS A  15       9.726   8.473 -15.340  1.00  1.62           H  
ATOM    271  N   GLU A  16      16.723  11.645 -11.972  1.00  0.95           N  
ATOM    272  CA  GLU A  16      17.787  12.546 -12.413  1.00  1.11           C  
ATOM    273  C   GLU A  16      18.873  12.790 -11.348  1.00  1.03           C  
ATOM    274  O   GLU A  16      20.048  12.954 -11.681  1.00  1.16           O  
ATOM    275  CB  GLU A  16      17.208  13.894 -12.857  1.00  1.49           C  
ATOM    276  CG  GLU A  16      16.288  13.828 -14.083  1.00  1.49           C  
ATOM    277  CD  GLU A  16      15.754  15.187 -14.490  1.00  1.49           C  
ATOM    278  OE1 GLU A  16      16.053  16.144 -13.814  1.00  1.49           O  
ATOM    279  OE2 GLU A  16      15.056  15.265 -15.476  1.00  1.49           O  
ATOM    280  H   GLU A  16      16.198  11.859 -11.122  1.00  1.14           H  
ATOM    281  HA  GLU A  16      18.277  12.095 -13.274  1.00  1.33           H  
ATOM    282 1HB  GLU A  16      16.634  14.321 -12.033  1.00  1.79           H  
ATOM    283 2HB  GLU A  16      18.022  14.583 -13.080  1.00  1.79           H  
ATOM    284 1HG  GLU A  16      16.841  13.396 -14.916  1.00  1.79           H  
ATOM    285 2HG  GLU A  16      15.451  13.167 -13.857  1.00  1.79           H  
ATOM    286  N   ALA A  17      18.476  12.863 -10.069  1.00  0.96           N  
ATOM    287  CA  ALA A  17      19.400  13.201  -8.986  1.00  1.09           C  
ATOM    288  C   ALA A  17      20.158  12.015  -8.379  1.00  1.06           C  
ATOM    289  O   ALA A  17      21.172  12.231  -7.711  1.00  1.27           O  
ATOM    290  CB  ALA A  17      18.641  13.918  -7.876  1.00  1.48           C  
ATOM    291  H   ALA A  17      17.498  12.712  -9.838  1.00  1.15           H  
ATOM    292  HA  ALA A  17      20.143  13.883  -9.394  1.00  1.31           H  
ATOM    293 1HB  ALA A  17      19.338  14.216  -7.094  1.00  1.78           H  
ATOM    294 2HB  ALA A  17      18.151  14.799  -8.286  1.00  1.78           H  
ATOM    295 3HB  ALA A  17      17.905  13.268  -7.468  1.00  1.78           H  
ATOM    296  N   PHE A  18      19.688  10.775  -8.559  1.00  0.91           N  
ATOM    297  CA  PHE A  18      20.346   9.660  -7.897  1.00  1.00           C  
ATOM    298  C   PHE A  18      20.979   8.686  -8.909  1.00  0.99           C  
ATOM    299  O   PHE A  18      20.448   8.514 -10.008  1.00  1.02           O  
ATOM    300  CB  PHE A  18      19.318   8.943  -7.018  1.00  1.37           C  
ATOM    301  CG  PHE A  18      18.811   9.748  -5.777  1.00  1.37           C  
ATOM    302  CD1 PHE A  18      17.995  10.856  -5.895  1.00  1.37           C  
ATOM    303  CD2 PHE A  18      19.093   9.335  -4.504  1.00  1.37           C  
ATOM    304  CE1 PHE A  18      17.503  11.517  -4.811  1.00  1.37           C  
ATOM    305  CE2 PHE A  18      18.596   9.998  -3.411  1.00  1.37           C  
ATOM    306  CZ  PHE A  18      17.806  11.087  -3.566  1.00  1.37           C  
ATOM    307  H   PHE A  18      18.856  10.571  -9.125  1.00  1.09           H  
ATOM    308  HA  PHE A  18      21.088  10.082  -7.254  1.00  1.20           H  
ATOM    309 1HB  PHE A  18      18.454   8.701  -7.635  1.00  1.64           H  
ATOM    310 2HB  PHE A  18      19.733   7.997  -6.668  1.00  1.64           H  
ATOM    311  HD1 PHE A  18      17.747  11.212  -6.860  1.00  1.64           H  
ATOM    312  HD2 PHE A  18      19.698   8.489  -4.360  1.00  1.64           H  
ATOM    313  HE1 PHE A  18      16.870  12.381  -4.946  1.00  1.64           H  
ATOM    314  HE2 PHE A  18      18.833   9.657  -2.419  1.00  1.64           H  
ATOM    315  HZ  PHE A  18      17.418  11.606  -2.693  1.00  1.64           H  
ATOM    316  N   PRO A  19      22.124   8.050  -8.585  1.00  1.23           N  
ATOM    317  CA  PRO A  19      22.773   7.008  -9.367  1.00  1.44           C  
ATOM    318  C   PRO A  19      21.860   5.812  -9.552  1.00  1.27           C  
ATOM    319  O   PRO A  19      21.039   5.512  -8.688  1.00  1.48           O  
ATOM    320  CB  PRO A  19      23.984   6.634  -8.509  1.00  2.16           C  
ATOM    321  CG  PRO A  19      24.259   7.855  -7.672  1.00  2.16           C  
ATOM    322  CD  PRO A  19      22.912   8.479  -7.409  1.00  2.16           C  
ATOM    323  HA  PRO A  19      23.083   7.421 -10.340  1.00  1.73           H  
ATOM    324 1HB  PRO A  19      23.759   5.745  -7.925  1.00  2.59           H  
ATOM    325 2HB  PRO A  19      24.831   6.374  -9.157  1.00  2.59           H  
ATOM    326 1HG  PRO A  19      24.776   7.569  -6.742  1.00  2.59           H  
ATOM    327 2HG  PRO A  19      24.937   8.535  -8.208  1.00  2.59           H  
ATOM    328 1HD  PRO A  19      22.470   8.124  -6.476  1.00  2.59           H  
ATOM    329 2HD  PRO A  19      23.092   9.563  -7.413  1.00  2.59           H  
ATOM    330  N   TRP A  20      22.010   5.112 -10.664  1.00  1.23           N  
ATOM    331  CA  TRP A  20      21.209   3.920 -10.934  1.00  1.31           C  
ATOM    332  C   TRP A  20      21.121   2.956  -9.752  1.00  1.23           C  
ATOM    333  O   TRP A  20      20.030   2.593  -9.310  1.00  1.42           O  
ATOM    334  CB  TRP A  20      21.755   3.188 -12.152  1.00  1.80           C  
ATOM    335  CG  TRP A  20      21.339   3.813 -13.432  1.00  1.80           C  
ATOM    336  CD1 TRP A  20      22.113   4.501 -14.320  1.00  1.80           C  
ATOM    337  CD2 TRP A  20      20.013   3.789 -13.991  1.00  1.80           C  
ATOM    338  NE1 TRP A  20      21.354   4.907 -15.386  1.00  1.80           N  
ATOM    339  CE2 TRP A  20      20.068   4.477 -15.202  1.00  1.80           C  
ATOM    340  CE3 TRP A  20      18.803   3.242 -13.568  1.00  1.80           C  
ATOM    341  CZ2 TRP A  20      18.954   4.634 -16.000  1.00  1.80           C  
ATOM    342  CZ3 TRP A  20      17.690   3.392 -14.367  1.00  1.80           C  
ATOM    343  CH2 TRP A  20      17.761   4.071 -15.554  1.00  1.80           C  
ATOM    344  H   TRP A  20      22.692   5.411 -11.349  1.00  1.48           H  
ATOM    345  HA  TRP A  20      20.201   4.251 -11.171  1.00  1.57           H  
ATOM    346 1HB  TRP A  20      22.842   3.168 -12.117  1.00  2.16           H  
ATOM    347 2HB  TRP A  20      21.407   2.157 -12.144  1.00  2.16           H  
ATOM    348  HD1 TRP A  20      23.177   4.697 -14.204  1.00  2.16           H  
ATOM    349  HE1 TRP A  20      21.689   5.432 -16.184  1.00  2.16           H  
ATOM    350  HE3 TRP A  20      18.740   2.708 -12.625  1.00  2.16           H  
ATOM    351  HZ2 TRP A  20      18.993   5.169 -16.949  1.00  2.16           H  
ATOM    352  HZ3 TRP A  20      16.749   2.958 -14.030  1.00  2.16           H  
ATOM    353  HH2 TRP A  20      16.863   4.172 -16.162  1.00  2.16           H  
ATOM    354  N   LYS A  21      22.269   2.525  -9.231  1.00  1.42           N  
ATOM    355  CA  LYS A  21      22.270   1.556  -8.136  1.00  1.74           C  
ATOM    356  C   LYS A  21      21.597   2.078  -6.865  1.00  1.53           C  
ATOM    357  O   LYS A  21      21.149   1.283  -6.031  1.00  1.75           O  
ATOM    358  CB  LYS A  21      23.706   1.125  -7.809  1.00  2.31           C  
ATOM    359  CG  LYS A  21      24.576   2.212  -7.162  1.00  2.31           C  
ATOM    360  CD  LYS A  21      26.005   1.735  -6.926  1.00  2.31           C  
ATOM    361  CE  LYS A  21      26.838   2.812  -6.228  1.00  2.31           C  
ATOM    362  NZ  LYS A  21      28.249   2.374  -6.012  1.00  2.31           N  
ATOM    363  H   LYS A  21      23.140   2.858  -9.615  1.00  1.70           H  
ATOM    364  HA  LYS A  21      21.714   0.678  -8.466  1.00  2.09           H  
ATOM    365 1HB  LYS A  21      23.680   0.272  -7.131  1.00  2.77           H  
ATOM    366 2HB  LYS A  21      24.202   0.800  -8.724  1.00  2.77           H  
ATOM    367 1HG  LYS A  21      24.584   3.108  -7.781  1.00  2.77           H  
ATOM    368 2HG  LYS A  21      24.158   2.464  -6.190  1.00  2.77           H  
ATOM    369 1HD  LYS A  21      25.989   0.839  -6.305  1.00  2.77           H  
ATOM    370 2HD  LYS A  21      26.472   1.487  -7.880  1.00  2.77           H  
ATOM    371 1HE  LYS A  21      26.837   3.714  -6.840  1.00  2.77           H  
ATOM    372 2HE  LYS A  21      26.387   3.040  -5.262  1.00  2.77           H  
ATOM    373 1HZ  LYS A  21      28.764   3.111  -5.550  1.00  2.77           H  
ATOM    374 2HZ  LYS A  21      28.262   1.544  -5.436  1.00  2.77           H  
ATOM    375 3HZ  LYS A  21      28.681   2.171  -6.903  1.00  2.77           H  
ATOM    376  N   VAL A  22      21.543   3.398  -6.711  1.00  1.34           N  
ATOM    377  CA  VAL A  22      20.999   4.050  -5.544  1.00  1.33           C  
ATOM    378  C   VAL A  22      19.491   4.124  -5.647  1.00  1.20           C  
ATOM    379  O   VAL A  22      18.794   3.854  -4.669  1.00  1.36           O  
ATOM    380  CB  VAL A  22      21.627   5.440  -5.362  1.00  1.87           C  
ATOM    381  CG1 VAL A  22      20.975   6.168  -4.248  1.00  1.87           C  
ATOM    382  CG2 VAL A  22      23.115   5.280  -5.059  1.00  1.87           C  
ATOM    383  H   VAL A  22      21.840   3.989  -7.484  1.00  1.61           H  
ATOM    384  HA  VAL A  22      21.254   3.450  -4.669  1.00  1.60           H  
ATOM    385  HB  VAL A  22      21.488   6.014  -6.269  1.00  2.24           H  
ATOM    386 1HG1 VAL A  22      21.444   7.140  -4.139  1.00  2.24           H  
ATOM    387 2HG1 VAL A  22      19.914   6.292  -4.447  1.00  2.24           H  
ATOM    388 3HG1 VAL A  22      21.105   5.604  -3.349  1.00  2.24           H  
ATOM    389 1HG2 VAL A  22      23.575   6.260  -4.934  1.00  2.24           H  
ATOM    390 2HG2 VAL A  22      23.245   4.704  -4.150  1.00  2.24           H  
ATOM    391 3HG2 VAL A  22      23.596   4.762  -5.872  1.00  2.24           H  
ATOM    392  N   ARG A  23      18.975   4.563  -6.802  1.00  1.22           N  
ATOM    393  CA  ARG A  23      17.526   4.641  -6.933  1.00  1.39           C  
ATOM    394  C   ARG A  23      16.911   3.241  -6.860  1.00  1.24           C  
ATOM    395  O   ARG A  23      15.800   3.079  -6.328  1.00  1.26           O  
ATOM    396  CB  ARG A  23      17.108   5.332  -8.241  1.00  1.87           C  
ATOM    397  CG  ARG A  23      17.350   4.550  -9.518  1.00  1.87           C  
ATOM    398  CD  ARG A  23      17.045   5.300 -10.768  1.00  1.87           C  
ATOM    399  NE  ARG A  23      18.048   6.320 -11.083  1.00  1.87           N  
ATOM    400  CZ  ARG A  23      18.154   6.955 -12.272  1.00  1.87           C  
ATOM    401  NH1 ARG A  23      17.323   6.675 -13.259  1.00  1.87           N  
ATOM    402  NH2 ARG A  23      19.097   7.862 -12.436  1.00  1.87           N  
ATOM    403  H   ARG A  23      19.608   4.826  -7.564  1.00  1.46           H  
ATOM    404  HA  ARG A  23      17.138   5.214  -6.099  1.00  1.67           H  
ATOM    405 1HB  ARG A  23      16.045   5.527  -8.201  1.00  2.24           H  
ATOM    406 2HB  ARG A  23      17.626   6.288  -8.338  1.00  2.24           H  
ATOM    407 1HG  ARG A  23      18.385   4.298  -9.561  1.00  2.24           H  
ATOM    408 2HG  ARG A  23      16.749   3.643  -9.531  1.00  2.24           H  
ATOM    409 1HD  ARG A  23      17.003   4.594 -11.589  1.00  2.24           H  
ATOM    410 2HD  ARG A  23      16.080   5.794 -10.659  1.00  2.24           H  
ATOM    411  HE  ARG A  23      18.714   6.589 -10.359  1.00  2.24           H  
ATOM    412 1HH1 ARG A  23      16.581   6.004 -13.126  1.00  2.24           H  
ATOM    413 2HH1 ARG A  23      17.409   7.167 -14.139  1.00  2.24           H  
ATOM    414 1HH2 ARG A  23      19.717   8.094 -11.639  1.00  2.24           H  
ATOM    415 2HH2 ARG A  23      19.199   8.347 -13.318  1.00  2.24           H  
ATOM    416  N   LYS A  24      17.657   2.228  -7.348  1.00  1.32           N  
ATOM    417  CA  LYS A  24      17.195   0.853  -7.306  1.00  1.31           C  
ATOM    418  C   LYS A  24      17.257   0.300  -5.896  1.00  1.34           C  
ATOM    419  O   LYS A  24      16.294  -0.333  -5.453  1.00  1.71           O  
ATOM    420  CB  LYS A  24      18.011  -0.040  -8.241  1.00  1.84           C  
ATOM    421  CG  LYS A  24      17.766   0.181  -9.738  1.00  1.84           C  
ATOM    422  CD  LYS A  24      18.643  -0.755 -10.574  1.00  1.84           C  
ATOM    423  CE  LYS A  24      18.402  -0.579 -12.070  1.00  1.84           C  
ATOM    424  NZ  LYS A  24      19.260  -1.491 -12.888  1.00  1.84           N  
ATOM    425  H   LYS A  24      18.551   2.437  -7.803  1.00  1.58           H  
ATOM    426  HA  LYS A  24      16.155   0.831  -7.628  1.00  1.57           H  
ATOM    427 1HB  LYS A  24      19.073   0.132  -8.055  1.00  2.21           H  
ATOM    428 2HB  LYS A  24      17.805  -1.085  -8.013  1.00  2.21           H  
ATOM    429 1HG  LYS A  24      16.718  -0.010  -9.964  1.00  2.21           H  
ATOM    430 2HG  LYS A  24      17.991   1.215  -9.995  1.00  2.21           H  
ATOM    431 1HD  LYS A  24      19.693  -0.538 -10.361  1.00  2.21           H  
ATOM    432 2HD  LYS A  24      18.440  -1.788 -10.301  1.00  2.21           H  
ATOM    433 1HE  LYS A  24      17.356  -0.785 -12.289  1.00  2.21           H  
ATOM    434 2HE  LYS A  24      18.624   0.445 -12.345  1.00  2.21           H  
ATOM    435 1HZ  LYS A  24      19.070  -1.342 -13.870  1.00  2.21           H  
ATOM    436 2HZ  LYS A  24      20.233  -1.298 -12.702  1.00  2.21           H  
ATOM    437 3HZ  LYS A  24      19.056  -2.452 -12.650  1.00  2.21           H  
ATOM    438  N   SER A  25      18.362   0.542  -5.179  1.00  1.16           N  
ATOM    439  CA  SER A  25      18.492   0.037  -3.827  1.00  1.30           C  
ATOM    440  C   SER A  25      17.471   0.703  -2.912  1.00  1.19           C  
ATOM    441  O   SER A  25      16.852   0.040  -2.081  1.00  1.23           O  
ATOM    442  CB  SER A  25      19.894   0.241  -3.323  1.00  1.77           C  
ATOM    443  OG  SER A  25      20.810  -0.521  -4.062  1.00  1.77           O  
ATOM    444  H   SER A  25      19.161   1.040  -5.576  1.00  1.39           H  
ATOM    445  HA  SER A  25      18.296  -1.034  -3.841  1.00  1.56           H  
ATOM    446 1HB  SER A  25      20.159   1.297  -3.373  1.00  2.12           H  
ATOM    447 2HB  SER A  25      19.924  -0.067  -2.298  1.00  2.12           H  
ATOM    448  HG  SER A  25      20.999   0.005  -4.866  1.00  2.12           H  
ATOM    449  N   PHE A  26      17.240   2.010  -3.090  1.00  1.29           N  
ATOM    450  CA  PHE A  26      16.260   2.727  -2.292  1.00  1.34           C  
ATOM    451  C   PHE A  26      14.921   2.010  -2.444  1.00  1.31           C  
ATOM    452  O   PHE A  26      14.236   1.728  -1.455  1.00  1.60           O  
ATOM    453  CB  PHE A  26      16.169   4.180  -2.743  1.00  1.86           C  
ATOM    454  CG  PHE A  26      15.264   5.061  -1.935  1.00  1.86           C  
ATOM    455  CD1 PHE A  26      15.744   5.707  -0.814  1.00  1.86           C  
ATOM    456  CD2 PHE A  26      13.959   5.255  -2.289  1.00  1.86           C  
ATOM    457  CE1 PHE A  26      14.936   6.545  -0.085  1.00  1.86           C  
ATOM    458  CE2 PHE A  26      13.132   6.082  -1.570  1.00  1.86           C  
ATOM    459  CZ  PHE A  26      13.627   6.736  -0.464  1.00  1.86           C  
ATOM    460  H   PHE A  26      17.793   2.540  -3.769  1.00  1.55           H  
ATOM    461  HA  PHE A  26      16.543   2.695  -1.247  1.00  1.61           H  
ATOM    462 1HB  PHE A  26      17.168   4.615  -2.729  1.00  2.23           H  
ATOM    463 2HB  PHE A  26      15.833   4.210  -3.781  1.00  2.23           H  
ATOM    464  HD1 PHE A  26      16.769   5.550  -0.510  1.00  2.23           H  
ATOM    465  HD2 PHE A  26      13.598   4.749  -3.143  1.00  2.23           H  
ATOM    466  HE1 PHE A  26      15.333   7.051   0.799  1.00  2.23           H  
ATOM    467  HE2 PHE A  26      12.097   6.224  -1.879  1.00  2.23           H  
ATOM    468  HZ  PHE A  26      12.997   7.401   0.115  1.00  2.23           H  
ATOM    469  N   PHE A  27      14.521   1.706  -3.689  1.00  1.19           N  
ATOM    470  CA  PHE A  27      13.274   0.979  -3.877  1.00  1.38           C  
ATOM    471  C   PHE A  27      13.289  -0.384  -3.159  1.00  1.36           C  
ATOM    472  O   PHE A  27      12.387  -0.724  -2.389  1.00  1.53           O  
ATOM    473  CB  PHE A  27      12.986   0.731  -5.354  1.00  1.85           C  
ATOM    474  CG  PHE A  27      11.712  -0.019  -5.571  1.00  1.85           C  
ATOM    475  CD1 PHE A  27      10.513   0.649  -5.486  1.00  1.85           C  
ATOM    476  CD2 PHE A  27      11.695  -1.373  -5.846  1.00  1.85           C  
ATOM    477  CE1 PHE A  27       9.318   0.015  -5.663  1.00  1.85           C  
ATOM    478  CE2 PHE A  27      10.497  -2.029  -6.028  1.00  1.85           C  
ATOM    479  CZ  PHE A  27       9.302  -1.330  -5.935  1.00  1.85           C  
ATOM    480  H   PHE A  27      15.071   2.001  -4.504  1.00  1.43           H  
ATOM    481  HA  PHE A  27      12.480   1.582  -3.477  1.00  1.66           H  
ATOM    482 1HB  PHE A  27      12.937   1.660  -5.882  1.00  2.22           H  
ATOM    483 2HB  PHE A  27      13.799   0.158  -5.794  1.00  2.22           H  
ATOM    484  HD1 PHE A  27      10.529   1.689  -5.266  1.00  2.22           H  
ATOM    485  HD2 PHE A  27      12.636  -1.921  -5.916  1.00  2.22           H  
ATOM    486  HE1 PHE A  27       8.383   0.578  -5.587  1.00  2.22           H  
ATOM    487  HE2 PHE A  27      10.487  -3.096  -6.241  1.00  2.22           H  
ATOM    488  HZ  PHE A  27       8.354  -1.847  -6.078  1.00  2.22           H  
ATOM    489  N   LYS A  28      14.329  -1.181  -3.420  1.00  1.45           N  
ATOM    490  CA  LYS A  28      14.426  -2.545  -2.889  1.00  1.67           C  
ATOM    491  C   LYS A  28      14.415  -2.636  -1.366  1.00  1.70           C  
ATOM    492  O   LYS A  28      13.864  -3.584  -0.802  1.00  1.97           O  
ATOM    493  CB  LYS A  28      15.671  -3.244  -3.425  1.00  2.25           C  
ATOM    494  CG  LYS A  28      15.598  -3.618  -4.900  1.00  2.25           C  
ATOM    495  CD  LYS A  28      16.887  -4.290  -5.361  1.00  2.25           C  
ATOM    496  CE  LYS A  28      16.826  -4.671  -6.839  1.00  2.25           C  
ATOM    497  NZ  LYS A  28      18.090  -5.322  -7.300  1.00  2.25           N  
ATOM    498  H   LYS A  28      15.068  -0.836  -4.039  1.00  1.74           H  
ATOM    499  HA  LYS A  28      13.557  -3.094  -3.248  1.00  2.00           H  
ATOM    500 1HB  LYS A  28      16.530  -2.589  -3.289  1.00  2.70           H  
ATOM    501 2HB  LYS A  28      15.856  -4.150  -2.849  1.00  2.70           H  
ATOM    502 1HG  LYS A  28      14.761  -4.297  -5.057  1.00  2.70           H  
ATOM    503 2HG  LYS A  28      15.427  -2.722  -5.493  1.00  2.70           H  
ATOM    504 1HD  LYS A  28      17.721  -3.604  -5.208  1.00  2.70           H  
ATOM    505 2HD  LYS A  28      17.062  -5.188  -4.770  1.00  2.70           H  
ATOM    506 1HE  LYS A  28      15.996  -5.358  -6.997  1.00  2.70           H  
ATOM    507 2HE  LYS A  28      16.658  -3.769  -7.432  1.00  2.70           H  
ATOM    508 1HZ  LYS A  28      18.010  -5.558  -8.280  1.00  2.70           H  
ATOM    509 2HZ  LYS A  28      18.865  -4.689  -7.169  1.00  2.70           H  
ATOM    510 3HZ  LYS A  28      18.251  -6.165  -6.765  1.00  2.70           H  
ATOM    511  N   LEU A  29      14.979  -1.639  -0.696  1.00  1.61           N  
ATOM    512  CA  LEU A  29      15.059  -1.648   0.752  1.00  1.85           C  
ATOM    513  C   LEU A  29      13.996  -0.760   1.401  1.00  1.86           C  
ATOM    514  O   LEU A  29      14.104  -0.405   2.584  1.00  2.14           O  
ATOM    515  CB  LEU A  29      16.441  -1.140   1.193  1.00  2.50           C  
ATOM    516  CG  LEU A  29      17.622  -2.130   1.222  1.00  2.50           C  
ATOM    517  CD1 LEU A  29      18.129  -2.415  -0.205  1.00  2.50           C  
ATOM    518  CD2 LEU A  29      18.717  -1.527   2.089  1.00  2.50           C  
ATOM    519  H   LEU A  29      15.461  -0.904  -1.226  1.00  1.93           H  
ATOM    520  HA  LEU A  29      14.916  -2.669   1.100  1.00  2.22           H  
ATOM    521 1HB  LEU A  29      16.712  -0.347   0.508  1.00  3.00           H  
ATOM    522 2HB  LEU A  29      16.362  -0.713   2.163  1.00  3.00           H  
ATOM    523  HG  LEU A  29      17.298  -3.074   1.657  1.00  3.00           H  
ATOM    524 1HD1 LEU A  29      18.964  -3.112  -0.159  1.00  3.00           H  
ATOM    525 2HD1 LEU A  29      17.345  -2.852  -0.803  1.00  3.00           H  
ATOM    526 3HD1 LEU A  29      18.459  -1.486  -0.668  1.00  3.00           H  
ATOM    527 1HD2 LEU A  29      19.563  -2.211   2.141  1.00  3.00           H  
ATOM    528 2HD2 LEU A  29      19.030  -0.605   1.661  1.00  3.00           H  
ATOM    529 3HD2 LEU A  29      18.331  -1.348   3.097  1.00  3.00           H  
ATOM    530  N   GLN A  30      12.953  -0.417   0.644  1.00  1.81           N  
ATOM    531  CA  GLN A  30      11.829   0.391   1.111  1.00  2.06           C  
ATOM    532  C   GLN A  30      12.246   1.694   1.770  1.00  1.83           C  
ATOM    533  O   GLN A  30      11.719   2.078   2.818  1.00  2.08           O  
ATOM    534  CB  GLN A  30      10.895  -0.386   2.045  1.00  2.78           C  
ATOM    535  CG  GLN A  30      10.228  -1.573   1.391  1.00  2.78           C  
ATOM    536  CD  GLN A  30       9.174  -2.217   2.272  1.00  2.78           C  
ATOM    537  OE1 GLN A  30       8.327  -1.528   2.858  1.00  2.78           O  
ATOM    538  NE2 GLN A  30       9.212  -3.541   2.371  1.00  2.78           N  
ATOM    539  H   GLN A  30      12.924  -0.707  -0.343  1.00  2.17           H  
ATOM    540  HA  GLN A  30      11.249   0.639   0.240  1.00  2.47           H  
ATOM    541 1HB  GLN A  30      11.452  -0.737   2.913  1.00  3.34           H  
ATOM    542 2HB  GLN A  30      10.111   0.280   2.404  1.00  3.34           H  
ATOM    543 1HG  GLN A  30       9.752  -1.238   0.471  1.00  3.34           H  
ATOM    544 2HG  GLN A  30      10.992  -2.317   1.165  1.00  3.34           H  
ATOM    545 1HE2 GLN A  30       8.539  -4.021   2.938  1.00  3.34           H  
ATOM    546 2HE2 GLN A  30       9.913  -4.061   1.880  1.00  3.34           H  
ATOM    547  N   GLY A  31      13.213   2.368   1.171  1.00  1.71           N  
ATOM    548  CA  GLY A  31      13.690   3.651   1.635  1.00  1.88           C  
ATOM    549  C   GLY A  31      14.727   3.600   2.753  1.00  1.75           C  
ATOM    550  O   GLY A  31      15.253   4.639   3.151  1.00  2.03           O  
ATOM    551  H   GLY A  31      13.609   2.002   0.300  1.00  2.05           H  
ATOM    552 1HA  GLY A  31      14.121   4.149   0.783  1.00  2.26           H  
ATOM    553 2HA  GLY A  31      12.841   4.252   1.954  1.00  2.26           H  
ATOM    554  N   SER A  32      15.061   2.406   3.258  1.00  1.58           N  
ATOM    555  CA  SER A  32      16.038   2.303   4.343  1.00  1.58           C  
ATOM    556  C   SER A  32      17.481   2.355   3.840  1.00  1.55           C  
ATOM    557  O   SER A  32      18.427   2.414   4.627  1.00  1.76           O  
ATOM    558  CB  SER A  32      15.799   1.052   5.177  1.00  2.21           C  
ATOM    559  OG  SER A  32      16.069  -0.110   4.465  1.00  2.21           O  
ATOM    560  H   SER A  32      14.592   1.558   2.932  1.00  1.90           H  
ATOM    561  HA  SER A  32      15.892   3.158   5.004  1.00  1.90           H  
ATOM    562 1HB  SER A  32      16.432   1.091   6.059  1.00  2.65           H  
ATOM    563 2HB  SER A  32      14.763   1.037   5.515  1.00  2.65           H  
ATOM    564  HG  SER A  32      15.280  -0.269   3.900  1.00  2.65           H  
ATOM    565  N   PHE A  33      17.651   2.313   2.523  1.00  1.64           N  
ATOM    566  CA  PHE A  33      18.969   2.344   1.907  1.00  1.76           C  
ATOM    567  C   PHE A  33      19.700   3.648   2.183  1.00  1.62           C  
ATOM    568  O   PHE A  33      19.170   4.749   1.989  1.00  1.87           O  
ATOM    569  CB  PHE A  33      18.886   2.142   0.403  1.00  2.42           C  
ATOM    570  CG  PHE A  33      20.212   2.124  -0.243  1.00  2.42           C  
ATOM    571  CD1 PHE A  33      21.060   1.045  -0.110  1.00  2.42           C  
ATOM    572  CD2 PHE A  33      20.622   3.188  -0.997  1.00  2.42           C  
ATOM    573  CE1 PHE A  33      22.286   1.052  -0.711  1.00  2.42           C  
ATOM    574  CE2 PHE A  33      21.848   3.195  -1.598  1.00  2.42           C  
ATOM    575  CZ  PHE A  33      22.678   2.132  -1.457  1.00  2.42           C  
ATOM    576  H   PHE A  33      16.821   2.267   1.954  1.00  1.97           H  
ATOM    577  HA  PHE A  33      19.562   1.540   2.336  1.00  2.11           H  
ATOM    578 1HB  PHE A  33      18.369   1.223   0.160  1.00  2.90           H  
ATOM    579 2HB  PHE A  33      18.333   2.965  -0.018  1.00  2.90           H  
ATOM    580  HD1 PHE A  33      20.756   0.187   0.474  1.00  2.90           H  
ATOM    581  HD2 PHE A  33      19.961   4.019  -1.099  1.00  2.90           H  
ATOM    582  HE1 PHE A  33      22.952   0.198  -0.603  1.00  2.90           H  
ATOM    583  HE2 PHE A  33      22.168   4.036  -2.184  1.00  2.90           H  
ATOM    584  HZ  PHE A  33      23.655   2.138  -1.938  1.00  2.90           H  
ATOM    585  N   ASP A  34      20.973   3.535   2.543  1.00  1.63           N  
ATOM    586  CA  ASP A  34      21.786   4.704   2.826  1.00  1.78           C  
ATOM    587  C   ASP A  34      22.244   5.376   1.532  1.00  1.68           C  
ATOM    588  O   ASP A  34      23.376   5.198   1.075  1.00  2.08           O  
ATOM    589  CB  ASP A  34      23.005   4.294   3.670  1.00  2.43           C  
ATOM    590  CG  ASP A  34      23.809   5.473   4.254  1.00  2.43           C  
ATOM    591  OD1 ASP A  34      23.307   6.574   4.257  1.00  2.43           O  
ATOM    592  OD2 ASP A  34      24.907   5.244   4.723  1.00  2.43           O  
ATOM    593  H   ASP A  34      21.373   2.620   2.691  1.00  1.96           H  
ATOM    594  HA  ASP A  34      21.187   5.419   3.391  1.00  2.14           H  
ATOM    595 1HB  ASP A  34      22.672   3.664   4.495  1.00  2.92           H  
ATOM    596 2HB  ASP A  34      23.676   3.693   3.055  1.00  2.92           H  
ATOM    597  N   VAL A  35      21.331   6.130   0.926  1.00  1.52           N  
ATOM    598  CA  VAL A  35      21.619   6.801  -0.335  1.00  1.70           C  
ATOM    599  C   VAL A  35      22.798   7.743  -0.116  1.00  1.59           C  
ATOM    600  O   VAL A  35      22.861   8.450   0.885  1.00  1.96           O  
ATOM    601  CB  VAL A  35      20.388   7.610  -0.859  1.00  2.31           C  
ATOM    602  CG1 VAL A  35      19.196   6.686  -1.132  1.00  2.31           C  
ATOM    603  CG2 VAL A  35      19.980   8.684   0.156  1.00  2.31           C  
ATOM    604  H   VAL A  35      20.414   6.149   1.374  1.00  1.82           H  
ATOM    605  HA  VAL A  35      21.900   6.059  -1.076  1.00  2.04           H  
ATOM    606  HB  VAL A  35      20.653   8.086  -1.799  1.00  2.77           H  
ATOM    607 1HG1 VAL A  35      18.356   7.275  -1.506  1.00  2.77           H  
ATOM    608 2HG1 VAL A  35      19.450   5.949  -1.860  1.00  2.77           H  
ATOM    609 3HG1 VAL A  35      18.911   6.196  -0.205  1.00  2.77           H  
ATOM    610 1HG2 VAL A  35      19.129   9.236  -0.219  1.00  2.77           H  
ATOM    611 2HG2 VAL A  35      19.710   8.214   1.099  1.00  2.77           H  
ATOM    612 3HG2 VAL A  35      20.788   9.390   0.330  1.00  2.77           H  
ATOM    613  N   SER A  36      23.720   7.771  -1.073  1.00  1.60           N  
ATOM    614  CA  SER A  36      24.917   8.608  -1.024  1.00  1.88           C  
ATOM    615  C   SER A  36      24.667  10.056  -1.442  1.00  1.90           C  
ATOM    616  O   SER A  36      25.569  10.897  -1.402  1.00  2.22           O  
ATOM    617  CB  SER A  36      25.974   8.000  -1.921  1.00  2.53           C  
ATOM    618  OG  SER A  36      25.565   8.031  -3.266  1.00  2.53           O  
ATOM    619  H   SER A  36      23.619   7.158  -1.869  1.00  1.92           H  
ATOM    620  HA  SER A  36      25.283   8.610   0.004  1.00  2.26           H  
ATOM    621 1HB  SER A  36      26.909   8.551  -1.808  1.00  3.04           H  
ATOM    622 2HB  SER A  36      26.161   6.973  -1.618  1.00  3.04           H  
ATOM    623  HG  SER A  36      26.298   7.663  -3.771  1.00  3.04           H  
ATOM    624  N   VAL A  37      23.457  10.305  -1.901  1.00  2.21           N  
ATOM    625  CA  VAL A  37      23.022  11.576  -2.441  1.00  2.67           C  
ATOM    626  C   VAL A  37      22.503  12.527  -1.373  1.00  3.13           C  
ATOM    627  O   VAL A  37      22.650  13.739  -1.524  1.00  3.47           O  
ATOM    628  OXT VAL A  37      21.601  12.127  -0.641  1.00  4.00           O  
ATOM    629  CB  VAL A  37      21.927  11.292  -3.462  1.00  3.33           C  
ATOM    630  CG1 VAL A  37      21.354  12.577  -4.062  1.00  3.33           C  
ATOM    631  CG2 VAL A  37      22.492  10.396  -4.521  1.00  3.33           C  
ATOM    632  H   VAL A  37      22.802   9.543  -1.844  1.00  2.65           H  
ATOM    633  HA  VAL A  37      23.872  12.042  -2.943  1.00  3.20           H  
ATOM    634  HB  VAL A  37      21.127  10.790  -2.961  1.00  4.00           H  
ATOM    635 1HG1 VAL A  37      20.569  12.326  -4.776  1.00  4.00           H  
ATOM    636 2HG1 VAL A  37      20.934  13.201  -3.275  1.00  4.00           H  
ATOM    637 3HG1 VAL A  37      22.143  13.121  -4.573  1.00  4.00           H  
ATOM    638 1HG2 VAL A  37      21.722  10.175  -5.207  1.00  4.00           H  
ATOM    639 2HG2 VAL A  37      23.305  10.911  -5.028  1.00  4.00           H  
ATOM    640 3HG2 VAL A  37      22.865   9.475  -4.089  1.00  4.00           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 -209.083 23.2061 145.923 -16.0121 3.08316 9.18872 77.4212 -83.9691 -0.14587 -0.9302 -69.5914 -8.06044 -27.8651 -1.51688 -2.11383 -2.93669 0 -0.63268 2.19954 22.3585 36.1182 -8.21132 4.34443 -3.16841 -7.74081 17.8345 -100.3
ASP:NtermProteinFull_1 -2.77858 0.0793 4.417 -0.24191 0.06837 0.78427 1.9379 -1.86251 -0 -0 -3.52196 -0.28772 0 0 -0.60189 0 0 -0.039 0.00737 0 1.92864 0 0 -2.3716 0 0.08161 -2.40071
TRP_2 -5.07816 0.46019 2.63681 -1.42479 0.15 0.68438 1.72007 -1.82164 -0 -0 -1.43131 -0.28048 0 0 0 0 0 -0.00433 0.07743 0 1.70298 -0.27743 0 1.6906 -0.00336 0.34978 -0.84922
PHE_3 -10.7504 1.64911 4.31184 -1.15117 0.19084 0.51214 2.58351 -3.35131 -0.00977 -0.06147 -2.26576 0.08487 0 0 0 0 0 -0.01154 0.00745 0 1.86067 -0.35491 0 1.0402 -0.01216 0.95893 -4.76894
LYS_4 -5.54979 0.33271 7.63223 -0.49017 0.11777 0.40738 3.03144 -3.26131 -0 -0 -4.92473 -0.03001 0 0 -0.60189 -0.79551 0 -0.02631 0.03023 2.30702 0 0.03079 0 -1.5107 -0.08931 1.11273 -2.27745
ALA_5 -4.1972 0.23876 4.79362 -0.021 0 0 2.25295 -2.45125 -0 -0 -1.61161 -0.35002 0 0 0 0 0 0.05777 0 0 0 -0.2153 0 1.8394 -0.24555 0.49894 0.5895
PHE_6 -8.51928 0.78976 3.87093 -0.94738 0.06961 0.27653 3.17181 -2.88696 -0 -0 -2.76551 -0.09612 0 0 0 0 0 -0.00532 0.34933 0 1.77017 -0.46081 0 1.0402 -0.12766 0.3011 -4.16961
TYR_7 -10.3621 1.50034 5.08727 -0.93713 0.07395 0.35857 3.67566 -3.63812 -0.01294 -0.12028 -3.47536 -0.27725 0 0 0 0 0 -0.00735 0.12306 0 1.75239 -0.42355 0.24678 1.2797 0.08758 0.55524 -4.51357
ASP_8 -4.68836 0.14352 6.46183 -0.10318 0.00593 0.30928 2.70552 -2.94649 -0.02177 -0.11668 -3.87485 -0.4164 0 0 0 -0.79551 0 -0.00036 0.00611 0 1.68327 0.06927 0 -2.3716 -0.07346 0.48363 -3.54029
LYS_9 -3.60906 0.28997 4.17303 -0.29997 0.02977 0.13436 1.88688 -1.98551 -0 -0 -1.12452 -0.03155 0 0 0 0 0 -0.0081 0.0159 1.8468 0 -0.06496 0 -1.5107 -0.22204 0.29115 -0.18856
VAL_10 -6.07069 0.76932 2.9784 -0.2895 0.13946 0.05202 2.94921 -2.45461 -0 -0 -2.9339 0.20881 0 0 0 0 0 -0.01928 0.00012 0.36952 0 0.42472 0 1.9342 -0.1089 0.45669 -1.5944
ALA_11 -5.60967 0.75837 4.42749 -0.02377 0 0 3.26482 -2.78466 -0 -0 -2.82877 -0.37611 0 0 0 0 0 -0.08618 0 0 0 -0.40767 0 1.8394 -0.29498 0.57823 -1.54349
GLU_12 -3.41424 0.23834 5.08552 -0.45874 0.06637 0.90752 1.49434 -2.12479 -0.012 -0.05521 -2.30746 -0.46136 0 0 0 -0.67283 0 0.06447 0.00713 0 3.48698 -0.34563 0 -2.7348 -0.64859 0.37859 -1.50639
LYS_13 -4.5854 0.38795 4.42543 -0.40381 0.04865 0.21034 2.61425 -2.26119 -0.02264 -0.09167 -2.81211 -0.1102 0 0 0 0 0 -0.03653 0.00236 2.25075 0 -0.10359 0 -1.5107 -0.37285 0.33345 -2.03751
PHE_14 -10.8655 1.76592 3.28401 -0.59627 0.02208 0.23861 2.83313 -2.98543 -0 -0 -0.9919 0.02781 0 0 0 0 0 -0.04353 0.13779 0 3.08157 0.03126 0 1.0402 -0.09364 0.53458 -2.57935
LYS_15 -5.04976 0.40548 6.27987 -0.31515 0.02659 0.15504 2.17891 -2.64789 -0 -0 -3.80175 -0.02227 0 0 0 -0.67283 0 -0.13921 0.06846 1.74921 0 -0.04231 0 -1.5107 -0.22225 0.57078 -2.98976
GLU_16 -2.25262 0.24693 3.11662 -0.2021 0.029 0.30124 1.11622 -1.43131 -0 -0 -0.26138 -0.53969 0 0 0 0 0 -0.01741 0.0079 0 2.94435 -0.06294 0 -2.7348 0.21481 0.35364 0.82848
ALA_17 -3.22221 0.30417 1.44578 -0.02536 0.00145 0 1.07672 -1.24265 -0 -0 -0.74893 -0.36555 0 0 0 0 0 -0.01521 0 0 0 0.13646 0 1.8394 0.30599 0.44481 -0.06513
PHE_18 -9.61708 1.9917 1.30025 -0.51843 0.19519 0.25105 1.89644 -2.047 -0.02264 -0.09167 -0.79571 -0.05947 0 0 -0.45503 0 0 0.10136 0.03819 0 2.58088 -0.30669 0 1.0402 -0.02337 1.29464 -3.24718
PRO_19 -4.90421 0.68494 3.4845 -0.121 0.00056 0.08994 1.9619 -1.58472 -0.01108 -0.08627 -2.05325 0.26488 0 0 0 0 0 -0.05881 0.03977 0.18061 0 -1.13493 0 -2.4119 -0.35443 1.10414 -4.90936
TRP_20 -5.3393 0.53306 4.73244 -0.98809 0.07964 0.31043 1.89727 -2.23026 -0 -0 -0.94581 -0.38446 0 0 0 0 0 -0.02621 0.09921 0 2.76299 -0.49542 0 1.6906 0.02165 0.24713 1.96486
LYS_21 -3.67892 0.17333 3.41549 -0.41953 0.07074 0.21785 1.33801 -1.64501 -0 -0 -1.52963 0.11896 0 0 0 0 0 -0.06526 0.01885 1.54479 0 -0.02578 0 -1.5107 0.06205 0.27811 -1.63666
VAL_22 -8.42655 1.06453 3.74288 -0.30932 0.21338 0.06985 2.86068 -2.62129 -0 -0 -1.44149 -0.27477 0 0 0 0 0 0.01121 0.00109 0.19943 0 -0.41607 0 1.9342 -0.31562 0.39456 -3.31328
ARG_23 -10.7933 0.69008 9.56203 -0.64893 0.10003 0.41357 3.5916 -4.54822 -0 -0 -4.45985 0.77743 0 0 -0.45503 0 0 0.03994 0.43982 2.75762 0 -0.17935 0 -1.2888 -0.23176 0.49404 -3.73907
LYS_24 -5.6241 0.41415 6.02192 -0.29316 0.02184 0.12379 2.52061 -2.66265 -0.01108 -0.08627 -2.02975 -0.04188 0 0 0 0 0 0.00061 0.0269 1.89169 0 -0.06844 0 -1.5107 -0.27275 0.41047 -1.16881
SER_25 -6.15224 0.47815 5.74326 -0.03071 0 0.02169 3.12894 -2.91144 -0 -0 -3.15337 -0.02592 0 0 0 0 0 0.07253 0.00625 0.49289 0 0.29696 1.73944 -0.77834 -0.05466 0.31795 -0.80861
PHE_26 -9.83144 1.26823 3.90676 -0.78447 0.03701 0.2542 2.87942 -3.12758 -0.00042 -0.00657 -3.04387 -0.07261 0 0 0 0 0 0.0894 0.19122 0 1.91324 -0.44864 0 1.0402 -0.02289 0.45876 -5.30004
PHE_27 -6.97788 0.89614 4.08015 -0.94789 0.06525 0.32559 2.03181 -2.52502 -0.01294 -0.12028 -1.35695 0.02135 0 0 0 0 0 0.0606 0.03771 0 1.73973 -0.46932 0 1.0402 0.07361 0.43554 -1.6026
LYS_28 -4.06181 0.19534 3.75263 -0.3114 0.02716 0.1433 1.63326 -1.81779 -0 -0 -0.84741 0.00214 0 0 0 0 0 -0.08563 0.01395 1.72918 0 -0.07423 0 -1.5107 -0.23642 0.37049 -1.07793
LEU_29 -6.05701 0.56703 4.48491 -0.52518 0.28892 0.1677 2.49998 -2.50214 -0 -0 -2.97225 -0.08909 0 0 0 0 0 -0.04215 0.23271 2.3223 0 -0.00059 0 0.18072 -0.40582 0.41211 -1.43785
GLN_30 -4.1935 0.55906 3.02064 -0.30282 0.06138 0.2667 1.44826 -1.72039 -0 -0 -1.58028 -0.78574 0 0 0 0 0 -0.05258 0.08573 0 2.71426 -0.19068 0 -0.18838 -0.26929 0.42441 -0.70321
GLY_31 -3.26625 0.51347 2.70974 -5e-05 0 0 1.08726 -1.64568 -0 -0 -0.84375 -0.39671 0 0 0 0 0 -0.16145 0 0 0 -1.45162 0 0.83697 -0.67656 0.44657 -2.84806
SER_32 -2.47038 0.21465 3.08683 -0.0387 0.00115 0.05369 1.63004 -1.42996 -0 -0 -1.90584 -0.29432 0 0 0 0 0 -0.0437 0.00342 0.30451 0 -0.29385 1.75524 -0.77834 -0.87396 0.38643 -0.69309
PHE_33 -7.86365 1.07588 2.98432 -0.83563 0.06788 0.08326 1.36081 -2.3542 -0.00277 -0.04282 -0.03418 -0.42115 0 0 0 0 0 -0.06211 0.00225 0 2.11576 0.10528 0 1.0402 -0.66571 0.35877 -3.08782
ASP_34 -2.16466 0.08076 2.09982 -0.23269 0.03406 0.76337 0.47613 -1.1895 -0.00409 -0.04363 0.34904 -0.70304 0 0 0 0 0 0.01099 0.08474 0 2.08028 -0.72937 0 -2.3716 -0.33386 0.34632 -1.44696
VAL_35 -5.31232 0.79534 1.48654 -0.33924 0.45727 0.07398 1.31142 -1.54941 -0.00174 -0.00737 0.20173 -0.23388 0 0 0 0 0 -0.09456 0.00551 2.01357 0 0.03313 0 1.9342 -0.30779 0.37646 0.84281
SER_36 -1.53881 0.02687 1.38531 -0.03249 0.00239 0.05552 0.57847 -0.74688 -0 -0 0.26895 -1.02351 0 0 0 0 0 0.01055 0.01058 0.29492 0 -0.29511 0.60297 -0.77834 -0.61379 0.39996 -1.39244
VAL:CtermProteinFull_37 -4.20635 0.62327 0.49519 -0.40095 0.31948 0.17155 0.79556 -0.97233 -0 -0 0.26412 -1.11542 0 0 0 0 0 0 0.02099 0.10371 0 0 0 1.9342 -0.33307 0.59376 -1.7063
#END_POSE_ENERGIES_TABLE best_scoring0001_0001.pdb

ENDMDL

REMARK ID 691851 DOMAINID 682966 MODEL 2 pep1_AB
MODEL     2
REMARK    Rerank model04.pdb to model02.pdb score: 19.677
REMARK    CLUSTER 0004 t000_.out.valid.rescored.best_scoring.binary cluster_size: 7 cluster_threshold: 2.176304
REMARK    SCORE     cart_bonded:          18.015
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE        hbond_sc:          -1.550
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE          fa_sol:         122.410
REMARK    SCORE           score:         -80.106
REMARK    SCORE     total_score:         -80.106
REMARK    SCORE             ref:           9.690
REMARK    SCORE     lk_ball_wtd:          -6.339
REMARK    SCORE         p_aa_pp:          -6.280
REMARK    SCORE     rama_prepro:          -4.668
REMARK    SCORE fa_intra_sol_xover4:           8.286
REMARK    SCORE           omega:          -0.324
REMARK    SCORE     hbond_lr_bb:          -1.285
REMARK    SCORE         fa_elec:         -61.396
REMARK    SCORE     description: cluster0004_0001
REMARK    SCORE          fa_atr:        -205.182
REMARK    SCORE     hbond_bb_sc:          -1.130
REMARK    SCORE    fa_intra_rep:           0.472
REMARK    SCORE            time:           0.000
REMARK    SCORE     hbond_sr_bb:         -23.673
REMARK    SCORE          fa_dun:          49.816
REMARK    SCORE          fa_rep:          23.031
ATOM      1  N   ASP A   1      -1.213   0.529   0.588  1.00  2.950          N  
ATOM      2  CA  ASP A   1       0.230   0.325   0.639  1.00  2.580          C  
ATOM      3  C   ASP A   1       0.946   1.660   0.412  1.00  2.180          C  
ATOM      4  O   ASP A   1       1.006   2.170  -0.717  1.00  1.880          O  
ATOM      5  CB  ASP A   1       0.632  -0.749  -0.390  1.00  3.760          C  
ATOM      6  CG  ASP A   1       2.117  -1.135  -0.385  1.00  3.760          C  
ATOM      7  OD1 ASP A   1       2.935  -0.319  -0.015  1.00  3.760          O  
ATOM      8  OD2 ASP A   1       2.422  -2.274  -0.732  1.00  3.760          O  
ATOM      9 1H   ASP A   1      -1.665  -0.134   1.201  1.00  3.540          H  
ATOM     10 2H   ASP A   1      -1.432   1.468   0.889  1.00  3.540          H  
ATOM     11 3H   ASP A   1      -1.540   0.393  -0.356  1.00  3.540          H  
ATOM     12  HA  ASP A   1       0.497  -0.039   1.631  1.00  3.100          H  
ATOM     13 1HB  ASP A   1       0.044  -1.651  -0.214  1.00  4.510          H  
ATOM     14 2HB  ASP A   1       0.381  -0.392  -1.391  1.00  4.510          H  
ATOM     15  N   TRP A   2       1.418   2.253   1.520  1.00  2.290          N  
ATOM     16  CA  TRP A   2       2.085   3.553   1.483  1.00  2.040          C  
ATOM     17  C   TRP A   2       3.335   3.537   0.656  1.00  1.650          C  
ATOM     18  O   TRP A   2       3.574   4.466  -0.109  1.00  1.340          O  
ATOM     19  CB  TRP A   2       2.461   4.062   2.875  1.00  2.960          C  
ATOM     20  CG  TRP A   2       3.150   5.412   2.802  1.00  2.960          C  
ATOM     21  CD1 TRP A   2       2.523   6.617   2.757  1.00  2.960          C  
ATOM     22  CD2 TRP A   2       4.581   5.708   2.763  1.00  2.960          C  
ATOM     23  NE1 TRP A   2       3.444   7.628   2.680  1.00  2.960          N  
ATOM     24  CE2 TRP A   2       4.704   7.089   2.687  1.00  2.960          C  
ATOM     25  CE3 TRP A   2       5.735   4.926   2.786  1.00  2.960          C  
ATOM     26  CZ2 TRP A   2       5.938   7.711   2.627  1.00  2.960          C  
ATOM     27  CZ3 TRP A   2       6.965   5.552   2.721  1.00  2.960          C  
ATOM     28  CH2 TRP A   2       7.065   6.899   2.645  1.00  2.960          C  
ATOM     29  H   TRP A   2       1.328   1.780   2.409  1.00  2.750          H  
ATOM     30  HA  TRP A   2       1.399   4.273   1.038  1.00  2.450          H  
ATOM     31 1HB  TRP A   2       1.571   4.153   3.493  1.00  3.550          H  
ATOM     32 2HB  TRP A   2       3.136   3.357   3.356  1.00  3.550          H  
ATOM     33  HD1 TRP A   2       1.443   6.758   2.769  1.00  3.550          H  
ATOM     34  HE1 TRP A   2       3.229   8.612   2.632  1.00  3.550          H  
ATOM     35  HE3 TRP A   2       5.670   3.855   2.847  1.00  3.550          H  
ATOM     36  HZ2 TRP A   2       6.042   8.792   2.563  1.00  3.550          H  
ATOM     37  HZ3 TRP A   2       7.857   4.946   2.731  1.00  3.550          H  
ATOM     38  HH2 TRP A   2       8.054   7.355   2.595  1.00  3.550          H  
ATOM     39  N   PHE A   3       4.160   2.512   0.838  1.00  1.780          N  
ATOM     40  CA  PHE A   3       5.420   2.458   0.130  1.00  1.650          C  
ATOM     41  C   PHE A   3       5.213   2.434  -1.355  1.00  1.240          C  
ATOM     42  O   PHE A   3       5.880   3.174  -2.072  1.00  1.120          O  
ATOM     43  CB  PHE A   3       6.227   1.256   0.580  1.00  2.360          C  
ATOM     44  CG  PHE A   3       6.951   1.505   1.842  1.00  2.360          C  
ATOM     45  CD1 PHE A   3       6.438   1.099   3.064  1.00  2.360          C  
ATOM     46  CD2 PHE A   3       8.172   2.158   1.813  1.00  2.360          C  
ATOM     47  CE1 PHE A   3       7.131   1.350   4.228  1.00  2.360          C  
ATOM     48  CE2 PHE A   3       8.867   2.403   2.970  1.00  2.360          C  
ATOM     49  CZ  PHE A   3       8.344   2.004   4.182  1.00  2.360          C  
ATOM     50  H   PHE A   3       3.895   1.763   1.465  1.00  2.140          H  
ATOM     51  HA  PHE A   3       5.989   3.351   0.379  1.00  1.980          H  
ATOM     52 1HB  PHE A   3       5.556   0.403   0.720  1.00  2.830          H  
ATOM     53 2HB  PHE A   3       6.934   0.987  -0.174  1.00  2.830          H  
ATOM     54  HD1 PHE A   3       5.479   0.581   3.103  1.00  2.830          H  
ATOM     55  HD2 PHE A   3       8.583   2.479   0.857  1.00  2.830          H  
ATOM     56  HE1 PHE A   3       6.721   1.032   5.187  1.00  2.830          H  
ATOM     57  HE2 PHE A   3       9.827   2.918   2.930  1.00  2.830          H  
ATOM     58  HZ  PHE A   3       8.892   2.201   5.102  1.00  2.830          H  
ATOM     59  N   LYS A   4       4.266   1.645  -1.845  1.00  1.230          N  
ATOM     60  CA  LYS A   4       4.092   1.652  -3.286  1.00  1.140          C  
ATOM     61  C   LYS A   4       3.619   3.018  -3.779  1.00  1.080          C  
ATOM     62  O   LYS A   4       4.140   3.531  -4.774  1.00  1.200          O  
ATOM     63  CB  LYS A   4       3.131   0.563  -3.726  1.00  1.630          C  
ATOM     64  CG  LYS A   4       3.709  -0.825  -3.599  1.00  1.630          C  
ATOM     65  CD  LYS A   4       2.717  -1.884  -4.061  1.00  1.630          C  
ATOM     66  CE  LYS A   4       3.287  -3.291  -3.905  1.00  1.630          C  
ATOM     67  NZ  LYS A   4       3.533  -3.623  -2.456  1.00  1.630          N  
ATOM     68  H   LYS A   4       3.719   1.027  -1.220  1.00  1.480          H  
ATOM     69  HA  LYS A   4       5.055   1.454  -3.748  1.00  1.370          H  
ATOM     70 1HB  LYS A   4       2.230   0.610  -3.113  1.00  1.960          H  
ATOM     71 2HB  LYS A   4       2.841   0.725  -4.762  1.00  1.960          H  
ATOM     72 1HG  LYS A   4       4.610  -0.893  -4.207  1.00  1.960          H  
ATOM     73 2HG  LYS A   4       3.983  -0.993  -2.563  1.00  1.960          H  
ATOM     74 1HD  LYS A   4       1.809  -1.811  -3.458  1.00  1.960          H  
ATOM     75 2HD  LYS A   4       2.458  -1.718  -5.104  1.00  1.960          H  
ATOM     76 1HE  LYS A   4       2.577  -4.008  -4.313  1.00  1.960          H  
ATOM     77 2HE  LYS A   4       4.226  -3.370  -4.451  1.00  1.960          H  
ATOM     78 1HZ  LYS A   4       3.897  -4.550  -2.363  1.00  1.960          H  
ATOM     79 2HZ  LYS A   4       4.185  -2.969  -2.052  1.00  1.960          H  
ATOM     80 3HZ  LYS A   4       2.658  -3.543  -1.913  1.00  1.960          H  
ATOM     81  N   ALA A   5       2.659   3.637  -3.062  1.00  1.170          N  
ATOM     82  CA  ALA A   5       2.166   4.943  -3.490  1.00  1.320          C  
ATOM     83  C   ALA A   5       3.300   5.956  -3.487  1.00  1.010          C  
ATOM     84  O   ALA A   5       3.420   6.773  -4.414  1.00  1.340          O  
ATOM     85  CB  ALA A   5       1.060   5.408  -2.560  1.00  1.790          C  
ATOM     86  H   ALA A   5       2.247   3.183  -2.240  1.00  1.400          H  
ATOM     87  HA  ALA A   5       1.784   4.851  -4.502  1.00  1.580          H  
ATOM     88 1HB  ALA A   5       0.689   6.373  -2.890  1.00  2.150          H  
ATOM     89 2HB  ALA A   5       0.249   4.680  -2.574  1.00  2.150          H  
ATOM     90 3HB  ALA A   5       1.455   5.491  -1.545  1.00  2.150          H  
ATOM     91  N   PHE A   6       4.137   5.876  -2.454  1.00  0.710          N  
ATOM     92  CA  PHE A   6       5.292   6.713  -2.274  1.00  0.830          C  
ATOM     93  C   PHE A   6       6.272   6.580  -3.387  1.00  0.890          C  
ATOM     94  O   PHE A   6       6.642   7.579  -3.994  1.00  0.760          O  
ATOM     95  CB  PHE A   6       5.975   6.380  -0.958  1.00  1.110          C  
ATOM     96  CG  PHE A   6       7.337   6.944  -0.795  1.00  1.110          C  
ATOM     97  CD1 PHE A   6       7.557   8.282  -0.551  1.00  1.110          C  
ATOM     98  CD2 PHE A   6       8.426   6.083  -0.864  1.00  1.110          C  
ATOM     99  CE1 PHE A   6       8.840   8.757  -0.386  1.00  1.110          C  
ATOM    100  CE2 PHE A   6       9.706   6.549  -0.701  1.00  1.110          C  
ATOM    101  CZ  PHE A   6       9.916   7.891  -0.460  1.00  1.110          C  
ATOM    102  H   PHE A   6       3.943   5.193  -1.722  1.00  0.850          H  
ATOM    103  HA  PHE A   6       4.955   7.748  -2.235  1.00  1.000          H  
ATOM    104 1HB  PHE A   6       5.354   6.732  -0.144  1.00  1.340          H  
ATOM    105 2HB  PHE A   6       6.042   5.319  -0.854  1.00  1.340          H  
ATOM    106  HD1 PHE A   6       6.709   8.962  -0.490  1.00  1.340          H  
ATOM    107  HD2 PHE A   6       8.248   5.018  -1.051  1.00  1.340          H  
ATOM    108  HE1 PHE A   6       9.005   9.818  -0.195  1.00  1.340          H  
ATOM    109  HE2 PHE A   6      10.554   5.857  -0.762  1.00  1.340          H  
ATOM    110  HZ  PHE A   6      10.925   8.271  -0.328  1.00  1.340          H  
ATOM    111  N   TYR A   7       6.676   5.352  -3.713  1.00  1.170          N  
ATOM    112  CA  TYR A   7       7.694   5.174  -4.728  1.00  1.340          C  
ATOM    113  C   TYR A   7       7.251   5.792  -6.042  1.00  1.260          C  
ATOM    114  O   TYR A   7       8.038   6.470  -6.699  1.00  1.190          O  
ATOM    115  CB  TYR A   7       8.052   3.705  -4.917  1.00  1.810          C  
ATOM    116  CG  TYR A   7       8.782   3.061  -3.724  1.00  1.810          C  
ATOM    117  CD1 TYR A   7       8.285   1.899  -3.187  1.00  1.810          C  
ATOM    118  CD2 TYR A   7       9.919   3.630  -3.162  1.00  1.810          C  
ATOM    119  CE1 TYR A   7       8.887   1.316  -2.116  1.00  1.810          C  
ATOM    120  CE2 TYR A   7      10.521   3.029  -2.077  1.00  1.810          C  
ATOM    121  CZ  TYR A   7       9.990   1.876  -1.552  1.00  1.810          C  
ATOM    122  OH  TYR A   7      10.566   1.238  -0.473  1.00  1.810          O  
ATOM    123  H   TYR A   7       6.309   4.543  -3.205  1.00  1.400          H  
ATOM    124  HA  TYR A   7       8.590   5.693  -4.397  1.00  1.610          H  
ATOM    125 1HB  TYR A   7       7.136   3.133  -5.108  1.00  2.170          H  
ATOM    126 2HB  TYR A   7       8.684   3.608  -5.784  1.00  2.170          H  
ATOM    127  HD1 TYR A   7       7.403   1.438  -3.621  1.00  2.170          H  
ATOM    128  HD2 TYR A   7      10.334   4.539  -3.554  1.00  2.170          H  
ATOM    129  HE1 TYR A   7       8.482   0.394  -1.709  1.00  2.170          H  
ATOM    130  HE2 TYR A   7      11.410   3.472  -1.629  1.00  2.170          H  
ATOM    131  HH  TYR A   7      11.533   1.416  -0.458  1.00  2.170          H  
ATOM    132  N   ASP A   8       5.983   5.627  -6.423  1.00  1.340          N  
ATOM    133  CA  ASP A   8       5.577   6.233  -7.687  1.00  1.420          C  
ATOM    134  C   ASP A   8       5.532   7.763  -7.636  1.00  1.160          C  
ATOM    135  O   ASP A   8       5.983   8.417  -8.583  1.00  1.210          O  
ATOM    136  CB  ASP A   8       4.210   5.705  -8.116  1.00  1.960          C  
ATOM    137  CG  ASP A   8       4.254   4.284  -8.648  1.00  1.960          C  
ATOM    138  OD1 ASP A   8       5.305   3.860  -9.078  1.00  1.960          O  
ATOM    139  OD2 ASP A   8       3.242   3.636  -8.625  1.00  1.960          O  
ATOM    140  H   ASP A   8       5.337   5.044  -5.875  1.00  1.610          H  
ATOM    141  HA  ASP A   8       6.303   5.946  -8.445  1.00  1.700          H  
ATOM    142 1HB  ASP A   8       3.539   5.730  -7.247  1.00  2.350          H  
ATOM    143 2HB  ASP A   8       3.790   6.358  -8.875  1.00  2.350          H  
ATOM    144  N   LYS A   9       5.017   8.333  -6.537  1.00  0.960          N  
ATOM    145  CA  LYS A   9       4.918   9.790  -6.439  1.00  0.870          C  
ATOM    146  C   LYS A   9       6.281  10.465  -6.342  1.00  0.720          C  
ATOM    147  O   LYS A   9       6.514  11.519  -6.963  1.00  0.760          O  
ATOM    148  CB  LYS A   9       4.074  10.170  -5.217  1.00  1.250          C  
ATOM    149  CG  LYS A   9       2.583   9.861  -5.352  1.00  1.250          C  
ATOM    150  CD  LYS A   9       1.819  10.215  -4.072  1.00  1.250          C  
ATOM    151  CE  LYS A   9       0.333   9.867  -4.185  1.00  1.250          C  
ATOM    152  NZ  LYS A   9      -0.416  10.194  -2.928  1.00  1.250          N  
ATOM    153  H   LYS A   9       4.639   7.749  -5.783  1.00  1.150          H  
ATOM    154  HA  LYS A   9       4.424  10.159  -7.333  1.00  1.040          H  
ATOM    155 1HB  LYS A   9       4.443   9.620  -4.347  1.00  1.500          H  
ATOM    156 2HB  LYS A   9       4.188  11.232  -5.009  1.00  1.500          H  
ATOM    157 1HG  LYS A   9       2.175  10.433  -6.182  1.00  1.500          H  
ATOM    158 2HG  LYS A   9       2.454   8.803  -5.571  1.00  1.500          H  
ATOM    159 1HD  LYS A   9       2.249   9.657  -3.236  1.00  1.500          H  
ATOM    160 2HD  LYS A   9       1.923  11.280  -3.869  1.00  1.500          H  
ATOM    161 1HE  LYS A   9      -0.102  10.425  -5.011  1.00  1.500          H  
ATOM    162 2HE  LYS A   9       0.235   8.799  -4.386  1.00  1.500          H  
ATOM    163 1HZ  LYS A   9      -1.391   9.947  -3.041  1.00  1.500          H  
ATOM    164 2HZ  LYS A   9      -0.026   9.672  -2.156  1.00  1.500          H  
ATOM    165 3HZ  LYS A   9      -0.342  11.183  -2.735  1.00  1.500          H  
ATOM    166  N   VAL A  10       7.178   9.876  -5.557  1.00  0.700          N  
ATOM    167  CA  VAL A  10       8.484  10.447  -5.346  1.00  0.810          C  
ATOM    168  C   VAL A  10       9.336  10.253  -6.593  1.00  0.880          C  
ATOM    169  O   VAL A  10      10.143  11.126  -6.918  1.00  0.970          O  
ATOM    170  CB  VAL A  10       9.139   9.848  -4.078  1.00  1.090          C  
ATOM    171  CG1 VAL A  10       9.630   8.476  -4.327  1.00  1.090          C  
ATOM    172  CG2 VAL A  10      10.250  10.723  -3.623  1.00  1.090          C  
ATOM    173  H   VAL A  10       6.921   9.016  -5.068  1.00  0.840          H  
ATOM    174  HA  VAL A  10       8.362  11.517  -5.177  1.00  0.970          H  
ATOM    175  HB  VAL A  10       8.378   9.774  -3.302  1.00  1.310          H  
ATOM    176 1HG1 VAL A  10      10.049   8.061  -3.417  1.00  1.310          H  
ATOM    177 2HG1 VAL A  10       8.842   7.874  -4.650  1.00  1.310          H  
ATOM    178 3HG1 VAL A  10      10.371   8.499  -5.078  1.00  1.310          H  
ATOM    179 1HG2 VAL A  10      10.697  10.313  -2.723  1.00  1.310          H  
ATOM    180 2HG2 VAL A  10      10.977  10.770  -4.402  1.00  1.310          H  
ATOM    181 3HG2 VAL A  10       9.869  11.725  -3.415  1.00  1.310          H  
ATOM    182  N   ALA A  11       9.201   9.113  -7.284  1.00  0.970          N  
ATOM    183  CA  ALA A  11       9.958   8.886  -8.489  1.00  1.120          C  
ATOM    184  C   ALA A  11       9.606   9.926  -9.553  1.00  0.980          C  
ATOM    185  O   ALA A  11      10.500  10.411 -10.244  1.00  1.010          O  
ATOM    186  CB  ALA A  11       9.720   7.496  -9.015  1.00  1.510          C  
ATOM    187  H   ALA A  11       8.577   8.367  -6.967  1.00  1.160          H  
ATOM    188  HA  ALA A  11      11.013   8.986  -8.249  1.00  1.340          H  
ATOM    189 1HB  ALA A  11      10.313   7.365  -9.892  1.00  1.810          H  
ATOM    190 2HB  ALA A  11      10.006   6.765  -8.256  1.00  1.810          H  
ATOM    191 3HB  ALA A  11       8.660   7.378  -9.258  1.00  1.810          H  
ATOM    192  N   GLU A  12       8.329  10.320  -9.679  1.00  0.900          N  
ATOM    193  CA  GLU A  12       8.043  11.342 -10.686  1.00  0.910          C  
ATOM    194  C   GLU A  12       8.718  12.671 -10.311  1.00  0.810          C  
ATOM    195  O   GLU A  12       9.253  13.372 -11.180  1.00  0.850          O  
ATOM    196  CB  GLU A  12       6.539  11.525 -10.880  1.00  1.270          C  
ATOM    197  CG  GLU A  12       5.849  10.331 -11.541  1.00  1.270          C  
ATOM    198  CD  GLU A  12       6.343  10.058 -12.939  1.00  1.270          C  
ATOM    199  OE1 GLU A  12       6.312  10.941 -13.756  1.00  1.270          O  
ATOM    200  OE2 GLU A  12       6.793   8.957 -13.174  1.00  1.270          O  
ATOM    201  H   GLU A  12       7.574   9.863  -9.152  1.00  1.080          H  
ATOM    202  HA  GLU A  12       8.462  11.009 -11.636  1.00  1.090          H  
ATOM    203 1HB  GLU A  12       6.066  11.692  -9.911  1.00  1.520          H  
ATOM    204 2HB  GLU A  12       6.357  12.405 -11.496  1.00  1.520          H  
ATOM    205 1HG  GLU A  12       6.024   9.446 -10.933  1.00  1.520          H  
ATOM    206 2HG  GLU A  12       4.778  10.512 -11.570  1.00  1.520          H  
ATOM    207  N   LYS A  13       8.723  13.018  -9.011  1.00  0.760          N  
ATOM    208  CA  LYS A  13       9.396  14.253  -8.588  1.00  0.830          C  
ATOM    209  C   LYS A  13      10.889  14.137  -8.896  1.00  0.920          C  
ATOM    210  O   LYS A  13      11.560  15.102  -9.288  1.00  1.100          O  
ATOM    211  CB  LYS A  13       9.194  14.508  -7.093  1.00  1.130          C  
ATOM    212  CG  LYS A  13       7.787  14.899  -6.704  1.00  1.130          C  
ATOM    213  CD  LYS A  13       7.666  15.116  -5.192  1.00  1.130          C  
ATOM    214  CE  LYS A  13       6.244  15.502  -4.802  1.00  1.130          C  
ATOM    215  NZ  LYS A  13       6.102  15.695  -3.329  1.00  1.130          N  
ATOM    216  H   LYS A  13       8.209  12.442  -8.334  1.00  0.910          H  
ATOM    217  HA  LYS A  13       8.992  15.093  -9.155  1.00  1.000          H  
ATOM    218 1HB  LYS A  13       9.465  13.617  -6.530  1.00  1.360          H  
ATOM    219 2HB  LYS A  13       9.854  15.311  -6.774  1.00  1.360          H  
ATOM    220 1HG  LYS A  13       7.506  15.812  -7.225  1.00  1.360          H  
ATOM    221 2HG  LYS A  13       7.102  14.104  -7.003  1.00  1.360          H  
ATOM    222 1HD  LYS A  13       7.935  14.194  -4.673  1.00  1.360          H  
ATOM    223 2HD  LYS A  13       8.349  15.905  -4.878  1.00  1.360          H  
ATOM    224 1HE  LYS A  13       5.975  16.427  -5.309  1.00  1.360          H  
ATOM    225 2HE  LYS A  13       5.562  14.712  -5.123  1.00  1.360          H  
ATOM    226 1HZ  LYS A  13       5.149  15.949  -3.110  1.00  1.360          H  
ATOM    227 2HZ  LYS A  13       6.338  14.837  -2.850  1.00  1.360          H  
ATOM    228 3HZ  LYS A  13       6.722  16.432  -3.023  1.00  1.360          H  
ATOM    229  N   PHE A  14      11.413  12.937  -8.694  1.00  0.920          N  
ATOM    230  CA  PHE A  14      12.798  12.653  -8.952  1.00  1.100          C  
ATOM    231  C   PHE A  14      13.144  12.912 -10.397  1.00  0.990          C  
ATOM    232  O   PHE A  14      14.111  13.612 -10.676  1.00  0.970          O  
ATOM    233  CB  PHE A  14      13.154  11.221  -8.624  1.00  1.470          C  
ATOM    234  CG  PHE A  14      14.519  11.010  -8.855  1.00  1.470          C  
ATOM    235  CD1 PHE A  14      15.393  11.390  -7.921  1.00  1.470          C  
ATOM    236  CD2 PHE A  14      14.969  10.489 -10.025  1.00  1.470          C  
ATOM    237  CE1 PHE A  14      16.683  11.258  -8.116  1.00  1.470          C  
ATOM    238  CE2 PHE A  14      16.281  10.364 -10.231  1.00  1.470          C  
ATOM    239  CZ  PHE A  14      17.131  10.752  -9.253  1.00  1.470          C  
ATOM    240  H   PHE A  14      10.815  12.205  -8.298  1.00  1.100          H  
ATOM    241  HA  PHE A  14      13.407  13.315  -8.346  1.00  1.320          H  
ATOM    242 1HB  PHE A  14      12.909  10.986  -7.595  1.00  1.760          H  
ATOM    243 2HB  PHE A  14      12.614  10.548  -9.248  1.00  1.760          H  
ATOM    244  HD1 PHE A  14      15.028  11.832  -7.005  1.00  1.760          H  
ATOM    245  HD2 PHE A  14      14.255  10.214 -10.795  1.00  1.760          H  
ATOM    246  HE1 PHE A  14      17.373  11.591  -7.365  1.00  1.760          H  
ATOM    247  HE2 PHE A  14      16.658   9.990 -11.178  1.00  1.760          H  
ATOM    248  HZ  PHE A  14      18.170  10.699  -9.401  1.00  1.760          H  
ATOM    249  N   LYS A  15      12.329  12.394 -11.322  1.00  1.000          N  
ATOM    250  CA  LYS A  15      12.565  12.582 -12.751  1.00  0.960          C  
ATOM    251  C   LYS A  15      12.674  14.068 -13.109  1.00  0.890          C  
ATOM    252  O   LYS A  15      13.427  14.443 -14.010  1.00  0.930          O  
ATOM    253  CB  LYS A  15      11.443  11.943 -13.574  1.00  1.360          C  
ATOM    254  CG  LYS A  15      11.416  10.408 -13.603  1.00  1.360          C  
ATOM    255  CD  LYS A  15      10.184   9.937 -14.382  1.00  1.360          C  
ATOM    256  CE  LYS A  15      10.054   8.428 -14.446  1.00  1.360          C  
ATOM    257  NZ  LYS A  15       8.753   8.034 -15.079  1.00  1.360          N  
ATOM    258  H   LYS A  15      11.555  11.806 -11.005  1.00  1.200          H  
ATOM    259  HA  LYS A  15      13.515  12.106 -13.008  1.00  1.150          H  
ATOM    260 1HB  LYS A  15      10.483  12.277 -13.179  1.00  1.630          H  
ATOM    261 2HB  LYS A  15      11.512  12.297 -14.600  1.00  1.630          H  
ATOM    262 1HG  LYS A  15      12.323  10.034 -14.083  1.00  1.630          H  
ATOM    263 2HG  LYS A  15      11.375  10.022 -12.590  1.00  1.630          H  
ATOM    264 1HD  LYS A  15       9.284  10.337 -13.908  1.00  1.630          H  
ATOM    265 2HD  LYS A  15      10.230  10.322 -15.398  1.00  1.630          H  
ATOM    266 1HE  LYS A  15      10.874   8.022 -15.036  1.00  1.630          H  
ATOM    267 2HE  LYS A  15      10.098   8.010 -13.438  1.00  1.630          H  
ATOM    268 1HZ  LYS A  15       8.671   7.033 -15.117  1.00  1.630          H  
ATOM    269 2HZ  LYS A  15       7.979   8.418 -14.495  1.00  1.630          H  
ATOM    270 3HZ  LYS A  15       8.688   8.412 -16.010  1.00  1.630          H  
ATOM    271  N   GLU A  16      11.873  14.921 -12.458  1.00  0.930          N  
ATOM    272  CA  GLU A  16      11.984  16.355 -12.718  1.00  1.030          C  
ATOM    273  C   GLU A  16      13.364  16.897 -12.282  1.00  0.830          C  
ATOM    274  O   GLU A  16      13.913  17.798 -12.922  1.00  0.880          O  
ATOM    275  CB  GLU A  16      10.867  17.143 -12.016  1.00  1.400          C  
ATOM    276  CG  GLU A  16       9.466  16.927 -12.587  1.00  1.400          C  
ATOM    277  CD  GLU A  16       8.407  17.732 -11.867  1.00  1.400          C  
ATOM    278  OE1 GLU A  16       8.704  18.274 -10.827  1.00  1.400          O  
ATOM    279  OE2 GLU A  16       7.309  17.815 -12.365  1.00  1.400          O  
ATOM    280  H   GLU A  16      11.193  14.554 -11.783  1.00  1.120          H  
ATOM    281  HA  GLU A  16      11.882  16.514 -13.791  1.00  1.240          H  
ATOM    282 1HB  GLU A  16      10.841  16.869 -10.963  1.00  1.680          H  
ATOM    283 2HB  GLU A  16      11.086  18.208 -12.068  1.00  1.680          H  
ATOM    284 1HG  GLU A  16       9.468  17.202 -13.639  1.00  1.680          H  
ATOM    285 2HG  GLU A  16       9.220  15.865 -12.515  1.00  1.680          H  
ATOM    286  N   ALA A  17      13.900  16.358 -11.172  1.00  0.780          N  
ATOM    287  CA  ALA A  17      15.191  16.780 -10.600  1.00  0.870          C  
ATOM    288  C   ALA A  17      16.449  16.190 -11.301  1.00  0.790          C  
ATOM    289  O   ALA A  17      17.419  16.910 -11.553  1.00  1.010          O  
ATOM    290  CB  ALA A  17      15.213  16.376  -9.123  1.00  1.180          C  
ATOM    291  H   ALA A  17      13.351  15.636 -10.689  1.00  0.940          H  
ATOM    292  HA  ALA A  17      15.246  17.863 -10.678  1.00  1.040          H  
ATOM    293 1HB  ALA A  17      16.123  16.710  -8.651  1.00  1.420          H  
ATOM    294 2HB  ALA A  17      14.358  16.821  -8.615  1.00  1.420          H  
ATOM    295 3HB  ALA A  17      15.148  15.292  -9.047  1.00  1.420          H  
ATOM    296  N   PHE A  18      16.432  14.885 -11.581  1.00  0.600          N  
ATOM    297  CA  PHE A  18      17.575  14.148 -12.137  1.00  0.690          C  
ATOM    298  C   PHE A  18      17.211  13.128 -13.238  1.00  0.720          C  
ATOM    299  O   PHE A  18      16.094  12.616 -13.251  1.00  0.660          O  
ATOM    300  CB  PHE A  18      18.278  13.388 -11.031  1.00  0.930          C  
ATOM    301  CG  PHE A  18      18.947  14.161  -9.952  1.00  0.930          C  
ATOM    302  CD1 PHE A  18      18.272  14.481  -8.804  1.00  0.930          C  
ATOM    303  CD2 PHE A  18      20.271  14.541 -10.069  1.00  0.930          C  
ATOM    304  CE1 PHE A  18      18.891  15.161  -7.786  1.00  0.930          C  
ATOM    305  CE2 PHE A  18      20.899  15.225  -9.048  1.00  0.930          C  
ATOM    306  CZ  PHE A  18      20.203  15.530  -7.904  1.00  0.930          C  
ATOM    307  H   PHE A  18      15.576  14.378 -11.366  1.00  0.720          H  
ATOM    308  HA  PHE A  18      18.246  14.898 -12.525  1.00  0.830          H  
ATOM    309 1HB  PHE A  18      17.494  12.886 -10.564  1.00  1.120          H  
ATOM    310 2HB  PHE A  18      18.955  12.636 -11.416  1.00  1.120          H  
ATOM    311  HD1 PHE A  18      17.234  14.178  -8.701  1.00  1.120          H  
ATOM    312  HD2 PHE A  18      20.828  14.291 -10.973  1.00  1.120          H  
ATOM    313  HE1 PHE A  18      18.336  15.405  -6.883  1.00  1.120          H  
ATOM    314  HE2 PHE A  18      21.947  15.520  -9.145  1.00  1.120          H  
ATOM    315  HZ  PHE A  18      20.693  16.067  -7.091  1.00  1.120          H  
ATOM    316  N   PRO A  19      18.160  12.733 -14.124  1.00  0.980          N  
ATOM    317  CA  PRO A  19      17.988  11.729 -15.176  1.00  1.140          C  
ATOM    318  C   PRO A  19      17.520  10.357 -14.681  1.00  0.920          C  
ATOM    319  O   PRO A  19      17.968   9.864 -13.629  1.00  0.700          O  
ATOM    320  CB  PRO A  19      19.408  11.618 -15.761  1.00  1.710          C  
ATOM    321  CG  PRO A  19      20.041  12.957 -15.494  1.00  1.710          C  
ATOM    322  CD  PRO A  19      19.503  13.386 -14.146  1.00  1.710          C  
ATOM    323  HA  PRO A  19      17.288  12.119 -15.927  1.00  1.370          H  
ATOM    324 1HB  PRO A  19      19.953  10.792 -15.280  1.00  2.050          H  
ATOM    325 2HB  PRO A  19      19.353  11.377 -16.836  1.00  2.050          H  
ATOM    326 1HG  PRO A  19      21.142  12.865 -15.500  1.00  2.050          H  
ATOM    327 2HG  PRO A  19      19.783  13.664 -16.294  1.00  2.050          H  
ATOM    328 1HD  PRO A  19      20.149  13.019 -13.340  1.00  2.050          H  
ATOM    329 2HD  PRO A  19      19.441  14.476 -14.182  1.00  2.050          H  
ATOM    330  N   TRP A  20      16.677   9.732 -15.517  1.00  1.070          N  
ATOM    331  CA  TRP A  20      16.085   8.404 -15.319  1.00  1.030          C  
ATOM    332  C   TRP A  20      17.058   7.314 -14.880  1.00  0.910          C  
ATOM    333  O   TRP A  20      16.639   6.324 -14.283  1.00  0.850          O  
ATOM    334  CB  TRP A  20      15.409   7.930 -16.607  1.00  1.460          C  
ATOM    335  CG  TRP A  20      16.369   7.657 -17.730  1.00  1.460          C  
ATOM    336  CD1 TRP A  20      16.773   8.534 -18.686  1.00  1.460          C  
ATOM    337  CD2 TRP A  20      17.049   6.404 -18.026  1.00  1.460          C  
ATOM    338  NE1 TRP A  20      17.650   7.928 -19.542  1.00  1.460          N  
ATOM    339  CE2 TRP A  20      17.828   6.627 -19.154  1.00  1.460          C  
ATOM    340  CE3 TRP A  20      17.056   5.132 -17.426  1.00  1.460          C  
ATOM    341  CZ2 TRP A  20      18.611   5.635 -19.707  1.00  1.460          C  
ATOM    342  CZ3 TRP A  20      17.844   4.144 -17.975  1.00  1.460          C  
ATOM    343  CH2 TRP A  20      18.603   4.387 -19.089  1.00  1.460          C  
ATOM    344  H   TRP A  20      16.394  10.239 -16.344  1.00  1.280          H  
ATOM    345  HA  TRP A  20      15.318   8.504 -14.557  1.00  1.240          H  
ATOM    346 1HB  TRP A  20      14.852   7.017 -16.406  1.00  1.750          H  
ATOM    347 2HB  TRP A  20      14.693   8.680 -16.940  1.00  1.750          H  
ATOM    348  HD1 TRP A  20      16.449   9.569 -18.764  1.00  1.750          H  
ATOM    349  HE1 TRP A  20      18.091   8.367 -20.339  1.00  1.750          H  
ATOM    350  HE3 TRP A  20      16.455   4.930 -16.538  1.00  1.750          H  
ATOM    351  HZ2 TRP A  20      19.221   5.807 -20.591  1.00  1.750          H  
ATOM    352  HZ3 TRP A  20      17.845   3.167 -17.499  1.00  1.750          H  
ATOM    353  HH2 TRP A  20      19.214   3.586 -19.500  1.00  1.750          H  
ATOM    354  N   LYS A  21      18.343   7.451 -15.203  1.00  1.030          N  
ATOM    355  CA  LYS A  21      19.322   6.433 -14.844  1.00  1.070          C  
ATOM    356  C   LYS A  21      19.423   6.291 -13.334  1.00  0.900          C  
ATOM    357  O   LYS A  21      19.632   5.192 -12.797  1.00  0.970          O  
ATOM    358  CB  LYS A  21      20.690   6.769 -15.422  1.00  1.480          C  
ATOM    359  CG  LYS A  21      20.773   6.625 -16.918  1.00  1.480          C  
ATOM    360  CD  LYS A  21      22.143   6.982 -17.448  1.00  1.480          C  
ATOM    361  CE  LYS A  21      22.196   6.822 -18.960  1.00  1.480          C  
ATOM    362  NZ  LYS A  21      23.525   7.203 -19.518  1.00  1.480          N  
ATOM    363  H   LYS A  21      18.628   8.286 -15.697  1.00  1.240          H  
ATOM    364  HA  LYS A  21      18.992   5.477 -15.250  1.00  1.280          H  
ATOM    365 1HB  LYS A  21      20.947   7.795 -15.162  1.00  1.780          H  
ATOM    366 2HB  LYS A  21      21.438   6.118 -14.972  1.00  1.780          H  
ATOM    367 1HG  LYS A  21      20.547   5.594 -17.183  1.00  1.780          H  
ATOM    368 2HG  LYS A  21      20.033   7.271 -17.378  1.00  1.780          H  
ATOM    369 1HD  LYS A  21      22.377   8.015 -17.190  1.00  1.780          H  
ATOM    370 2HD  LYS A  21      22.892   6.331 -16.996  1.00  1.780          H  
ATOM    371 1HE  LYS A  21      21.990   5.783 -19.214  1.00  1.780          H  
ATOM    372 2HE  LYS A  21      21.428   7.452 -19.411  1.00  1.780          H  
ATOM    373 1HZ  LYS A  21      23.516   7.082 -20.521  1.00  1.780          H  
ATOM    374 2HZ  LYS A  21      23.721   8.170 -19.299  1.00  1.780          H  
ATOM    375 3HZ  LYS A  21      24.242   6.616 -19.115  1.00  1.780          H  
ATOM    376  N   VAL A  22      19.320   7.428 -12.653  1.00  0.830          N  
ATOM    377  CA  VAL A  22      19.456   7.470 -11.224  1.00  0.880          C  
ATOM    378  C   VAL A  22      18.126   7.004 -10.654  1.00  0.700          C  
ATOM    379  O   VAL A  22      18.086   6.340  -9.613  1.00  0.860          O  
ATOM    380  CB  VAL A  22      19.874   8.854 -10.740  1.00  1.210          C  
ATOM    381  CG1 VAL A  22      19.935   8.843  -9.221  1.00  1.210          C  
ATOM    382  CG2 VAL A  22      21.206   9.232 -11.356  1.00  1.210          C  
ATOM    383  H   VAL A  22      19.110   8.301 -13.143  1.00  1.000          H  
ATOM    384  HA  VAL A  22      20.229   6.764 -10.919  1.00  1.060          H  
ATOM    385  HB  VAL A  22      19.134   9.579 -11.054  1.00  1.450          H  
ATOM    386 1HG1 VAL A  22      20.219   9.828  -8.848  1.00  1.450          H  
ATOM    387 2HG1 VAL A  22      18.975   8.578  -8.844  1.00  1.450          H  
ATOM    388 3HG1 VAL A  22      20.664   8.111  -8.884  1.00  1.450          H  
ATOM    389 1HG2 VAL A  22      21.499  10.227 -11.016  1.00  1.450          H  
ATOM    390 2HG2 VAL A  22      21.959   8.506 -11.054  1.00  1.450          H  
ATOM    391 3HG2 VAL A  22      21.118   9.234 -12.441  1.00  1.450          H  
ATOM    392  N   ARG A  23      17.025   7.419 -11.306  1.00  0.580          N  
ATOM    393  CA  ARG A  23      15.696   6.995 -10.868  1.00  0.720          C  
ATOM    394  C   ARG A  23      15.670   5.493 -10.810  1.00  0.850          C  
ATOM    395  O   ARG A  23      15.189   4.912  -9.840  1.00  1.060          O  
ATOM    396  CB  ARG A  23      14.577   7.411 -11.840  1.00  0.950          C  
ATOM    397  CG  ARG A  23      13.107   7.046 -11.400  1.00  0.950          C  
ATOM    398  CD  ARG A  23      12.606   5.732 -12.017  1.00  0.950          C  
ATOM    399  NE  ARG A  23      11.249   5.381 -11.585  1.00  0.950          N  
ATOM    400  CZ  ARG A  23      10.591   4.245 -11.928  1.00  0.950          C  
ATOM    401  NH1 ARG A  23      11.154   3.361 -12.726  1.00  0.950          N  
ATOM    402  NH2 ARG A  23       9.373   4.017 -11.460  1.00  0.950          N  
ATOM    403  H   ARG A  23      17.159   8.012 -12.131  1.00  0.700          H  
ATOM    404  HA  ARG A  23      15.498   7.401  -9.875  1.00  0.860          H  
ATOM    405 1HB  ARG A  23      14.634   8.461 -12.062  1.00  1.140          H  
ATOM    406 2HB  ARG A  23      14.728   6.890 -12.776  1.00  1.140          H  
ATOM    407 1HG  ARG A  23      13.058   6.942 -10.346  1.00  1.140          H  
ATOM    408 2HG  ARG A  23      12.430   7.843 -11.707  1.00  1.140          H  
ATOM    409 1HD  ARG A  23      12.604   5.833 -13.101  1.00  1.140          H  
ATOM    410 2HD  ARG A  23      13.246   4.909 -11.742  1.00  1.140          H  
ATOM    411  HE  ARG A  23      10.776   6.018 -10.970  1.00  1.140          H  
ATOM    412 1HH1 ARG A  23      12.079   3.523 -13.092  1.00  1.140          H  
ATOM    413 2HH1 ARG A  23      10.656   2.516 -12.974  1.00  1.140          H  
ATOM    414 1HH2 ARG A  23       8.927   4.675 -10.834  1.00  1.140          H  
ATOM    415 2HH2 ARG A  23       8.880   3.173 -11.716  1.00  1.140          H  
ATOM    416  N   LYS A  24      16.164   4.851 -11.878  1.00  0.840          N  
ATOM    417  CA  LYS A  24      16.148   3.404 -11.960  1.00  1.040          C  
ATOM    418  C   LYS A  24      16.847   2.786 -10.768  1.00  1.020          C  
ATOM    419  O   LYS A  24      16.314   1.852 -10.168  1.00  1.320          O  
ATOM    420  CB  LYS A  24      16.778   2.932 -13.271  1.00  1.380          C  
ATOM    421  CG  LYS A  24      16.752   1.413 -13.478  1.00  1.380          C  
ATOM    422  CD  LYS A  24      17.329   1.022 -14.842  1.00  1.380          C  
ATOM    423  CE  LYS A  24      17.341  -0.495 -15.024  1.00  1.380          C  
ATOM    424  NZ  LYS A  24      17.894  -0.897 -16.351  1.00  1.380          N  
ATOM    425  H   LYS A  24      16.522   5.392 -12.670  1.00  1.010          H  
ATOM    426  HA  LYS A  24      15.112   3.072 -11.946  1.00  1.250          H  
ATOM    427 1HB  LYS A  24      16.265   3.407 -14.109  1.00  1.650          H  
ATOM    428 2HB  LYS A  24      17.818   3.261 -13.307  1.00  1.650          H  
ATOM    429 1HG  LYS A  24      17.340   0.927 -12.695  1.00  1.650          H  
ATOM    430 2HG  LYS A  24      15.725   1.055 -13.404  1.00  1.650          H  
ATOM    431 1HD  LYS A  24      16.727   1.474 -15.634  1.00  1.650          H  
ATOM    432 2HD  LYS A  24      18.348   1.400 -14.924  1.00  1.650          H  
ATOM    433 1HE  LYS A  24      17.947  -0.942 -14.239  1.00  1.650          H  
ATOM    434 2HE  LYS A  24      16.321  -0.870 -14.941  1.00  1.650          H  
ATOM    435 1HZ  LYS A  24      17.882  -1.905 -16.428  1.00  1.650          H  
ATOM    436 2HZ  LYS A  24      17.330  -0.498 -17.089  1.00  1.650          H  
ATOM    437 3HZ  LYS A  24      18.844  -0.566 -16.438  1.00  1.650          H  
ATOM    438  N   SER A  25      18.030   3.296 -10.410  1.00  0.870          N  
ATOM    439  CA  SER A  25      18.741   2.757  -9.256  1.00  1.020          C  
ATOM    440  C   SER A  25      17.948   2.925  -7.954  1.00  1.190          C  
ATOM    441  O   SER A  25      17.777   1.964  -7.194  1.00  1.350          O  
ATOM    442  CB  SER A  25      20.085   3.439  -9.111  1.00  1.370          C  
ATOM    443  OG  SER A  25      20.781   2.940  -7.999  1.00  1.370          O  
ATOM    444  H   SER A  25      18.460   4.031 -10.983  1.00  1.040          H  
ATOM    445  HA  SER A  25      18.902   1.693  -9.422  1.00  1.220          H  
ATOM    446 1HB  SER A  25      20.669   3.284 -10.017  1.00  1.640          H  
ATOM    447 2HB  SER A  25      19.936   4.514  -8.998  1.00  1.640          H  
ATOM    448  HG  SER A  25      21.608   3.426  -7.967  1.00  1.640          H  
ATOM    449  N   PHE A  26      17.432   4.132  -7.693  1.00  1.200          N  
ATOM    450  CA  PHE A  26      16.697   4.346  -6.443  1.00  1.470          C  
ATOM    451  C   PHE A  26      15.442   3.494  -6.372  1.00  1.560          C  
ATOM    452  O   PHE A  26      15.103   2.926  -5.320  1.00  1.820          O  
ATOM    453  CB  PHE A  26      16.255   5.796  -6.285  1.00  1.950          C  
ATOM    454  CG  PHE A  26      17.254   6.793  -5.845  1.00  1.950          C  
ATOM    455  CD1 PHE A  26      17.500   7.916  -6.599  1.00  1.950          C  
ATOM    456  CD2 PHE A  26      17.936   6.636  -4.659  1.00  1.950          C  
ATOM    457  CE1 PHE A  26      18.415   8.860  -6.166  1.00  1.950          C  
ATOM    458  CE2 PHE A  26      18.844   7.578  -4.237  1.00  1.950          C  
ATOM    459  CZ  PHE A  26      19.081   8.686  -4.994  1.00  1.950          C  
ATOM    460  H   PHE A  26      17.577   4.899  -8.362  1.00  1.440          H  
ATOM    461  HA  PHE A  26      17.347   4.071  -5.616  1.00  1.760          H  
ATOM    462 1HB  PHE A  26      15.894   6.122  -7.252  1.00  2.340          H  
ATOM    463 2HB  PHE A  26      15.419   5.833  -5.582  1.00  2.340          H  
ATOM    464  HD1 PHE A  26      16.964   8.058  -7.541  1.00  2.340          H  
ATOM    465  HD2 PHE A  26      17.736   5.760  -4.036  1.00  2.340          H  
ATOM    466  HE1 PHE A  26      18.620   9.744  -6.754  1.00  2.340          H  
ATOM    467  HE2 PHE A  26      19.371   7.447  -3.291  1.00  2.340          H  
ATOM    468  HZ  PHE A  26      19.808   9.432  -4.654  1.00  2.340          H  
ATOM    469  N   PHE A  27      14.724   3.407  -7.491  1.00  1.450          N  
ATOM    470  CA  PHE A  27      13.498   2.646  -7.551  1.00  1.650          C  
ATOM    471  C   PHE A  27      13.787   1.160  -7.357  1.00  1.650          C  
ATOM    472  O   PHE A  27      13.157   0.508  -6.527  1.00  1.890          O  
ATOM    473  CB  PHE A  27      12.774   2.903  -8.868  1.00  2.230          C  
ATOM    474  CG  PHE A  27      11.459   2.242  -8.936  1.00  2.230          C  
ATOM    475  CD1 PHE A  27      10.357   2.812  -8.294  1.00  2.230          C  
ATOM    476  CD2 PHE A  27      11.295   1.056  -9.618  1.00  2.230          C  
ATOM    477  CE1 PHE A  27       9.128   2.198  -8.344  1.00  2.230          C  
ATOM    478  CE2 PHE A  27      10.068   0.443  -9.664  1.00  2.230          C  
ATOM    479  CZ  PHE A  27       8.985   1.015  -9.026  1.00  2.230          C  
ATOM    480  H   PHE A  27      15.031   3.904  -8.329  1.00  1.740          H  
ATOM    481  HA  PHE A  27      12.854   2.967  -6.736  1.00  1.980          H  
ATOM    482 1HB  PHE A  27      12.641   3.970  -9.017  1.00  2.680          H  
ATOM    483 2HB  PHE A  27      13.391   2.542  -9.693  1.00  2.680          H  
ATOM    484  HD1 PHE A  27      10.469   3.748  -7.752  1.00  2.680          H  
ATOM    485  HD2 PHE A  27      12.151   0.602 -10.119  1.00  2.680          H  
ATOM    486  HE1 PHE A  27       8.260   2.645  -7.847  1.00  2.680          H  
ATOM    487  HE2 PHE A  27       9.947  -0.497 -10.204  1.00  2.680          H  
ATOM    488  HZ  PHE A  27       8.010   0.530  -9.064  1.00  2.680          H  
ATOM    489  N   LYS A  28      14.764   0.619  -8.096  1.00  1.390          N  
ATOM    490  CA  LYS A  28      15.132  -0.796  -8.012  1.00  1.420          C  
ATOM    491  C   LYS A  28      15.466  -1.209  -6.589  1.00  1.660          C  
ATOM    492  O   LYS A  28      15.064  -2.280  -6.127  1.00  1.880          O  
ATOM    493  CB  LYS A  28      16.332  -1.095  -8.912  1.00  1.980          C  
ATOM    494  CG  LYS A  28      16.783  -2.567  -8.916  1.00  1.980          C  
ATOM    495  CD  LYS A  28      17.954  -2.789  -9.873  1.00  1.980          C  
ATOM    496  CE  LYS A  28      18.438  -4.235  -9.832  1.00  1.980          C  
ATOM    497  NZ  LYS A  28      19.596  -4.462 -10.745  1.00  1.980          N  
ATOM    498  H   LYS A  28      15.268   1.203  -8.764  1.00  1.670          H  
ATOM    499  HA  LYS A  28      14.282  -1.390  -8.345  1.00  1.700          H  
ATOM    500 1HB  LYS A  28      16.098  -0.805  -9.936  1.00  2.370          H  
ATOM    501 2HB  LYS A  28      17.180  -0.482  -8.589  1.00  2.370          H  
ATOM    502 1HG  LYS A  28      17.097  -2.854  -7.911  1.00  2.370          H  
ATOM    503 2HG  LYS A  28      15.946  -3.201  -9.209  1.00  2.370          H  
ATOM    504 1HD  LYS A  28      17.647  -2.544 -10.892  1.00  2.370          H  
ATOM    505 2HD  LYS A  28      18.776  -2.131  -9.592  1.00  2.370          H  
ATOM    506 1HE  LYS A  28      18.737  -4.480  -8.814  1.00  2.370          H  
ATOM    507 2HE  LYS A  28      17.622  -4.893 -10.129  1.00  2.370          H  
ATOM    508 1HZ  LYS A  28      19.886  -5.428 -10.688  1.00  2.370          H  
ATOM    509 2HZ  LYS A  28      19.327  -4.248 -11.695  1.00  2.370          H  
ATOM    510 3HZ  LYS A  28      20.364  -3.865 -10.471  1.00  2.370          H  
ATOM    511  N   LEU A  29      16.181  -0.340  -5.878  1.00  1.710          N  
ATOM    512  CA  LEU A  29      16.601  -0.596  -4.512  1.00  2.090          C  
ATOM    513  C   LEU A  29      15.522  -0.254  -3.487  1.00  2.410          C  
ATOM    514  O   LEU A  29      15.736  -0.409  -2.282  1.00  2.710          O  
ATOM    515  CB  LEU A  29      17.852   0.237  -4.222  1.00  2.770          C  
ATOM    516  CG  LEU A  29      19.123  -0.093  -5.066  1.00  2.770          C  
ATOM    517  CD1 LEU A  29      20.186   0.945  -4.758  1.00  2.770          C  
ATOM    518  CD2 LEU A  29      19.637  -1.504  -4.747  1.00  2.770          C  
ATOM    519  H   LEU A  29      16.516   0.520  -6.335  1.00  2.050          H  
ATOM    520  HA  LEU A  29      16.819  -1.654  -4.416  1.00  2.510          H  
ATOM    521 1HB  LEU A  29      17.601   1.285  -4.416  1.00  3.330          H  
ATOM    522 2HB  LEU A  29      18.106   0.135  -3.170  1.00  3.330          H  
ATOM    523  HG  LEU A  29      18.884  -0.030  -6.129  1.00  3.330          H  
ATOM    524 1HD1 LEU A  29      21.076   0.743  -5.354  1.00  3.330          H  
ATOM    525 2HD1 LEU A  29      19.802   1.938  -5.011  1.00  3.330          H  
ATOM    526 3HD1 LEU A  29      20.439   0.909  -3.701  1.00  3.330          H  
ATOM    527 1HD2 LEU A  29      20.528  -1.704  -5.342  1.00  3.330          H  
ATOM    528 2HD2 LEU A  29      19.887  -1.570  -3.687  1.00  3.330          H  
ATOM    529 3HD2 LEU A  29      18.883  -2.246  -4.986  1.00  3.330          H  
ATOM    530  N   GLN A  30      14.376   0.242  -3.961  1.00  2.670          N  
ATOM    531  CA  GLN A  30      13.236   0.635  -3.151  1.00  3.120          C  
ATOM    532  C   GLN A  30      13.629   1.597  -2.025  1.00  2.250          C  
ATOM    533  O   GLN A  30      13.193   1.446  -0.878  1.00  2.520          O  
ATOM    534  CB  GLN A  30      12.579  -0.642  -2.607  1.00  4.190          C  
ATOM    535  CG  GLN A  30      12.014  -1.544  -3.713  1.00  4.190          C  
ATOM    536  CD  GLN A  30      10.710  -1.035  -4.333  1.00  4.190          C  
ATOM    537  OE1 GLN A  30       9.652  -1.174  -3.709  1.00  4.190          O  
ATOM    538  NE2 GLN A  30      10.774  -0.438  -5.519  1.00  4.190          N  
ATOM    539  H   GLN A  30      14.254   0.324  -4.968  1.00  3.200          H  
ATOM    540  HA  GLN A  30      12.529   1.152  -3.799  1.00  3.740          H  
ATOM    541 1HB  GLN A  30      13.304  -1.216  -2.038  1.00  5.030          H  
ATOM    542 2HB  GLN A  30      11.771  -0.391  -1.945  1.00  5.030          H  
ATOM    543 1HG  GLN A  30      12.756  -1.620  -4.512  1.00  5.030          H  
ATOM    544 2HG  GLN A  30      11.827  -2.526  -3.291  1.00  5.030          H  
ATOM    545 1HE2 GLN A  30       9.941  -0.086  -5.944  1.00  5.030          H  
ATOM    546 2HE2 GLN A  30      11.674  -0.320  -5.999  1.00  5.030          H  
ATOM    547  N   GLY A  31      14.428   2.613  -2.360  1.00  1.690          N  
ATOM    548  CA  GLY A  31      14.855   3.584  -1.361  1.00  1.550          C  
ATOM    549  C   GLY A  31      14.238   4.961  -1.563  1.00  1.470          C  
ATOM    550  O   GLY A  31      13.281   5.135  -2.318  1.00  1.700          O  
ATOM    551  H   GLY A  31      14.744   2.702  -3.333  1.00  2.030          H  
ATOM    552 1HA  GLY A  31      14.614   3.216  -0.366  1.00  1.860          H  
ATOM    553 2HA  GLY A  31      15.941   3.674  -1.406  1.00  1.860          H  
ATOM    554  N   SER A  32      14.794   5.940  -0.846  1.00  1.610          N  
ATOM    555  CA  SER A  32      14.342   7.318  -0.933  1.00  1.550          C  
ATOM    556  C   SER A  32      14.948   7.899  -2.186  1.00  1.650          C  
ATOM    557  O   SER A  32      15.821   7.277  -2.785  1.00  2.100          O  
ATOM    558  CB  SER A  32      14.777   8.099   0.290  1.00  2.190          C  
ATOM    559  OG  SER A  32      16.169   8.232   0.323  1.00  2.190          O  
ATOM    560  H   SER A  32      15.576   5.733  -0.239  1.00  1.930          H  
ATOM    561  HA  SER A  32      13.253   7.343  -1.022  1.00  1.860          H  
ATOM    562 1HB  SER A  32      14.315   9.086   0.271  1.00  2.630          H  
ATOM    563 2HB  SER A  32      14.434   7.591   1.187  1.00  2.630          H  
ATOM    564  HG  SER A  32      16.371   8.749   1.110  1.00  2.630          H  
ATOM    565  N   PHE A  33      14.484   9.067  -2.603  1.00  1.570          N  
ATOM    566  CA  PHE A  33      15.006   9.697  -3.807  1.00  1.810          C  
ATOM    567  C   PHE A  33      15.494  11.128  -3.609  1.00  1.710          C  
ATOM    568  O   PHE A  33      14.883  11.948  -2.910  1.00  2.010          O  
ATOM    569  CB  PHE A  33      13.925   9.716  -4.879  1.00  2.440          C  
ATOM    570  CG  PHE A  33      13.489   8.401  -5.461  1.00  2.440          C  
ATOM    571  CD1 PHE A  33      12.745   7.502  -4.737  1.00  2.440          C  
ATOM    572  CD2 PHE A  33      13.760   8.095  -6.776  1.00  2.440          C  
ATOM    573  CE1 PHE A  33      12.300   6.344  -5.298  1.00  2.440          C  
ATOM    574  CE2 PHE A  33      13.304   6.933  -7.328  1.00  2.440          C  
ATOM    575  CZ  PHE A  33      12.572   6.064  -6.586  1.00  2.440          C  
ATOM    576  H   PHE A  33      13.768   9.530  -2.065  1.00  1.880          H  
ATOM    577  HA  PHE A  33      15.847   9.105  -4.160  1.00  2.170          H  
ATOM    578 1HB  PHE A  33      13.066  10.184  -4.470  1.00  2.930          H  
ATOM    579 2HB  PHE A  33      14.252  10.322  -5.672  1.00  2.930          H  
ATOM    580  HD1 PHE A  33      12.496   7.709  -3.704  1.00  2.930          H  
ATOM    581  HD2 PHE A  33      14.337   8.775  -7.374  1.00  2.930          H  
ATOM    582  HE1 PHE A  33      11.727   5.657  -4.702  1.00  2.930          H  
ATOM    583  HE2 PHE A  33      13.532   6.694  -8.343  1.00  2.930          H  
ATOM    584  HZ  PHE A  33      12.214   5.155  -7.019  1.00  2.930          H  
ATOM    585  N   ASP A  34      16.525  11.477  -4.346  1.00  2.190          N  
ATOM    586  CA  ASP A  34      17.025  12.839  -4.332  1.00  2.650          C  
ATOM    587  C   ASP A  34      16.155  13.682  -5.252  1.00  2.520          C  
ATOM    588  O   ASP A  34      16.433  13.819  -6.434  1.00  3.380          O  
ATOM    589  CB  ASP A  34      18.486  12.867  -4.797  1.00  3.530          C  
ATOM    590  CG  ASP A  34      19.444  12.179  -3.834  1.00  3.530          C  
ATOM    591  OD1 ASP A  34      19.146  12.069  -2.668  1.00  3.530          O  
ATOM    592  OD2 ASP A  34      20.466  11.736  -4.293  1.00  3.530          O  
ATOM    593  H   ASP A  34      17.010  10.759  -4.872  1.00  2.630          H  
ATOM    594  HA  ASP A  34      16.958  13.238  -3.320  1.00  3.180          H  
ATOM    595 1HB  ASP A  34      18.583  12.394  -5.761  1.00  4.230          H  
ATOM    596 2HB  ASP A  34      18.806  13.903  -4.918  1.00  4.230          H  
ATOM    597  N   VAL A  35      15.090  14.247  -4.712  1.00  1.980          N  
ATOM    598  CA  VAL A  35      14.107  14.928  -5.561  1.00  2.310          C  
ATOM    599  C   VAL A  35      14.237  16.444  -5.585  1.00  1.910          C  
ATOM    600  O   VAL A  35      13.284  17.148  -5.919  1.00  2.300          O  
ATOM    601  CB  VAL A  35      12.665  14.584  -5.137  1.00  3.100          C  
ATOM    602  CG1 VAL A  35      12.419  13.122  -5.283  1.00  3.100          C  
ATOM    603  CG2 VAL A  35      12.399  15.004  -3.715  1.00  3.100          C  
ATOM    604  H   VAL A  35      14.933  14.076  -3.714  1.00  2.380          H  
ATOM    605  HA  VAL A  35      14.243  14.573  -6.580  1.00  2.770          H  
ATOM    606  HB  VAL A  35      11.984  15.096  -5.804  1.00  3.720          H  
ATOM    607 1HG1 VAL A  35      11.392  12.920  -5.023  1.00  3.720          H  
ATOM    608 2HG1 VAL A  35      12.589  12.827  -6.265  1.00  3.720          H  
ATOM    609 3HG1 VAL A  35      13.081  12.577  -4.627  1.00  3.720          H  
ATOM    610 1HG2 VAL A  35      11.371  14.756  -3.462  1.00  3.720          H  
ATOM    611 2HG2 VAL A  35      13.071  14.477  -3.040  1.00  3.720          H  
ATOM    612 3HG2 VAL A  35      12.547  16.078  -3.609  1.00  3.720          H  
ATOM    613  N   SER A  36      15.410  16.944  -5.240  1.00  1.850          N  
ATOM    614  CA  SER A  36      15.668  18.373  -5.272  1.00  1.850          C  
ATOM    615  C   SER A  36      17.135  18.643  -5.556  1.00  1.330          C  
ATOM    616  O   SER A  36      18.016  17.961  -5.016  1.00  2.000          O  
ATOM    617  CB  SER A  36      15.268  19.011  -3.962  1.00  2.590          C  
ATOM    618  OG  SER A  36      15.544  20.383  -3.977  1.00  2.590          O  
ATOM    619  H   SER A  36      16.144  16.313  -4.952  1.00  2.220          H  
ATOM    620  HA  SER A  36      15.080  18.815  -6.075  1.00  2.220          H  
ATOM    621 1HB  SER A  36      14.203  18.849  -3.794  1.00  3.110          H  
ATOM    622 2HB  SER A  36      15.806  18.534  -3.146  1.00  3.110          H  
ATOM    623  HG  SER A  36      15.259  20.717  -3.122  1.00  3.110          H  
ATOM    624  N   VAL A  37      17.375  19.624  -6.427  1.00  1.390          N  
ATOM    625  CA  VAL A  37      18.703  20.041  -6.842  1.00  2.070          C  
ATOM    626  C   VAL A  37      18.624  21.338  -7.631  1.00  2.810          C  
ATOM    627  O   VAL A  37      19.603  22.076  -7.713  1.00  3.470          O  
ATOM    628  OXT VAL A  37      17.678  21.492  -8.406  1.00  3.100          O  
ATOM    629  CB  VAL A  37      19.353  18.932  -7.696  1.00  2.390          C  
ATOM    630  CG1 VAL A  37      18.529  18.678  -8.948  1.00  2.390          C  
ATOM    631  CG2 VAL A  37      20.773  19.308  -8.082  1.00  2.390          C  
ATOM    632  H   VAL A  37      16.576  20.123  -6.798  1.00  1.670          H  
ATOM    633  HA  VAL A  37      19.312  20.205  -5.951  1.00  2.480          H  
ATOM    634  HB  VAL A  37      19.360  18.032  -7.117  1.00  2.860          H  
ATOM    635 1HG1 VAL A  37      18.973  17.868  -9.525  1.00  2.860          H  
ATOM    636 2HG1 VAL A  37      17.532  18.408  -8.668  1.00  2.860          H  
ATOM    637 3HG1 VAL A  37      18.499  19.569  -9.564  1.00  2.860          H  
ATOM    638 1HG2 VAL A  37      21.209  18.500  -8.663  1.00  2.860          H  
ATOM    639 2HG2 VAL A  37      20.769  20.216  -8.682  1.00  2.860          H  
ATOM    640 3HG2 VAL A  37      21.361  19.472  -7.183  1.00  2.860          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 -205.068 23.0398 146.216 -15.944 3.52786 9.64522 77.3977 -84.0372 -0.17132 -1.32571 -69.517 -9.27394 -26.813 -1.45447 -2.19226 -1.6049 0 -0.38539 2.08839 20.2099 39.1655 -6.3868 2.25148 -3.16841 -5.16824 18.0171 -90.9514
ASP:NtermProteinFull_1 -3.39405 0.2955 6.11241 -0.23304 0.0554 0.74131 2.77335 -2.37191 -0 -0 -6.44484 -0.23559 0 0 -0.57081 0 0 -0.0663 0.01029 0 2.18592 0 0 -2.3716 0 0.15515 -3.35883
TRP_2 -5.64756 0.54969 2.14827 -1.41806 0.14377 0.68793 1.77013 -1.79719 -0 -0 -1.58793 -0.23501 0 0 0 0 0 -0.01652 1e-05 0 1.71919 -0.216 0 1.6906 -0.04702 0.3449 -1.9108
PHE_3 -6.44205 0.81387 3.87256 -0.62643 0.03062 0.26142 2.22937 -2.44191 -0 -0 -1.86069 0.01171 0 0 0 0 0 -0.00264 0.14697 0 3.00207 -0.15912 0 1.0402 -0.13311 0.44136 0.18421
LYS_4 -4.94504 0.50186 7.29116 -0.39207 0.06902 0.28739 2.56623 -3.02352 -0 -0 -4.68689 0.40996 0 0 -0.57081 0 0 -0.01136 0.101 2.34532 0 0.01603 0 -1.5107 -0.24786 0.48541 -1.31487
ALA_5 -3.91591 0.16113 4.38158 -0.02146 0 0 2.23928 -2.28491 -0 -0 -1.9047 -0.36647 0 0 0 0 0 0.05339 0 0 0 -0.24232 0 1.8394 -0.36602 0.33297 -0.09404
PHE_6 -9.10459 0.8918 4.18293 -0.93745 0.05742 0.28303 3.1872 -3.04067 -0.01441 -0.06698 -3.07898 -0.12105 0 0 0 0 0 0.03835 0.47274 0 1.81958 -0.43832 0 1.0402 -0.14676 0.34068 -4.63528
TYR_7 -10.3664 1.14964 5.25302 -0.5828 0.12436 0.2856 3.52869 -3.71855 -0.00236 -0.02502 -3.6129 -0.31332 0 0 -0.52532 0 0 -0.01552 0.06145 0 3.00577 0.00791 0.45023 1.2797 -0.05787 0.65041 -3.42334
ASP_8 -3.83814 0.18301 5.03338 -0.11346 0.02553 0.35295 2.02173 -2.4027 -0.02983 -0.24963 -1.58555 -0.19987 0 0 0 0 0 -0.03317 0.07741 0 1.98061 0.15612 0 -2.3716 -0.18337 0.54055 -0.63602
LYS_9 -4.26693 0.13268 5.01203 -0.30046 0.02724 0.13365 2.27626 -2.3096 -0 -0 -2.0283 -0.01012 0 0 0 0 0 -0.04165 0.02057 1.80225 0 -0.02862 0 -1.5107 -0.21718 0.19914 -1.10975
VAL_10 -7.94968 1.4139 3.12641 -0.36213 0.19545 0.08412 2.95572 -2.77887 -0 -0 -2.76638 0.08402 0 0 0 0 0 0.00171 0.09272 0.94878 0 -0.15054 0 1.9342 -0.19559 0.39537 -2.9708
ALA_11 -6.35114 0.77583 4.31593 -0.02258 0 0 3.09537 -2.88116 -0.01441 -0.06698 -2.27847 -0.35938 0 0 0 0 0 0.04816 0 0 0 -0.27797 0 1.8394 -0.30555 0.66228 -1.82066
GLU_12 -4.89052 0.31991 6.83459 -0.45027 0.06732 0.88351 3.06954 -2.91657 -0.01126 -0.10239 -3.38261 -0.48801 0 0 0 -0.80245 0 0.1138 0.00274 0 3.38336 -0.28093 0 -2.7348 -0.52248 0.51181 -1.3957
LYS_13 -5.39851 0.26851 5.14402 -0.30127 0.02687 0.13175 2.40022 -2.51544 -0.02074 -0.15992 -1.41422 -0.02818 0 0 0 0 0 0.01124 0.00109 1.73231 0 -0.03435 0 -1.5107 -0.51981 0.33063 -1.85649
PHE_14 -13.1129 2.91523 5.33561 -1.16315 0.23717 0.42641 3.94774 -4.11713 -0.01261 -0.12878 -2.80985 0.03278 0 0 0 0 0 0.00764 0.07004 0 1.82996 -0.37774 0 1.0402 -0.27469 0.88322 -5.27088
LYS_15 -5.70748 0.28493 6.87901 -0.30244 0.02304 0.13435 2.78131 -2.91329 -0 -0 -2.94237 -0.00172 0 0 0 -0.80245 0 0.12898 0.11287 1.6602 0 -0.07811 0 -1.5107 -0.22159 0.9731 -1.50236
GLU_16 -2.663 0.18678 3.46684 -0.20849 0.02212 0.28039 1.32281 -1.59789 -0.02074 -0.15992 -0.33266 -0.57121 0 0 0 0 0 -0.05629 0.01904 0 3.01469 -0.33199 0 -2.7348 -0.51329 0.36699 -0.5106
ALA_17 -4.44039 0.34444 1.57414 -0.02081 0 0 1.82557 -1.79667 -0 -0 -0.87617 -0.28779 0 0 0 0 0 -0.00155 0 0 0 0.2716 0 1.8394 -0.05684 0.41643 -1.20865
PHE_18 -7.20757 1.31859 2.60172 -0.53787 0.03151 0.26092 2.0082 -2.16115 -0 -0 -0.98285 0.06026 0 0 0 0 0 0.00301 0.10157 0 2.12199 -0.36055 0 1.0402 0.67662 1.41978 0.39438
PRO_19 -3.02776 0.58848 2.62861 -0.11197 0.00209 0.08199 1.68921 -1.22676 -0 -0 -1.60853 0.27893 0 0 0 0 0 -0.08725 0.01656 0.13144 0 -1.07355 0 -2.4119 0.05702 1.51396 -2.55941
TRP_20 -5.31114 0.46085 3.7431 -1.40823 0.24179 0.56462 1.63961 -1.89034 -0 -0 -0.97425 -0.58682 0 0 0 0 0 -0.19582 0.00774 0 1.10283 -0.17038 0 1.6906 -0.28048 0.56363 -0.8027
LYS_21 -4.89333 0.51609 3.76585 -0.31653 0.03328 0.14742 1.22168 -1.9063 -0 -0 -0.44616 -0.03663 0 0 0 0 0 -0.05438 0.00109 1.72917 0 -0.04227 0 -1.5107 -0.18141 0.24994 -1.72319
VAL_22 -5.65755 0.98397 3.66912 -0.3093 0.26487 0.07119 2.22371 -2.2698 -0 -0 -1.67155 -0.42724 0 0 0 0 0 0.05144 0.12539 0.62431 0 -0.23155 0 1.9342 -0.27745 0.42411 -0.47215
ARG_23 -9.31755 0.94455 6.80844 -0.85835 0.34403 0.73194 2.8276 -3.44879 -0.02428 -0.17976 -1.46628 0.21152 0 0 0 0 0 -0.01919 0.14033 3.9476 0 -0.11027 0 -1.2888 -0.00915 0.73406 -0.03234
LYS_24 -4.77651 0.27629 5.37462 -0.40974 0.05064 0.21889 2.36121 -2.46277 -0 -0 -2.53374 -0.13476 0 0 0 0 0 0.02744 0.01045 1.90451 0 0.03067 0 -1.5107 -0.07279 0.50485 -1.14145
SER_25 -4.25229 0.23744 4.92602 -0.02738 0 0.06406 2.31838 -2.36515 -0 -0 -1.51351 -0.61654 0 0 0 0 0 -0.01518 0.00012 0.59368 0 0.35368 0.60049 -0.77834 0.11667 0.21008 -0.14775
PHE_26 -9.36181 1.01752 5.01182 -0.53419 0.08266 0.20385 3.32584 -3.39061 -0 -0 -2.92634 -0.08306 0 0 0 0 0 -0.03438 0.05875 0 3.04414 -0.0236 0 1.0402 0.09118 0.36208 -2.11593
PHE_27 -7.51859 0.45448 6.23048 -0.88471 0.04618 0.28999 2.71299 -3.29337 -0 -0 -3.1352 -0.00131 0 0 0 0 0 0.00181 0.145 0 1.90083 -0.25408 0 1.0402 -0.07904 0.37662 -1.96772
LYS_28 -3.56083 0.19819 3.8767 -0.42627 0.07367 0.24392 1.62628 -1.79777 -0.00571 -0.03252 -1.06297 -0.13977 0 0 0 0 0 -0.04901 0.00986 1.99117 0 -0.03802 0 -1.5107 -0.14324 0.19322 -0.55381
LEU_29 -3.74817 0.29356 3.74063 -0.51572 0.22093 0.14835 1.26273 -1.7935 -0 -0 -0.9723 0.13816 0 0 0 0 0 -0.07489 0.03439 0.08891 0 -0.11322 0 0.18072 -0.44317 0.27231 -1.2803
GLN_30 -5.23893 0.49727 4.45953 -0.59724 0.11868 0.59438 2.51441 -2.38268 -0.00236 -0.02502 -3.57923 -0.42707 0 0 -0.52532 0 0 -0.08569 0.11676 0 2.6773 -0.21614 0 -0.18838 -0.44173 0.36882 -2.36263
GLY_31 -2.48056 0.12683 2.77935 -0.0004 0 0 1.15201 -1.44295 -0 -0 -1.29616 -0.19442 0 0 0 0 0 -0.06856 0 0 0 -0.74549 0 0.83697 0.05834 0.2534 -1.02165
SER_32 -2.1152 0.30812 1.4002 -0.02724 0 0.06346 0.70485 -0.87862 -0 -0 0.3587 -0.56808 0 0 0 0 0 0.01769 0.00352 0.16473 0 -0.46348 0.60066 -0.77834 -0.05127 0.19934 -1.06095
PHE_33 -10.5442 1.80471 0.17395 -0.5334 0.17204 0.25516 1.01501 -1.9849 -0 -0 -0.19449 -0.1201 0 0 0 0 0 0.02409 0.09846 0 2.47898 -0.23837 0 1.0402 -0.43057 0.6331 -6.35036
ASP_34 -4.15795 0.63317 2.86705 -0.12461 0.01233 0.37811 1.53702 -1.70873 -0.01261 -0.12878 -0.68254 -0.40393 0 0 0 0 0 0.05213 0.01842 0 3.89825 -0.82629 0 -2.3716 -0.23411 0.71679 -0.53788
VAL_35 -5.39954 0.7116 1.1292 -0.33023 0.23602 0.07746 0.64557 -1.44526 -0 -0 -0.56575 -0.27169 0 0 0 0 0 -0.02819 0.01031 0.03738 0 0.5326 0 1.9342 0.12549 0.45269 -2.14814
SER_36 -1.83419 0.12701 1.29731 -0.02769 0 0.04676 0.3552 -0.82073 -0 -0 -0.26289 -1.0021 0 0 0 0 0 -0.00874 3e-05 0.39427 0 -0.23214 0.6001 -0.77834 0.28022 0.30514 -1.56079
VAL:CtermProteinFull_37 -2.23002 0.3524 -0.23116 -0.50662 0.49179 0.22895 0.26565 -0.45899 -0 -0 -0.40748 -2.27005 0 0 0 0 0 0 0.00071 0.11388 0 0 0 1.9342 0.07965 0.23278 -2.40429
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691851 DOMAINID 682966 MODEL 3 pep1_AB
MODEL     3
REMARK    Rerank model02.pdb to model03.pdb score: 19.648
REMARK    CLUSTER 0002 t000_.out.valid.rescored.best_scoring.binary cluster_size: 11 cluster_threshold: 2.176304
REMARK    SCORE     cart_bonded:          18.803
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE        hbond_sc:          -3.364
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE           score:         -58.978
REMARK    SCORE          fa_sol:         111.035
REMARK    SCORE     lk_ball_wtd:          -3.763
REMARK    SCORE             ref:           9.690
REMARK    SCORE     total_score:         -58.978
REMARK    SCORE         p_aa_pp:          -8.062
REMARK    SCORE     hbond_lr_bb:          -5.779
REMARK    SCORE           omega:           0.308
REMARK    SCORE     rama_prepro:           2.688
REMARK    SCORE fa_intra_sol_xover4:           9.543
REMARK    SCORE     description: cluster0002_0001
REMARK    SCORE         fa_elec:         -62.258
REMARK    SCORE    fa_intra_rep:           0.478
REMARK    SCORE            time:           0.000
REMARK    SCORE          fa_atr:        -184.450
REMARK    SCORE     hbond_bb_sc:          -0.855
REMARK    SCORE          fa_rep:          19.358
REMARK    SCORE     hbond_sr_bb:         -18.521
REMARK    SCORE          fa_dun:          56.170
ATOM      1  N   ASP A   1      -0.119   0.511   0.694  1.00  1.280          N  
ATOM      2  CA  ASP A   1       1.321   0.333   0.538  1.00  0.900          C  
ATOM      3  C   ASP A   1       1.968   1.635   0.071  1.00  0.800          C  
ATOM      4  O   ASP A   1       1.642   2.150  -1.010  1.00  0.780          O  
ATOM      5  CB  ASP A   1       1.641  -0.827  -0.430  1.00  1.410          C  
ATOM      6  CG  ASP A   1       3.173  -1.150  -0.534  1.00  1.410          C  
ATOM      7  OD1 ASP A   1       3.967  -0.303  -0.142  1.00  1.410          O  
ATOM      8  OD2 ASP A   1       3.530  -2.231  -1.010  1.00  1.410          O  
ATOM      9 1H   ASP A   1      -0.592  -0.355   0.478  1.00  1.540          H  
ATOM     10 2H   ASP A   1      -0.324   0.778   1.647  1.00  1.540          H  
ATOM     11 3H   ASP A   1      -0.440   1.236   0.067  1.00  1.540          H  
ATOM     12  HA  ASP A   1       1.742   0.078   1.511  1.00  1.080          H  
ATOM     13 1HB  ASP A   1       1.120  -1.729  -0.100  1.00  1.690          H  
ATOM     14 2HB  ASP A   1       1.267  -0.582  -1.426  1.00  1.690          H  
ATOM     15  N   TRP A   2       2.860   2.170   0.909  1.00  0.940          N  
ATOM     16  CA  TRP A   2       3.578   3.415   0.645  1.00  1.080          C  
ATOM     17  C   TRP A   2       4.338   3.395  -0.656  1.00  1.010          C  
ATOM     18  O   TRP A   2       4.435   4.415  -1.327  1.00  0.970          O  
ATOM     19  CB  TRP A   2       4.572   3.767   1.756  1.00  1.460          C  
ATOM     20  CG  TRP A   2       5.364   5.032   1.429  1.00  1.460          C  
ATOM     21  CD1 TRP A   2       4.970   6.311   1.666  1.00  1.460          C  
ATOM     22  CD2 TRP A   2       6.686   5.132   0.810  1.00  1.460          C  
ATOM     23  NE1 TRP A   2       5.931   7.194   1.229  1.00  1.460          N  
ATOM     24  CE2 TRP A   2       6.983   6.486   0.701  1.00  1.460          C  
ATOM     25  CE3 TRP A   2       7.608   4.202   0.350  1.00  1.460          C  
ATOM     26  CZ2 TRP A   2       8.171   6.932   0.137  1.00  1.460          C  
ATOM     27  CZ3 TRP A   2       8.791   4.645  -0.210  1.00  1.460          C  
ATOM     28  CH2 TRP A   2       9.068   5.971  -0.323  1.00  1.460          C  
ATOM     29  H   TRP A   2       3.071   1.669   1.762  1.00  1.130          H  
ATOM     30  HA  TRP A   2       2.844   4.218   0.590  1.00  1.300          H  
ATOM     31 1HB  TRP A   2       4.040   3.921   2.693  1.00  1.750          H  
ATOM     32 2HB  TRP A   2       5.273   2.945   1.898  1.00  1.750          H  
ATOM     33  HD1 TRP A   2       4.026   6.596   2.127  1.00  1.750          H  
ATOM     34  HE1 TRP A   2       5.872   8.199   1.289  1.00  1.750          H  
ATOM     35  HE3 TRP A   2       7.400   3.149   0.434  1.00  1.750          H  
ATOM     36  HZ2 TRP A   2       8.409   7.992   0.045  1.00  1.750          H  
ATOM     37  HZ3 TRP A   2       9.495   3.907  -0.557  1.00  1.750          H  
ATOM     38  HH2 TRP A   2      10.014   6.284  -0.775  1.00  1.750          H  
ATOM     39  N   PHE A   3       4.981   2.280  -0.968  1.00  1.180          N  
ATOM     40  CA  PHE A   3       5.838   2.213  -2.136  1.00  1.340          C  
ATOM     41  C   PHE A   3       5.049   2.418  -3.418  1.00  1.160          C  
ATOM     42  O   PHE A   3       5.513   3.087  -4.348  1.00  1.190          O  
ATOM     43  CB  PHE A   3       6.530   0.868  -2.121  1.00  1.810          C  
ATOM     44  CG  PHE A   3       7.570   0.776  -1.026  1.00  1.810          C  
ATOM     45  CD1 PHE A   3       7.222   0.305   0.229  1.00  1.810          C  
ATOM     46  CD2 PHE A   3       8.884   1.133  -1.240  1.00  1.810          C  
ATOM     47  CE1 PHE A   3       8.155   0.217   1.229  1.00  1.810          C  
ATOM     48  CE2 PHE A   3       9.820   1.039  -0.247  1.00  1.810          C  
ATOM     49  CZ  PHE A   3       9.457   0.586   0.990  1.00  1.810          C  
ATOM     50  H   PHE A   3       4.846   1.426  -0.408  1.00  1.420          H  
ATOM     51  HA  PHE A   3       6.585   3.003  -2.064  1.00  1.610          H  
ATOM     52 1HB  PHE A   3       5.784   0.093  -1.946  1.00  2.170          H  
ATOM     53 2HB  PHE A   3       6.991   0.667  -3.074  1.00  2.170          H  
ATOM     54  HD1 PHE A   3       6.194   0.002   0.426  1.00  2.170          H  
ATOM     55  HD2 PHE A   3       9.186   1.477  -2.198  1.00  2.170          H  
ATOM     56  HE1 PHE A   3       7.864  -0.153   2.212  1.00  2.170          H  
ATOM     57  HE2 PHE A   3      10.856   1.315  -0.443  1.00  2.170          H  
ATOM     58  HZ  PHE A   3      10.201   0.508   1.780  1.00  2.170          H  
ATOM     59  N   LYS A   4       3.857   1.833  -3.472  1.00  1.100          N  
ATOM     60  CA  LYS A   4       3.003   1.975  -4.633  1.00  1.190          C  
ATOM     61  C   LYS A   4       2.447   3.378  -4.677  1.00  0.940          C  
ATOM     62  O   LYS A   4       2.480   4.030  -5.725  1.00  1.020          O  
ATOM     63  CB  LYS A   4       1.879   0.936  -4.617  1.00  1.630          C  
ATOM     64  CG  LYS A   4       0.841   1.042  -5.773  1.00  1.630          C  
ATOM     65  CD  LYS A   4       1.468   0.906  -7.164  1.00  1.630          C  
ATOM     66  CE  LYS A   4       0.425   0.536  -8.246  1.00  1.630          C  
ATOM     67  NZ  LYS A   4      -0.755   1.476  -8.289  1.00  1.630          N  
ATOM     68  H   LYS A   4       3.539   1.298  -2.672  1.00  1.320          H  
ATOM     69  HA  LYS A   4       3.607   1.824  -5.527  1.00  1.430          H  
ATOM     70 1HB  LYS A   4       2.313  -0.062  -4.646  1.00  1.960          H  
ATOM     71 2HB  LYS A   4       1.333   1.021  -3.674  1.00  1.960          H  
ATOM     72 1HG  LYS A   4       0.094   0.260  -5.646  1.00  1.960          H  
ATOM     73 2HG  LYS A   4       0.338   2.010  -5.713  1.00  1.960          H  
ATOM     74 1HD  LYS A   4       1.917   1.867  -7.449  1.00  1.960          H  
ATOM     75 2HD  LYS A   4       2.250   0.150  -7.146  1.00  1.960          H  
ATOM     76 1HE  LYS A   4       0.921   0.563  -9.214  1.00  1.960          H  
ATOM     77 2HE  LYS A   4       0.064  -0.475  -8.063  1.00  1.960          H  
ATOM     78 1HZ  LYS A   4      -1.385   1.193  -9.018  1.00  1.960          H  
ATOM     79 2HZ  LYS A   4      -1.239   1.460  -7.413  1.00  1.960          H  
ATOM     80 3HZ  LYS A   4      -0.463   2.450  -8.469  1.00  1.960          H  
ATOM     81  N   ALA A   5       1.939   3.861  -3.537  1.00  0.770          N  
ATOM     82  CA  ALA A   5       1.371   5.192  -3.515  1.00  0.880          C  
ATOM     83  C   ALA A   5       2.418   6.224  -3.895  1.00  0.770          C  
ATOM     84  O   ALA A   5       2.125   7.168  -4.633  1.00  0.870          O  
ATOM     85  CB  ALA A   5       0.817   5.497  -2.139  1.00  1.190          C  
ATOM     86  H   ALA A   5       1.927   3.289  -2.686  1.00  0.920          H  
ATOM     87  HA  ALA A   5       0.567   5.233  -4.249  1.00  1.060          H  
ATOM     88 1HB  ALA A   5       0.378   6.489  -2.135  1.00  1.430          H  
ATOM     89 2HB  ALA A   5       0.059   4.757  -1.883  1.00  1.430          H  
ATOM     90 3HB  ALA A   5       1.627   5.452  -1.411  1.00  1.430          H  
ATOM     91  N   PHE A   6       3.648   6.034  -3.403  1.00  0.770          N  
ATOM     92  CA  PHE A   6       4.737   6.933  -3.687  1.00  0.960          C  
ATOM     93  C   PHE A   6       5.003   6.973  -5.160  1.00  0.860          C  
ATOM     94  O   PHE A   6       5.069   8.052  -5.739  1.00  0.880          O  
ATOM     95  CB  PHE A   6       6.019   6.543  -2.976  1.00  1.270          C  
ATOM     96  CG  PHE A   6       7.133   7.465  -3.328  1.00  1.270          C  
ATOM     97  CD1 PHE A   6       7.262   8.683  -2.698  1.00  1.270          C  
ATOM     98  CD2 PHE A   6       8.030   7.142  -4.307  1.00  1.270          C  
ATOM     99  CE1 PHE A   6       8.276   9.547  -3.040  1.00  1.270          C  
ATOM    100  CE2 PHE A   6       9.043   8.000  -4.652  1.00  1.270          C  
ATOM    101  CZ  PHE A   6       9.168   9.201  -4.019  1.00  1.270          C  
ATOM    102  H   PHE A   6       3.833   5.255  -2.778  1.00  0.920          H  
ATOM    103  HA  PHE A   6       4.453   7.932  -3.362  1.00  1.150          H  
ATOM    104 1HB  PHE A   6       5.861   6.567  -1.906  1.00  1.520          H  
ATOM    105 2HB  PHE A   6       6.305   5.525  -3.243  1.00  1.520          H  
ATOM    106  HD1 PHE A   6       6.548   8.955  -1.920  1.00  1.520          H  
ATOM    107  HD2 PHE A   6       7.924   6.187  -4.819  1.00  1.520          H  
ATOM    108  HE1 PHE A   6       8.367  10.507  -2.534  1.00  1.520          H  
ATOM    109  HE2 PHE A   6       9.745   7.728  -5.431  1.00  1.520          H  
ATOM    110  HZ  PHE A   6       9.968   9.883  -4.294  1.00  1.520          H  
ATOM    111  N   TYR A   7       5.177   5.807  -5.798  1.00  0.950          N  
ATOM    112  CA  TYR A   7       5.460   5.850  -7.215  1.00  1.200          C  
ATOM    113  C   TYR A   7       4.393   6.576  -7.987  1.00  1.020          C  
ATOM    114  O   TYR A   7       4.703   7.454  -8.788  1.00  1.050          O  
ATOM    115  CB  TYR A   7       5.647   4.490  -7.848  1.00  1.580          C  
ATOM    116  CG  TYR A   7       5.767   4.618  -9.390  1.00  1.580          C  
ATOM    117  CD1 TYR A   7       6.900   5.184  -9.981  1.00  1.580          C  
ATOM    118  CD2 TYR A   7       4.748   4.155 -10.203  1.00  1.580          C  
ATOM    119  CE1 TYR A   7       7.014   5.279 -11.344  1.00  1.580          C  
ATOM    120  CE2 TYR A   7       4.863   4.252 -11.574  1.00  1.580          C  
ATOM    121  CZ  TYR A   7       5.994   4.806 -12.142  1.00  1.580          C  
ATOM    122  OH  TYR A   7       6.108   4.886 -13.507  1.00  1.580          O  
ATOM    123  H   TYR A   7       5.128   4.910  -5.300  1.00  1.140          H  
ATOM    124  HA  TYR A   7       6.394   6.379  -7.342  1.00  1.440          H  
ATOM    125 1HB  TYR A   7       6.530   4.016  -7.456  1.00  1.900          H  
ATOM    126 2HB  TYR A   7       4.789   3.853  -7.610  1.00  1.900          H  
ATOM    127  HD1 TYR A   7       7.684   5.563  -9.376  1.00  1.900          H  
ATOM    128  HD2 TYR A   7       3.849   3.712  -9.761  1.00  1.900          H  
ATOM    129  HE1 TYR A   7       7.903   5.726 -11.791  1.00  1.900          H  
ATOM    130  HE2 TYR A   7       4.056   3.884 -12.209  1.00  1.900          H  
ATOM    131  HH  TYR A   7       5.294   4.584 -13.915  1.00  1.900          H  
ATOM    132  N   ASP A   8       3.128   6.225  -7.781  1.00  1.010          N  
ATOM    133  CA  ASP A   8       2.107   6.878  -8.579  1.00  1.220          C  
ATOM    134  C   ASP A   8       2.098   8.394  -8.371  1.00  1.070          C  
ATOM    135  O   ASP A   8       1.953   9.157  -9.335  1.00  1.240          O  
ATOM    136  CB  ASP A   8       0.734   6.297  -8.250  1.00  1.620          C  
ATOM    137  CG  ASP A   8       0.512   4.875  -8.808  1.00  1.620          C  
ATOM    138  OD1 ASP A   8       1.229   4.448  -9.675  1.00  1.620          O  
ATOM    139  OD2 ASP A   8      -0.390   4.218  -8.335  1.00  1.620          O  
ATOM    140  H   ASP A   8       2.893   5.496  -7.096  1.00  1.210          H  
ATOM    141  HA  ASP A   8       2.321   6.679  -9.627  1.00  1.460          H  
ATOM    142 1HB  ASP A   8       0.625   6.259  -7.159  1.00  1.950          H  
ATOM    143 2HB  ASP A   8      -0.041   6.957  -8.633  1.00  1.950          H  
ATOM    144  N   LYS A   9       2.280   8.849  -7.124  1.00  0.890          N  
ATOM    145  CA  LYS A   9       2.279  10.278  -6.858  1.00  1.000          C  
ATOM    146  C   LYS A   9       3.511  10.988  -7.411  1.00  0.820          C  
ATOM    147  O   LYS A   9       3.393  12.069  -8.006  1.00  0.900          O  
ATOM    148  CB  LYS A   9       2.181  10.528  -5.354  1.00  1.360          C  
ATOM    149  CG  LYS A   9       0.822  10.190  -4.745  1.00  1.360          C  
ATOM    150  CD  LYS A   9       0.822  10.414  -3.236  1.00  1.360          C  
ATOM    151  CE  LYS A   9      -0.522  10.053  -2.614  1.00  1.360          C  
ATOM    152  NZ  LYS A   9      -0.525  10.258  -1.132  1.00  1.360          N  
ATOM    153  H   LYS A   9       2.371   8.190  -6.341  1.00  1.070          H  
ATOM    154  HA  LYS A   9       1.403  10.711  -7.340  1.00  1.200          H  
ATOM    155 1HB  LYS A   9       2.933   9.917  -4.845  1.00  1.630          H  
ATOM    156 2HB  LYS A   9       2.405  11.572  -5.142  1.00  1.630          H  
ATOM    157 1HG  LYS A   9       0.060  10.821  -5.201  1.00  1.630          H  
ATOM    158 2HG  LYS A   9       0.580   9.151  -4.956  1.00  1.630          H  
ATOM    159 1HD  LYS A   9       1.597   9.789  -2.786  1.00  1.630          H  
ATOM    160 2HD  LYS A   9       1.048  11.457  -3.020  1.00  1.630          H  
ATOM    161 1HE  LYS A   9      -1.299  10.671  -3.058  1.00  1.630          H  
ATOM    162 2HE  LYS A   9      -0.739   9.005  -2.825  1.00  1.630          H  
ATOM    163 1HZ  LYS A   9      -1.430  10.006  -0.758  1.00  1.630          H  
ATOM    164 2HZ  LYS A   9       0.186   9.679  -0.709  1.00  1.630          H  
ATOM    165 3HZ  LYS A   9      -0.336  11.229  -0.924  1.00  1.630          H  
ATOM    166  N   VAL A  10       4.696  10.395  -7.241  1.00  0.730          N  
ATOM    167  CA  VAL A  10       5.890  11.074  -7.693  1.00  0.840          C  
ATOM    168  C   VAL A  10       5.901  11.061  -9.217  1.00  0.780          C  
ATOM    169  O   VAL A  10       6.322  12.041  -9.826  1.00  0.790          O  
ATOM    170  CB  VAL A  10       7.181  10.453  -7.093  1.00  1.130          C  
ATOM    171  CG1 VAL A  10       7.591   9.165  -7.811  1.00  1.130          C  
ATOM    172  CG2 VAL A  10       8.262  11.486  -7.120  1.00  1.130          C  
ATOM    173  H   VAL A  10       4.760   9.500  -6.755  1.00  0.880          H  
ATOM    174  HA  VAL A  10       5.844  12.108  -7.359  1.00  1.010          H  
ATOM    175  HB  VAL A  10       6.980  10.163  -6.058  1.00  1.360          H  
ATOM    176 1HG1 VAL A  10       8.472   8.751  -7.343  1.00  1.360          H  
ATOM    177 2HG1 VAL A  10       6.789   8.476  -7.739  1.00  1.360          H  
ATOM    178 3HG1 VAL A  10       7.811   9.357  -8.846  1.00  1.360          H  
ATOM    179 1HG2 VAL A  10       9.175  11.082  -6.684  1.00  1.360          H  
ATOM    180 2HG2 VAL A  10       8.429  11.769  -8.135  1.00  1.360          H  
ATOM    181 3HG2 VAL A  10       7.943  12.358  -6.554  1.00  1.360          H  
ATOM    182  N   ALA A  11       5.432   9.963  -9.828  1.00  0.880          N  
ATOM    183  CA  ALA A  11       5.374   9.832 -11.266  1.00  1.080          C  
ATOM    184  C   ALA A  11       4.482  10.897 -11.883  1.00  1.010          C  
ATOM    185  O   ALA A  11       4.842  11.451 -12.925  1.00  1.060          O  
ATOM    186  CB  ALA A  11       4.883   8.454 -11.643  1.00  1.430          C  
ATOM    187  H   ALA A  11       5.124   9.167  -9.270  1.00  1.060          H  
ATOM    188  HA  ALA A  11       6.376   9.963 -11.655  1.00  1.300          H  
ATOM    189 1HB  ALA A  11       4.872   8.347 -12.724  1.00  1.720          H  
ATOM    190 2HB  ALA A  11       5.547   7.719 -11.211  1.00  1.720          H  
ATOM    191 3HB  ALA A  11       3.876   8.307 -11.249  1.00  1.720          H  
ATOM    192  N   GLU A  12       3.346  11.220 -11.242  1.00  1.010          N  
ATOM    193  CA  GLU A  12       2.489  12.264 -11.790  1.00  1.170          C  
ATOM    194  C   GLU A  12       3.223  13.606 -11.697  1.00  0.940          C  
ATOM    195  O   GLU A  12       3.161  14.425 -12.621  1.00  1.030          O  
ATOM    196  CB  GLU A  12       1.156  12.330 -11.042  1.00  1.570          C  
ATOM    197  CG  GLU A  12       0.102  13.277 -11.666  1.00  1.570          C  
ATOM    198  CD  GLU A  12      -0.392  12.804 -13.034  1.00  1.570          C  
ATOM    199  OE1 GLU A  12      -0.216  11.648 -13.339  1.00  1.570          O  
ATOM    200  OE2 GLU A  12      -0.947  13.593 -13.758  1.00  1.570          O  
ATOM    201  H   GLU A  12       3.036  10.680 -10.426  1.00  1.210          H  
ATOM    202  HA  GLU A  12       2.291  12.043 -12.839  1.00  1.400          H  
ATOM    203 1HB  GLU A  12       0.725  11.329 -10.987  1.00  1.890          H  
ATOM    204 2HB  GLU A  12       1.338  12.657 -10.016  1.00  1.890          H  
ATOM    205 1HG  GLU A  12      -0.750  13.345 -10.991  1.00  1.890          H  
ATOM    206 2HG  GLU A  12       0.530  14.276 -11.766  1.00  1.890          H  
ATOM    207  N   LYS A  13       3.937  13.834 -10.582  1.00  0.740          N  
ATOM    208  CA  LYS A  13       4.698  15.070 -10.439  1.00  0.790          C  
ATOM    209  C   LYS A  13       5.788  15.154 -11.508  1.00  0.610          C  
ATOM    210  O   LYS A  13       5.997  16.225 -12.084  1.00  0.710          O  
ATOM    211  CB  LYS A  13       5.324  15.185  -9.046  1.00  1.090          C  
ATOM    212  CG  LYS A  13       4.326  15.438  -7.921  1.00  1.090          C  
ATOM    213  CD  LYS A  13       5.021  15.504  -6.557  1.00  1.090          C  
ATOM    214  CE  LYS A  13       4.019  15.730  -5.431  1.00  1.090          C  
ATOM    215  NZ  LYS A  13       4.681  15.761  -4.094  1.00  1.090          N  
ATOM    216  H   LYS A  13       3.903  13.154  -9.814  1.00  0.890          H  
ATOM    217  HA  LYS A  13       4.021  15.910 -10.586  1.00  0.950          H  
ATOM    218 1HB  LYS A  13       5.861  14.272  -8.813  1.00  1.300          H  
ATOM    219 2HB  LYS A  13       6.049  15.997  -9.044  1.00  1.300          H  
ATOM    220 1HG  LYS A  13       3.806  16.378  -8.107  1.00  1.300          H  
ATOM    221 2HG  LYS A  13       3.591  14.635  -7.911  1.00  1.300          H  
ATOM    222 1HD  LYS A  13       5.547  14.564  -6.378  1.00  1.300          H  
ATOM    223 2HD  LYS A  13       5.747  16.315  -6.556  1.00  1.300          H  
ATOM    224 1HE  LYS A  13       3.508  16.677  -5.594  1.00  1.300          H  
ATOM    225 2HE  LYS A  13       3.284  14.924  -5.443  1.00  1.300          H  
ATOM    226 1HZ  LYS A  13       3.986  15.912  -3.376  1.00  1.300          H  
ATOM    227 2HZ  LYS A  13       5.149  14.881  -3.927  1.00  1.300          H  
ATOM    228 3HZ  LYS A  13       5.358  16.511  -4.067  1.00  1.300          H  
ATOM    229  N   PHE A  14       6.456  14.024 -11.802  1.00  0.600          N  
ATOM    230  CA  PHE A  14       7.496  13.979 -12.824  1.00  0.810          C  
ATOM    231  C   PHE A  14       6.888  14.290 -14.182  1.00  0.790          C  
ATOM    232  O   PHE A  14       7.484  14.990 -15.001  1.00  0.890          O  
ATOM    233  CB  PHE A  14       8.138  12.592 -12.924  1.00  1.050          C  
ATOM    234  CG  PHE A  14       8.992  12.126 -11.767  1.00  1.050          C  
ATOM    235  CD1 PHE A  14       9.661  12.987 -10.908  1.00  1.050          C  
ATOM    236  CD2 PHE A  14       9.114  10.771 -11.543  1.00  1.050          C  
ATOM    237  CE1 PHE A  14      10.410  12.485  -9.882  1.00  1.050          C  
ATOM    238  CE2 PHE A  14       9.856  10.281 -10.523  1.00  1.050          C  
ATOM    239  CZ  PHE A  14      10.496  11.135  -9.698  1.00  1.050          C  
ATOM    240  H   PHE A  14       6.265  13.187 -11.245  1.00  0.720          H  
ATOM    241  HA  PHE A  14       8.241  14.731 -12.597  1.00  0.970          H  
ATOM    242 1HB  PHE A  14       7.353  11.861 -13.067  1.00  1.260          H  
ATOM    243 2HB  PHE A  14       8.757  12.565 -13.815  1.00  1.260          H  
ATOM    244  HD1 PHE A  14       9.590  14.059 -11.035  1.00  1.260          H  
ATOM    245  HD2 PHE A  14       8.599  10.091 -12.194  1.00  1.260          H  
ATOM    246  HE1 PHE A  14      10.927  13.159  -9.200  1.00  1.260          H  
ATOM    247  HE2 PHE A  14       9.931   9.206 -10.358  1.00  1.260          H  
ATOM    248  HZ  PHE A  14      11.056  10.746  -8.884  1.00  1.260          H  
ATOM    249  N   LYS A  15       5.702  13.741 -14.454  1.00  0.870          N  
ATOM    250  CA  LYS A  15       5.034  13.976 -15.723  1.00  1.110          C  
ATOM    251  C   LYS A  15       4.855  15.471 -15.968  1.00  1.050          C  
ATOM    252  O   LYS A  15       5.080  15.944 -17.082  1.00  1.240          O  
ATOM    253  CB  LYS A  15       3.687  13.251 -15.762  1.00  1.460          C  
ATOM    254  CG  LYS A  15       2.921  13.358 -17.077  1.00  1.460          C  
ATOM    255  CD  LYS A  15       1.631  12.533 -17.010  1.00  1.460          C  
ATOM    256  CE  LYS A  15       0.834  12.626 -18.300  1.00  1.460          C  
ATOM    257  NZ  LYS A  15      -0.418  11.818 -18.238  1.00  1.460          N  
ATOM    258  H   LYS A  15       5.276  13.106 -13.771  1.00  1.040          H  
ATOM    259  HA  LYS A  15       5.664  13.583 -16.521  1.00  1.330          H  
ATOM    260 1HB  LYS A  15       3.837  12.198 -15.529  1.00  1.750          H  
ATOM    261 2HB  LYS A  15       3.041  13.659 -14.989  1.00  1.750          H  
ATOM    262 1HG  LYS A  15       2.667  14.403 -17.264  1.00  1.750          H  
ATOM    263 2HG  LYS A  15       3.546  13.000 -17.895  1.00  1.750          H  
ATOM    264 1HD  LYS A  15       1.877  11.488 -16.814  1.00  1.750          H  
ATOM    265 2HD  LYS A  15       1.012  12.898 -16.181  1.00  1.750          H  
ATOM    266 1HE  LYS A  15       0.574  13.666 -18.487  1.00  1.750          H  
ATOM    267 2HE  LYS A  15       1.447  12.260 -19.123  1.00  1.750          H  
ATOM    268 1HZ  LYS A  15      -0.918  11.900 -19.112  1.00  1.750          H  
ATOM    269 2HZ  LYS A  15      -0.187  10.848 -18.071  1.00  1.750          H  
ATOM    270 3HZ  LYS A  15      -1.005  12.155 -17.482  1.00  1.750          H  
ATOM    271  N   GLU A  16       4.446  16.220 -14.935  1.00  0.980          N  
ATOM    272  CA  GLU A  16       4.315  17.666 -15.097  1.00  1.240          C  
ATOM    273  C   GLU A  16       5.670  18.401 -15.102  1.00  1.210          C  
ATOM    274  O   GLU A  16       5.877  19.330 -15.887  1.00  1.470          O  
ATOM    275  CB  GLU A  16       3.462  18.269 -13.974  1.00  1.630          C  
ATOM    276  CG  GLU A  16       1.985  17.896 -13.986  1.00  1.630          C  
ATOM    277  CD  GLU A  16       1.214  18.584 -12.868  1.00  1.630          C  
ATOM    278  OE1 GLU A  16       1.840  19.230 -12.060  1.00  1.630          O  
ATOM    279  OE2 GLU A  16       0.014  18.462 -12.825  1.00  1.630          O  
ATOM    280  H   GLU A  16       4.189  15.754 -14.056  1.00  1.180          H  
ATOM    281  HA  GLU A  16       3.825  17.854 -16.050  1.00  1.490          H  
ATOM    282 1HB  GLU A  16       3.870  17.945 -13.012  1.00  1.960          H  
ATOM    283 2HB  GLU A  16       3.536  19.354 -14.008  1.00  1.960          H  
ATOM    284 1HG  GLU A  16       1.553  18.174 -14.945  1.00  1.960          H  
ATOM    285 2HG  GLU A  16       1.895  16.812 -13.874  1.00  1.960          H  
ATOM    286  N   ALA A  17       6.573  18.012 -14.193  1.00  1.040          N  
ATOM    287  CA  ALA A  17       7.886  18.637 -14.018  1.00  1.290          C  
ATOM    288  C   ALA A  17       8.835  18.500 -15.205  1.00  1.320          C  
ATOM    289  O   ALA A  17       9.606  19.421 -15.496  1.00  1.600          O  
ATOM    290  CB  ALA A  17       8.571  18.038 -12.800  1.00  1.710          C  
ATOM    291  H   ALA A  17       6.328  17.252 -13.560  1.00  1.250          H  
ATOM    292  HA  ALA A  17       7.716  19.698 -13.847  1.00  1.550          H  
ATOM    293 1HB  ALA A  17       9.525  18.537 -12.637  1.00  2.050          H  
ATOM    294 2HB  ALA A  17       7.933  18.166 -11.925  1.00  2.050          H  
ATOM    295 3HB  ALA A  17       8.739  16.985 -12.975  1.00  2.050          H  
ATOM    296  N   PHE A  18       8.812  17.357 -15.873  1.00  1.120          N  
ATOM    297  CA  PHE A  18       9.746  17.081 -16.943  1.00  1.270          C  
ATOM    298  C   PHE A  18       9.157  17.069 -18.358  1.00  1.240          C  
ATOM    299  O   PHE A  18       8.011  16.675 -18.556  1.00  1.410          O  
ATOM    300  CB  PHE A  18      10.376  15.740 -16.691  1.00  1.720          C  
ATOM    301  CG  PHE A  18      11.315  15.660 -15.523  1.00  1.720          C  
ATOM    302  CD1 PHE A  18      10.886  15.134 -14.330  1.00  1.720          C  
ATOM    303  CD2 PHE A  18      12.636  16.090 -15.621  1.00  1.720          C  
ATOM    304  CE1 PHE A  18      11.733  15.027 -13.260  1.00  1.720          C  
ATOM    305  CE2 PHE A  18      13.483  15.982 -14.551  1.00  1.720          C  
ATOM    306  CZ  PHE A  18      13.028  15.448 -13.369  1.00  1.720          C  
ATOM    307  H   PHE A  18       8.160  16.621 -15.589  1.00  1.340          H  
ATOM    308  HA  PHE A  18      10.514  17.845 -16.870  1.00  1.520          H  
ATOM    309 1HB  PHE A  18       9.577  15.015 -16.515  1.00  2.060          H  
ATOM    310 2HB  PHE A  18      10.849  15.440 -17.549  1.00  2.060          H  
ATOM    311  HD1 PHE A  18       9.866  14.798 -14.253  1.00  2.060          H  
ATOM    312  HD2 PHE A  18      13.002  16.510 -16.551  1.00  2.060          H  
ATOM    313  HE1 PHE A  18      11.388  14.609 -12.329  1.00  2.060          H  
ATOM    314  HE2 PHE A  18      14.515  16.317 -14.632  1.00  2.060          H  
ATOM    315  HZ  PHE A  18      13.702  15.362 -12.519  1.00  2.060          H  
ATOM    316  N   PRO A  19       9.931  17.463 -19.388  1.00  1.520          N  
ATOM    317  CA  PRO A  19       9.540  17.432 -20.785  1.00  1.810          C  
ATOM    318  C   PRO A  19       9.462  16.012 -21.342  1.00  1.500          C  
ATOM    319  O   PRO A  19      10.268  15.161 -20.971  1.00  2.250          O  
ATOM    320  CB  PRO A  19      10.667  18.223 -21.458  1.00  2.710          C  
ATOM    321  CG  PRO A  19      11.869  18.026 -20.553  1.00  2.710          C  
ATOM    322  CD  PRO A  19      11.303  17.976 -19.155  1.00  2.710          C  
ATOM    323  HA  PRO A  19       8.573  17.947 -20.897  1.00  2.170          H  
ATOM    324 1HB  PRO A  19      10.837  17.842 -22.477  1.00  3.260          H  
ATOM    325 2HB  PRO A  19      10.379  19.280 -21.556  1.00  3.260          H  
ATOM    326 1HG  PRO A  19      12.388  17.092 -20.822  1.00  3.260          H  
ATOM    327 2HG  PRO A  19      12.593  18.843 -20.695  1.00  3.260          H  
ATOM    328 1HD  PRO A  19      11.908  17.283 -18.572  1.00  3.260          H  
ATOM    329 2HD  PRO A  19      11.276  18.988 -18.716  1.00  3.260          H  
ATOM    330  N   TRP A  20       8.578  15.835 -22.324  1.00  1.180          N  
ATOM    331  CA  TRP A  20       8.354  14.626 -23.138  1.00  1.300          C  
ATOM    332  C   TRP A  20       9.308  13.436 -22.978  1.00  1.330          C  
ATOM    333  O   TRP A  20       8.892  12.343 -22.600  1.00  1.890          O  
ATOM    334  CB  TRP A  20       8.350  15.014 -24.617  1.00  1.770          C  
ATOM    335  CG  TRP A  20       7.147  15.781 -25.022  1.00  1.770          C  
ATOM    336  CD1 TRP A  20       7.076  17.109 -25.317  1.00  1.770          C  
ATOM    337  CD2 TRP A  20       5.811  15.261 -25.181  1.00  1.770          C  
ATOM    338  NE1 TRP A  20       5.790  17.448 -25.648  1.00  1.770          N  
ATOM    339  CE2 TRP A  20       5.003  16.328 -25.569  1.00  1.770          C  
ATOM    340  CE3 TRP A  20       5.244  13.989 -25.029  1.00  1.770          C  
ATOM    341  CZ2 TRP A  20       3.651  16.172 -25.808  1.00  1.770          C  
ATOM    342  CZ3 TRP A  20       3.889  13.832 -25.268  1.00  1.770          C  
ATOM    343  CH2 TRP A  20       3.113  14.895 -25.648  1.00  1.770          C  
ATOM    344  H   TRP A  20       7.967  16.617 -22.521  1.00  1.420          H  
ATOM    345  HA  TRP A  20       7.357  14.269 -22.889  1.00  1.560          H  
ATOM    346 1HB  TRP A  20       9.226  15.617 -24.844  1.00  2.130          H  
ATOM    347 2HB  TRP A  20       8.405  14.114 -25.230  1.00  2.130          H  
ATOM    348  HD1 TRP A  20       7.916  17.803 -25.299  1.00  2.130          H  
ATOM    349  HE1 TRP A  20       5.471  18.372 -25.909  1.00  2.130          H  
ATOM    350  HE3 TRP A  20       5.856  13.139 -24.728  1.00  2.130          H  
ATOM    351  HZ2 TRP A  20       3.016  17.004 -26.111  1.00  2.130          H  
ATOM    352  HZ3 TRP A  20       3.455  12.840 -25.148  1.00  2.130          H  
ATOM    353  HH2 TRP A  20       2.050  14.737 -25.829  1.00  2.130          H  
ATOM    354  N   LYS A  21      10.568  13.644 -23.353  1.00  1.790          N  
ATOM    355  CA  LYS A  21      11.624  12.631 -23.413  1.00  2.680          C  
ATOM    356  C   LYS A  21      12.009  11.950 -22.101  1.00  2.450          C  
ATOM    357  O   LYS A  21      12.682  10.917 -22.110  1.00  2.980          O  
ATOM    358  CB  LYS A  21      12.905  13.265 -23.972  1.00  3.400          C  
ATOM    359  CG  LYS A  21      13.555  14.305 -23.015  1.00  3.400          C  
ATOM    360  CD  LYS A  21      14.827  14.928 -23.585  1.00  3.400          C  
ATOM    361  CE  LYS A  21      15.423  15.919 -22.581  1.00  3.400          C  
ATOM    362  NZ  LYS A  21      16.711  16.513 -23.045  1.00  3.400          N  
ATOM    363  H   LYS A  21      10.810  14.585 -23.620  1.00  2.150          H  
ATOM    364  HA  LYS A  21      11.288  11.850 -24.097  1.00  3.220          H  
ATOM    365 1HB  LYS A  21      13.640  12.485 -24.174  1.00  4.080          H  
ATOM    366 2HB  LYS A  21      12.685  13.763 -24.915  1.00  4.080          H  
ATOM    367 1HG  LYS A  21      12.837  15.092 -22.776  1.00  4.080          H  
ATOM    368 2HG  LYS A  21      13.842  13.813 -22.087  1.00  4.080          H  
ATOM    369 1HD  LYS A  21      15.557  14.143 -23.789  1.00  4.080          H  
ATOM    370 2HD  LYS A  21      14.602  15.447 -24.516  1.00  4.080          H  
ATOM    371 1HE  LYS A  21      14.704  16.720 -22.418  1.00  4.080          H  
ATOM    372 2HE  LYS A  21      15.593  15.404 -21.644  1.00  4.080          H  
ATOM    373 1HZ  LYS A  21      17.056  17.162 -22.341  1.00  4.080          H  
ATOM    374 2HZ  LYS A  21      17.391  15.775 -23.173  1.00  4.080          H  
ATOM    375 3HZ  LYS A  21      16.574  17.004 -23.914  1.00  4.080          H  
ATOM    376  N   VAL A  22      11.671  12.555 -20.982  1.00  2.030          N  
ATOM    377  CA  VAL A  22      12.123  12.028 -19.704  1.00  1.990          C  
ATOM    378  C   VAL A  22      11.551  10.700 -19.267  1.00  1.840          C  
ATOM    379  O   VAL A  22      10.338  10.474 -19.260  1.00  2.110          O  
ATOM    380  CB  VAL A  22      11.908  13.079 -18.620  1.00  2.800          C  
ATOM    381  CG1 VAL A  22      12.261  12.522 -17.188  1.00  2.800          C  
ATOM    382  CG2 VAL A  22      12.797  14.212 -18.994  1.00  2.800          C  
ATOM    383  H   VAL A  22      11.086  13.396 -21.030  1.00  2.440          H  
ATOM    384  HA  VAL A  22      13.198  11.891 -19.796  1.00  2.390          H  
ATOM    385  HB  VAL A  22      10.868  13.398 -18.608  1.00  3.360          H  
ATOM    386 1HG1 VAL A  22      12.131  13.281 -16.453  1.00  3.360          H  
ATOM    387 2HG1 VAL A  22      11.609  11.690 -16.935  1.00  3.360          H  
ATOM    388 3HG1 VAL A  22      13.285  12.191 -17.164  1.00  3.360          H  
ATOM    389 1HG2 VAL A  22      12.747  15.002 -18.307  1.00  3.360          H  
ATOM    390 2HG2 VAL A  22      13.771  13.826 -19.014  1.00  3.360          H  
ATOM    391 3HG2 VAL A  22      12.536  14.588 -19.975  1.00  3.360          H  
ATOM    392  N   ARG A  23      12.472   9.825 -18.870  1.00  1.950          N  
ATOM    393  CA  ARG A  23      12.104   8.515 -18.353  1.00  2.220          C  
ATOM    394  C   ARG A  23      12.024   8.593 -16.840  1.00  1.830          C  
ATOM    395  O   ARG A  23      12.700   9.430 -16.226  1.00  1.770          O  
ATOM    396  CB  ARG A  23      13.101   7.432 -18.750  1.00  3.000          C  
ATOM    397  CG  ARG A  23      14.480   7.577 -18.132  1.00  3.000          C  
ATOM    398  CD  ARG A  23      15.369   6.433 -18.447  1.00  3.000          C  
ATOM    399  NE  ARG A  23      16.702   6.616 -17.867  1.00  3.000          N  
ATOM    400  CZ  ARG A  23      17.068   6.289 -16.599  1.00  3.000          C  
ATOM    401  NH1 ARG A  23      16.236   5.754 -15.745  1.00  3.000          N  
ATOM    402  NH2 ARG A  23      18.302   6.509 -16.194  1.00  3.000          N  
ATOM    403  H   ARG A  23      13.447  10.143 -18.912  1.00  2.340          H  
ATOM    404  HA  ARG A  23      11.122   8.244 -18.743  1.00  2.660          H  
ATOM    405 1HB  ARG A  23      12.710   6.458 -18.463  1.00  3.600          H  
ATOM    406 2HB  ARG A  23      13.221   7.434 -19.833  1.00  3.600          H  
ATOM    407 1HG  ARG A  23      14.921   8.476 -18.542  1.00  3.600          H  
ATOM    408 2HG  ARG A  23      14.417   7.668 -17.048  1.00  3.600          H  
ATOM    409 1HD  ARG A  23      14.941   5.509 -18.063  1.00  3.600          H  
ATOM    410 2HD  ARG A  23      15.479   6.354 -19.529  1.00  3.600          H  
ATOM    411  HE  ARG A  23      17.420   7.023 -18.455  1.00  3.600          H  
ATOM    412 1HH1 ARG A  23      15.284   5.563 -15.990  1.00  3.600          H  
ATOM    413 2HH1 ARG A  23      16.602   5.530 -14.805  1.00  3.600          H  
ATOM    414 1HH2 ARG A  23      18.976   6.926 -16.815  1.00  3.600          H  
ATOM    415 2HH2 ARG A  23      18.546   6.256 -15.214  1.00  3.600          H  
ATOM    416  N   LYS A  24      11.224   7.712 -16.235  1.00  2.090          N  
ATOM    417  CA  LYS A  24      11.169   7.620 -14.781  1.00  1.930          C  
ATOM    418  C   LYS A  24      10.798   6.228 -14.271  1.00  2.010          C  
ATOM    419  O   LYS A  24       9.917   5.570 -14.832  1.00  2.660          O  
ATOM    420  CB  LYS A  24      10.196   8.656 -14.203  1.00  2.770          C  
ATOM    421  CG  LYS A  24       8.761   8.675 -14.752  1.00  2.770          C  
ATOM    422  CD  LYS A  24       8.581   9.844 -15.748  1.00  2.770          C  
ATOM    423  CE  LYS A  24       7.104  10.135 -16.068  1.00  2.770          C  
ATOM    424  NZ  LYS A  24       6.462   9.032 -16.844  1.00  2.770          N  
ATOM    425  H   LYS A  24      10.673   7.074 -16.792  1.00  2.510          H  
ATOM    426  HA  LYS A  24      12.162   7.840 -14.391  1.00  2.320          H  
ATOM    427 1HB  LYS A  24      10.135   8.507 -13.129  1.00  3.320          H  
ATOM    428 2HB  LYS A  24      10.600   9.650 -14.375  1.00  3.320          H  
ATOM    429 1HG  LYS A  24       8.567   7.738 -15.270  1.00  3.320          H  
ATOM    430 2HG  LYS A  24       8.046   8.768 -13.939  1.00  3.320          H  
ATOM    431 1HD  LYS A  24       9.033  10.747 -15.342  1.00  3.320          H  
ATOM    432 2HD  LYS A  24       9.092   9.609 -16.685  1.00  3.320          H  
ATOM    433 1HE  LYS A  24       6.551  10.287 -15.137  1.00  3.320          H  
ATOM    434 2HE  LYS A  24       7.054  11.052 -16.657  1.00  3.320          H  
ATOM    435 1HZ  LYS A  24       5.500   9.273 -17.044  1.00  3.320          H  
ATOM    436 2HZ  LYS A  24       6.971   8.898 -17.708  1.00  3.320          H  
ATOM    437 3HZ  LYS A  24       6.488   8.179 -16.307  1.00  3.320          H  
ATOM    438  N   SER A  25      11.409   5.833 -13.149  1.00  1.580          N  
ATOM    439  CA  SER A  25      11.095   4.571 -12.472  1.00  1.710          C  
ATOM    440  C   SER A  25      11.416   4.616 -10.971  1.00  1.410          C  
ATOM    441  O   SER A  25      12.361   5.285 -10.539  1.00  1.500          O  
ATOM    442  CB  SER A  25      11.857   3.427 -13.099  1.00  2.340          C  
ATOM    443  OG  SER A  25      11.531   2.225 -12.470  1.00  2.340          O  
ATOM    444  H   SER A  25      12.180   6.408 -12.800  1.00  1.900          H  
ATOM    445  HA  SER A  25      10.027   4.377 -12.585  1.00  2.050          H  
ATOM    446 1HB  SER A  25      11.621   3.365 -14.160  1.00  2.810          H  
ATOM    447 2HB  SER A  25      12.928   3.613 -13.006  1.00  2.810          H  
ATOM    448  HG  SER A  25      12.106   1.560 -12.856  1.00  2.810          H  
ATOM    449  N   PHE A  26      10.585   3.949 -10.165  1.00  1.530          N  
ATOM    450  CA  PHE A  26      10.775   3.837  -8.707  1.00  1.410          C  
ATOM    451  C   PHE A  26      11.102   2.414  -8.328  1.00  1.130          C  
ATOM    452  O   PHE A  26      10.487   1.473  -8.839  1.00  1.500          O  
ATOM    453  CB  PHE A  26       9.547   4.304  -7.952  1.00  2.020          C  
ATOM    454  CG  PHE A  26       9.571   4.101  -6.481  1.00  2.020          C  
ATOM    455  CD1 PHE A  26      10.301   4.909  -5.652  1.00  2.020          C  
ATOM    456  CD2 PHE A  26       8.827   3.099  -5.917  1.00  2.020          C  
ATOM    457  CE1 PHE A  26      10.294   4.723  -4.311  1.00  2.020          C  
ATOM    458  CE2 PHE A  26       8.820   2.920  -4.581  1.00  2.020          C  
ATOM    459  CZ  PHE A  26       9.555   3.735  -3.774  1.00  2.020          C  
ATOM    460  H   PHE A  26       9.835   3.421 -10.598  1.00  1.840          H  
ATOM    461  HA  PHE A  26      11.619   4.455  -8.411  1.00  1.690          H  
ATOM    462 1HB  PHE A  26       9.414   5.364  -8.127  1.00  2.430          H  
ATOM    463 2HB  PHE A  26       8.693   3.776  -8.342  1.00  2.430          H  
ATOM    464  HD1 PHE A  26      10.889   5.698  -6.063  1.00  2.430          H  
ATOM    465  HD2 PHE A  26       8.230   2.443  -6.556  1.00  2.430          H  
ATOM    466  HE1 PHE A  26      10.876   5.382  -3.677  1.00  2.430          H  
ATOM    467  HE2 PHE A  26       8.221   2.136  -4.167  1.00  2.430          H  
ATOM    468  HZ  PHE A  26       9.548   3.602  -2.717  1.00  2.430          H  
ATOM    469  N   PHE A  27      12.053   2.243  -7.423  1.00  0.930          N  
ATOM    470  CA  PHE A  27      12.463   0.913  -7.060  1.00  0.910          C  
ATOM    471  C   PHE A  27      11.962   0.543  -5.670  1.00  0.840          C  
ATOM    472  O   PHE A  27      12.515   0.967  -4.650  1.00  1.230          O  
ATOM    473  CB  PHE A  27      13.980   0.876  -7.128  1.00  1.280          C  
ATOM    474  CG  PHE A  27      14.461   1.262  -8.465  1.00  1.280          C  
ATOM    475  CD1 PHE A  27      14.837   2.579  -8.658  1.00  1.280          C  
ATOM    476  CD2 PHE A  27      14.504   0.392  -9.532  1.00  1.280          C  
ATOM    477  CE1 PHE A  27      15.243   3.023  -9.870  1.00  1.280          C  
ATOM    478  CE2 PHE A  27      14.922   0.843 -10.770  1.00  1.280          C  
ATOM    479  CZ  PHE A  27      15.290   2.168 -10.935  1.00  1.280          C  
ATOM    480  H   PHE A  27      12.532   3.050  -7.006  1.00  1.120          H  
ATOM    481  HA  PHE A  27      12.051   0.208  -7.782  1.00  1.090          H  
ATOM    482 1HB  PHE A  27      14.377   1.590  -6.431  1.00  1.540          H  
ATOM    483 2HB  PHE A  27      14.358  -0.109  -6.880  1.00  1.540          H  
ATOM    484  HD1 PHE A  27      14.799   3.272  -7.811  1.00  1.540          H  
ATOM    485  HD2 PHE A  27      14.200  -0.646  -9.400  1.00  1.540          H  
ATOM    486  HE1 PHE A  27      15.522   4.051  -9.980  1.00  1.540          H  
ATOM    487  HE2 PHE A  27      14.956   0.158 -11.618  1.00  1.540          H  
ATOM    488  HZ  PHE A  27      15.616   2.531 -11.910  1.00  1.540          H  
ATOM    489  N   LYS A  28      10.952  -0.325  -5.618  1.00  1.040          N  
ATOM    490  CA  LYS A  28      10.337  -0.708  -4.345  1.00  1.320          C  
ATOM    491  C   LYS A  28      11.324  -1.269  -3.328  1.00  1.200          C  
ATOM    492  O   LYS A  28      11.193  -1.036  -2.133  1.00  1.520          O  
ATOM    493  CB  LYS A  28       9.182  -1.693  -4.550  1.00  1.740          C  
ATOM    494  CG  LYS A  28       8.504  -2.091  -3.232  1.00  1.740          C  
ATOM    495  CD  LYS A  28       7.196  -2.850  -3.410  1.00  1.740          C  
ATOM    496  CE  LYS A  28       6.551  -3.128  -2.032  1.00  1.740          C  
ATOM    497  NZ  LYS A  28       5.207  -3.784  -2.141  1.00  1.740          N  
ATOM    498  H   LYS A  28      10.559  -0.665  -6.490  1.00  1.250          H  
ATOM    499  HA  LYS A  28       9.913   0.192  -3.911  1.00  1.580          H  
ATOM    500 1HB  LYS A  28       8.429  -1.247  -5.202  1.00  2.080          H  
ATOM    501 2HB  LYS A  28       9.549  -2.601  -5.030  1.00  2.080          H  
ATOM    502 1HG  LYS A  28       9.182  -2.739  -2.676  1.00  2.080          H  
ATOM    503 2HG  LYS A  28       8.342  -1.237  -2.645  1.00  2.080          H  
ATOM    504 1HD  LYS A  28       6.505  -2.257  -4.009  1.00  2.080          H  
ATOM    505 2HD  LYS A  28       7.381  -3.795  -3.918  1.00  2.080          H  
ATOM    506 1HE  LYS A  28       7.212  -3.769  -1.453  1.00  2.080          H  
ATOM    507 2HE  LYS A  28       6.430  -2.186  -1.504  1.00  2.080          H  
ATOM    508 1HZ  LYS A  28       4.821  -3.928  -1.204  1.00  2.080          H  
ATOM    509 2HZ  LYS A  28       4.572  -3.182  -2.666  1.00  2.080          H  
ATOM    510 3HZ  LYS A  28       5.288  -4.666  -2.608  1.00  2.080          H  
ATOM    511  N   LEU A  29      12.330  -1.997  -3.785  1.00  1.150          N  
ATOM    512  CA  LEU A  29      13.269  -2.606  -2.857  1.00  1.590          C  
ATOM    513  C   LEU A  29      14.394  -1.657  -2.439  1.00  1.730          C  
ATOM    514  O   LEU A  29      15.295  -2.054  -1.695  1.00  2.130          O  
ATOM    515  CB  LEU A  29      13.874  -3.864  -3.491  1.00  2.050          C  
ATOM    516  CG  LEU A  29      12.877  -5.020  -3.843  1.00  2.050          C  
ATOM    517  CD1 LEU A  29      13.646  -6.121  -4.562  1.00  2.050          C  
ATOM    518  CD2 LEU A  29      12.205  -5.568  -2.577  1.00  2.050          C  
ATOM    519  H   LEU A  29      12.426  -2.162  -4.777  1.00  1.380          H  
ATOM    520  HA  LEU A  29      12.730  -2.874  -1.953  1.00  1.910          H  
ATOM    521 1HB  LEU A  29      14.382  -3.571  -4.407  1.00  2.460          H  
ATOM    522 2HB  LEU A  29      14.619  -4.268  -2.805  1.00  2.460          H  
ATOM    523  HG  LEU A  29      12.111  -4.646  -4.518  1.00  2.460          H  
ATOM    524 1HD1 LEU A  29      12.962  -6.926  -4.832  1.00  2.460          H  
ATOM    525 2HD1 LEU A  29      14.102  -5.718  -5.467  1.00  2.460          H  
ATOM    526 3HD1 LEU A  29      14.424  -6.511  -3.907  1.00  2.460          H  
ATOM    527 1HD2 LEU A  29      11.524  -6.374  -2.853  1.00  2.460          H  
ATOM    528 2HD2 LEU A  29      12.964  -5.955  -1.896  1.00  2.460          H  
ATOM    529 3HD2 LEU A  29      11.637  -4.788  -2.078  1.00  2.460          H  
ATOM    530  N   GLN A  30      14.378  -0.424  -2.950  1.00  1.520          N  
ATOM    531  CA  GLN A  30      15.397   0.563  -2.615  1.00  1.750          C  
ATOM    532  C   GLN A  30      14.790   1.746  -1.838  1.00  1.690          C  
ATOM    533  O   GLN A  30      15.399   2.260  -0.902  1.00  1.940          O  
ATOM    534  CB  GLN A  30      16.060   1.099  -3.885  1.00  2.360          C  
ATOM    535  CG  GLN A  30      16.810   0.057  -4.726  1.00  2.360          C  
ATOM    536  CD  GLN A  30      17.392   0.658  -6.023  1.00  2.360          C  
ATOM    537  OE1 GLN A  30      17.618   1.869  -6.108  1.00  2.360          O  
ATOM    538  NE2 GLN A  30      17.626  -0.188  -7.021  1.00  2.360          N  
ATOM    539  H   GLN A  30      13.601  -0.149  -3.547  1.00  1.820          H  
ATOM    540  HA  GLN A  30      16.149   0.094  -1.984  1.00  2.100          H  
ATOM    541 1HB  GLN A  30      15.317   1.578  -4.489  1.00  2.830          H  
ATOM    542 2HB  GLN A  30      16.778   1.868  -3.608  1.00  2.830          H  
ATOM    543 1HG  GLN A  30      17.627  -0.350  -4.134  1.00  2.830          H  
ATOM    544 2HG  GLN A  30      16.117  -0.737  -4.998  1.00  2.830          H  
ATOM    545 1HE2 GLN A  30      17.998   0.152  -7.888  1.00  2.830          H  
ATOM    546 2HE2 GLN A  30      17.428  -1.162  -6.913  1.00  2.830          H  
ATOM    547  N   GLY A  31      13.582   2.183  -2.242  1.00  1.450          N  
ATOM    548  CA  GLY A  31      12.903   3.345  -1.656  1.00  1.530          C  
ATOM    549  C   GLY A  31      13.246   4.631  -2.416  1.00  1.410          C  
ATOM    550  O   GLY A  31      12.699   5.704  -2.147  1.00  1.520          O  
ATOM    551  H   GLY A  31      13.120   1.726  -3.029  1.00  1.740          H  
ATOM    552 1HA  GLY A  31      11.829   3.182  -1.684  1.00  1.840          H  
ATOM    553 2HA  GLY A  31      13.187   3.446  -0.610  1.00  1.840          H  
ATOM    554  N   SER A  32      14.180   4.500  -3.347  1.00  1.280          N  
ATOM    555  CA  SER A  32      14.706   5.532  -4.218  1.00  1.280          C  
ATOM    556  C   SER A  32      14.087   5.447  -5.602  1.00  1.050          C  
ATOM    557  O   SER A  32      13.361   4.494  -5.924  1.00  0.960          O  
ATOM    558  CB  SER A  32      16.202   5.374  -4.354  1.00  1.790          C  
ATOM    559  OG  SER A  32      16.487   4.238  -5.113  1.00  1.790          O  
ATOM    560  H   SER A  32      14.560   3.576  -3.481  1.00  1.540          H  
ATOM    561  HA  SER A  32      14.475   6.510  -3.789  1.00  1.540          H  
ATOM    562 1HB  SER A  32      16.630   6.254  -4.832  1.00  2.150          H  
ATOM    563 2HB  SER A  32      16.651   5.278  -3.367  1.00  2.150          H  
ATOM    564  HG  SER A  32      17.451   4.168  -5.159  1.00  2.150          H  
ATOM    565  N   PHE A  33      14.426   6.423  -6.440  1.00  1.110          N  
ATOM    566  CA  PHE A  33      13.962   6.490  -7.817  1.00  1.020          C  
ATOM    567  C   PHE A  33      15.042   7.016  -8.744  1.00  1.010          C  
ATOM    568  O   PHE A  33      16.058   7.570  -8.317  1.00  1.240          O  
ATOM    569  CB  PHE A  33      12.722   7.382  -7.969  1.00  1.460          C  
ATOM    570  CG  PHE A  33      12.928   8.807  -7.593  1.00  1.460          C  
ATOM    571  CD1 PHE A  33      13.451   9.719  -8.503  1.00  1.460          C  
ATOM    572  CD2 PHE A  33      12.552   9.257  -6.341  1.00  1.460          C  
ATOM    573  CE1 PHE A  33      13.615  11.040  -8.166  1.00  1.460          C  
ATOM    574  CE2 PHE A  33      12.705  10.579  -6.001  1.00  1.460          C  
ATOM    575  CZ  PHE A  33      13.240  11.473  -6.914  1.00  1.460          C  
ATOM    576  H   PHE A  33      15.029   7.164  -6.103  1.00  1.330          H  
ATOM    577  HA  PHE A  33      13.705   5.485  -8.149  1.00  1.220          H  
ATOM    578 1HB  PHE A  33      12.390   7.359  -9.008  1.00  1.760          H  
ATOM    579 2HB  PHE A  33      11.923   6.997  -7.383  1.00  1.760          H  
ATOM    580  HD1 PHE A  33      13.740   9.382  -9.487  1.00  1.760          H  
ATOM    581  HD2 PHE A  33      12.129   8.551  -5.622  1.00  1.760          H  
ATOM    582  HE1 PHE A  33      14.033  11.739  -8.890  1.00  1.760          H  
ATOM    583  HE2 PHE A  33      12.407  10.928  -5.010  1.00  1.760          H  
ATOM    584  HZ  PHE A  33      13.363  12.521  -6.643  1.00  1.760          H  
ATOM    585  N   ASP A  34      14.795   6.857 -10.035  1.00  0.950          N  
ATOM    586  CA  ASP A  34      15.722   7.271 -11.069  1.00  1.090          C  
ATOM    587  C   ASP A  34      15.004   7.886 -12.262  1.00  0.940          C  
ATOM    588  O   ASP A  34      14.050   7.311 -12.808  1.00  0.970          O  
ATOM    589  CB  ASP A  34      16.564   6.070 -11.522  1.00  1.470          C  
ATOM    590  CG  ASP A  34      17.667   6.425 -12.483  1.00  1.470          C  
ATOM    591  OD1 ASP A  34      18.252   7.456 -12.305  1.00  1.470          O  
ATOM    592  OD2 ASP A  34      17.938   5.644 -13.385  1.00  1.470          O  
ATOM    593  H   ASP A  34      13.931   6.383 -10.307  1.00  1.140          H  
ATOM    594  HA  ASP A  34      16.390   8.026 -10.653  1.00  1.310          H  
ATOM    595 1HB  ASP A  34      17.020   5.608 -10.649  1.00  1.760          H  
ATOM    596 2HB  ASP A  34      15.915   5.332 -11.993  1.00  1.760          H  
ATOM    597  N   VAL A  35      15.389   9.118 -12.588  1.00  1.010          N  
ATOM    598  CA  VAL A  35      14.801   9.832 -13.713  1.00  1.000          C  
ATOM    599  C   VAL A  35      15.921  10.330 -14.601  1.00  1.180          C  
ATOM    600  O   VAL A  35      17.044  10.520 -14.132  1.00  1.650          O  
ATOM    601  CB  VAL A  35      13.942  11.037 -13.245  1.00  1.400          C  
ATOM    602  CG1 VAL A  35      12.834  10.572 -12.379  1.00  1.400          C  
ATOM    603  CG2 VAL A  35      14.785  12.049 -12.474  1.00  1.400          C  
ATOM    604  H   VAL A  35      16.175   9.521 -12.087  1.00  1.210          H  
ATOM    605  HA  VAL A  35      14.183   9.149 -14.289  1.00  1.200          H  
ATOM    606  HB  VAL A  35      13.495  11.511 -14.127  1.00  1.680          H  
ATOM    607 1HG1 VAL A  35      12.226  11.423 -12.090  1.00  1.680          H  
ATOM    608 2HG1 VAL A  35      12.248   9.876 -12.911  1.00  1.680          H  
ATOM    609 3HG1 VAL A  35      13.229  10.098 -11.503  1.00  1.680          H  
ATOM    610 1HG2 VAL A  35      14.152  12.878 -12.165  1.00  1.680          H  
ATOM    611 2HG2 VAL A  35      15.210  11.570 -11.594  1.00  1.680          H  
ATOM    612 3HG2 VAL A  35      15.588  12.431 -13.103  1.00  1.680          H  
ATOM    613  N   SER A  36      15.608  10.627 -15.854  1.00  1.180          N  
ATOM    614  CA  SER A  36      16.655  11.158 -16.724  1.00  1.700          C  
ATOM    615  C   SER A  36      16.162  12.083 -17.812  1.00  1.750          C  
ATOM    616  O   SER A  36      15.269  11.753 -18.609  1.00  1.880          O  
ATOM    617  CB  SER A  36      17.461  10.041 -17.330  1.00  2.170          C  
ATOM    618  OG  SER A  36      18.440  10.536 -18.188  1.00  2.170          O  
ATOM    619  H   SER A  36      14.648  10.451 -16.168  1.00  1.420          H  
ATOM    620  HA  SER A  36      17.336  11.741 -16.100  1.00  2.040          H  
ATOM    621 1HB  SER A  36      17.927   9.458 -16.537  1.00  2.610          H  
ATOM    622 2HB  SER A  36      16.818   9.393 -17.871  1.00  2.610          H  
ATOM    623  HG  SER A  36      18.963   9.775 -18.438  1.00  2.610          H  
ATOM    624  N   VAL A  37      16.789  13.261 -17.824  1.00  2.120          N  
ATOM    625  CA  VAL A  37      16.500  14.362 -18.727  1.00  2.380          C  
ATOM    626  C   VAL A  37      17.789  14.880 -19.351  1.00  2.740          C  
ATOM    627  O   VAL A  37      17.764  15.592 -20.357  1.00  3.030          O  
ATOM    628  OXT VAL A  37      18.851  14.693 -18.763  1.00  3.570          O  
ATOM    629  CB  VAL A  37      15.806  15.499 -17.922  1.00  3.060          C  
ATOM    630  CG1 VAL A  37      16.720  15.989 -16.825  1.00  3.060          C  
ATOM    631  CG2 VAL A  37      15.377  16.645 -18.843  1.00  3.060          C  
ATOM    632  H   VAL A  37      17.531  13.379 -17.150  1.00  2.540          H  
ATOM    633  HA  VAL A  37      15.859  14.008 -19.528  1.00  2.860          H  
ATOM    634  HB  VAL A  37      14.939  15.089 -17.426  1.00  3.670          H  
ATOM    635 1HG1 VAL A  37      16.215  16.759 -16.250  1.00  3.670          H  
ATOM    636 2HG1 VAL A  37      16.984  15.165 -16.170  1.00  3.670          H  
ATOM    637 3HG1 VAL A  37      17.627  16.410 -17.264  1.00  3.670          H  
ATOM    638 1HG2 VAL A  37      14.878  17.409 -18.255  1.00  3.670          H  
ATOM    639 2HG2 VAL A  37      16.246  17.081 -19.325  1.00  3.670          H  
ATOM    640 3HG2 VAL A  37      14.694  16.271 -19.595  1.00  3.670          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 -184.309 19.3377 131.434 -16.8047 3.42611 11.072 70.2593 -74.2463 -0.35418 -2.34324 -66.5471 -11.2539 -20.9875 -6.54576 -0.86316 -3.39071 0 0.36745 2.85237 23.5535 38.8719 -8.18725 1.85531 -3.16841 2.98374 18.7081 -74.2795
ASP:NtermProteinFull_1 -3.28209 0.27299 5.78662 -0.20058 0.07141 0.62878 3.43475 -2.37753 -0 -0 -6.66525 -0.83709 0 0 -0.43158 0 0 -0.04113 0.01874 0 2.26639 0 0 -2.3716 0 0.12323 -3.60393
TRP_2 -6.40929 0.62087 2.33522 -1.45814 0.18534 0.78597 1.89527 -1.98165 -0 -0 -1.71427 -0.19334 0 0 0 0 0 0.08581 0.03512 0 1.97738 -0.04152 0 1.6906 -0.11576 0.37151 -1.93087
PHE_3 -8.46398 1.09715 4.36986 -0.61926 0.06269 0.31216 2.7766 -2.68592 -0 -0 -2.30888 0.1435 0 0 -0.43158 0 0 0.02712 0.02676 0 2.75694 0.05553 0 1.0402 -0.22726 0.42409 -1.64428
LYS_4 -4.37459 0.23364 6.55346 -0.81266 0.09679 0.78532 2.91131 -2.78824 -0 -0 -3.58018 0.16533 0 0 0 -0.70424 0 -0.01502 0.3188 2.86749 0 -0.02964 0 -1.5107 -0.09088 0.37039 0.39639
ALA_5 -4.18907 0.15726 4.44282 -0.02199 0 0 2.18559 -2.34292 -0 -0 -1.83761 -0.37241 0 0 0 0 0 -0.01597 0 0 0 -0.2835 0 1.8394 -0.21489 0.25782 -0.39547
PHE_6 -8.67738 0.87722 4.08334 -1.01174 0.12303 0.38498 2.79661 -2.85733 -0.012 -0.06033 -3.13434 0.04831 0 0 0 0 0 -0.00043 0.00409 0 1.76675 -0.41443 0 1.0402 -0.18703 0.3361 -4.89439
TYR_7 -7.66491 0.98384 5.16435 -1.05297 0.09934 0.46905 2.91604 -3.22783 -0.00909 -0.05979 -2.22506 -0.30316 0 0 0 0 0 0.00497 0.07649 0 2.00095 -0.42086 0.01277 1.2797 0.09256 0.69118 -1.17244
ASP_8 -4.82158 0.15262 6.73714 -0.10811 0.0132 0.33034 3.00374 -3.05368 -0.00132 -0.02635 -4.61789 -0.30261 0 0 0 -0.70424 0 -0.02902 0.00932 0 1.71137 0.2049 0 -2.3716 -0.07788 0.55773 -3.39392
LYS_9 -4.63353 0.25515 5.42857 -0.30496 0.02914 0.137 2.54016 -2.51886 -0 -0 -2.25733 -0.00945 0 0 0 0 0 -0.03366 0.01583 1.84106 0 -0.0463 0 -1.5107 -0.21158 0.26335 -1.01612
VAL_10 -7.6898 0.95693 3.29688 -0.35117 0.14499 0.08187 2.97123 -2.7773 -0 -0 -2.59603 -0.01226 0 0 0 0 0 -0.03505 0.2756 0.95807 0 -0.13162 0 1.9342 -0.16026 0.42995 -2.70377
ALA_11 -5.72959 0.59252 4.06679 -0.02239 0 0 2.7144 -2.75591 -0.012 -0.06033 -2.7364 -0.35521 0 0 0 0 0 0.05446 0 0 0 -0.2841 0 1.8394 -0.31703 0.54486 -2.46052
GLU_12 -4.3506 0.22176 5.78006 -0.56656 0.09644 1.02274 2.37739 -2.55348 -0.02645 -0.22079 -1.82994 -0.74388 0 0 0 0 0 0.09949 0.125 0 3.41279 -0.26394 0 -2.7348 -0.47526 0.38702 -0.24302
LYS_13 -4.81222 0.27623 5.26605 -0.29833 0.02496 0.13009 2.81288 -2.56195 -0.00231 -0.04069 -2.35411 -0.02159 0 0 0 0 0 0.04035 0.00312 1.73493 0 -0.01062 0 -1.5107 -0.45592 0.27173 -1.5081
PHE_14 -10.185 1.49627 3.33767 -0.54107 0.18885 0.23922 2.99377 -2.97765 -0.00482 -0.02063 -1.97274 -0.20085 0 0 0 0 0 -0.00819 0.07755 0 3.00154 -0.00203 0 1.0402 -0.32795 0.48364 -3.38223
LYS_15 -3.93412 0.17729 5.06439 -0.40738 0.0459 0.21993 1.7877 -2.19954 -0.02167 -0.13704 -1.16521 -0.1526 0 0 0 0 0 0.11457 0.01484 1.96821 0 -0.00338 0 -1.5107 -0.24327 0.50927 0.12718
GLU_16 -2.77451 0.13066 3.56797 -0.21172 0.02297 0.28811 1.23992 -1.65435 -0.00578 -0.09809 -0.14816 -0.57097 0 0 0 0 0 -0.04061 0.0424 0 3.15847 -0.19379 0 -2.7348 -0.19597 0.3104 0.13213
ALA_17 -2.86369 0.12497 1.81769 -0.02373 0 0 1.38219 -1.34992 -0 -0 -1.10984 -0.32488 0 0 0 0 0 0.0224 0 0 0 -0.2215 0 1.8394 -0.30301 0.37852 -0.63141
PHE_18 -6.41708 1.28238 1.22036 -0.57344 0.0283 0.26925 1.55297 -1.55667 -0.00482 -0.02063 -0.61589 0.23018 0 0 0 0 0 0.00761 0.03599 0 2.05076 -0.3754 0 1.0402 -0.21346 1.08359 -0.9758
PRO_19 -3.4717 0.46899 2.36062 -0.19289 0.00518 0.14013 1.32133 -1.06473 -0 -0 -1.13059 -0.01635 0 0 0 0 0 0.02588 0.00299 0.4701 0 -0.8382 0 -2.4119 -0.18472 1.2414 -3.27445
TRP_20 -1.3096 0.14101 1.45771 -0.96929 0.05133 0.34702 0.46119 -0.68005 -0 -0 0.55934 -0.41984 0 0 0 0 0 0.18253 0.00985 0 1.65905 -0.25648 0 1.6906 3.99871 0.85573 7.7788
LYS_21 -3.311 0.21968 3.37056 -0.44956 0.09952 0.25445 1.03323 -1.42829 -0.01833 -0.11962 -1.11662 0.17939 0 0 0 0 0 0.18954 0.05741 1.40646 0 -0.0261 0 -1.5107 3.95649 0.83079 3.61731
VAL_22 -7.00809 1.62594 1.88662 -0.28857 0.29126 0.05931 1.92814 -1.92228 -0.02201 -0.11674 -1.46121 0.18851 0 0 0 0 0 0.01594 0.00019 0.09597 0 -0.31577 0 1.9342 -0.53621 1.00157 -2.64323
ARG_23 -5.12092 0.35031 5.84481 -0.83201 0.2207 0.63255 2.82161 -2.58961 -0.01745 -0.15718 -3.24334 0.36263 0 0 0 -0.99111 0 0.03569 0.02569 2.82991 0 -0.09605 0 -1.2888 -0.3177 0.95101 -0.57925
LYS_24 -4.78395 0.44923 2.3382 -0.66605 0.16577 0.81202 0.45752 -1.07453 -0.03111 -0.17653 -0.38232 -0.18224 0 0 0 0 0 -6e-05 0.6526 4.62934 0 -0.07461 0 -1.5107 0.14387 0.58125 1.34772
SER_25 -3.15518 0.07313 3.02413 -0.02614 0 0.04279 2.10973 -1.54418 -0 -0 -2.12496 -1.04757 0 0 0 0 0 -0.02766 0.01625 0.72091 0 -0.35907 0.61578 -0.77834 0.18863 0.42042 -1.85132
PHE_26 -9.24687 1.47595 1.52715 -0.79375 0.04155 0.07174 0.88486 -2.14753 -0 -0 -0.23402 -0.49909 0 0 0 0 0 0.11497 0.07479 0 2.74308 -0.15028 0 1.0402 -0.11794 0.37352 -4.84167
PHE_27 -7.49928 0.50391 5.09953 -0.73404 0.12674 0.46608 2.56367 -2.98468 -0.01936 -0.09516 -3.25548 0.19765 0 0 0 0 0 -0.06821 0.3935 0 2.33276 -0.27116 0 1.0402 0.05133 0.61423 -1.53776
LYS_28 -4.6672 0.66261 3.94108 -0.46395 0.10284 0.29819 1.74075 -1.80657 -0 -0 -2.0166 -0.25931 0 0 0 0 0 -0.08255 0.34751 2.25419 0 -0.08772 0 -1.5107 -0.05633 0.64208 -0.96167
LEU_29 -1.77427 0.15916 1.62449 -0.51513 0.23655 0.14995 0.04744 -0.76771 -0 -0 0.32004 0.11801 0 0 0 0 0 -0.06523 0.02914 0.07981 0 -0.11085 0 0.18072 -0.50483 0.38198 -0.41071
GLN_30 -4.22046 0.41259 3.61231 -0.24623 0.03177 0.1986 1.7952 -1.69101 -0 -0 -0.14601 -0.64597 0 0 0 0 0 -0.0227 0.04719 0 2.98747 -0.08268 0 -0.18838 0.10554 0.23003 2.17724
GLY_31 -2.49339 0.19153 2.01073 -6e-05 0 0 0.9554 -1.19025 -0.02033 -0.08722 -1.19667 -0.38748 0 0 0 0 0 -0.15768 0 0 0 -1.50463 0 0.83697 -0.09005 0.29728 -2.83586
SER_32 -3.7936 0.20921 3.87755 -0.02791 0 0.0652 1.98071 -1.9095 -0.03969 -0.18238 -1.4551 -0.77192 0 0 0 0 0 -0.01929 0.00989 0.33108 0 -0.27356 0.60071 -0.77834 -0.368 0.29761 -2.24734
PHE_33 -5.3168 0.6514 0.35738 -1.00173 0.18378 0.58586 0.50446 -1.00256 -0.01498 -0.11719 -0.123 -0.15925 0 0 0 0 0 0.06513 0.06104 0 1.85411 -0.56063 0 1.0402 0.04547 0.24143 -2.70589
ASP_34 -4.09341 0.28733 5.25248 -0.16359 0.00891 0.51602 2.67529 -2.43334 -0.01501 -0.11732 -4.03208 -0.97661 0 0 0 -0.99111 0 -0.02235 0.00605 0 3.19211 -0.12036 0 -2.3716 0.1735 0.30301 -2.92209
VAL_35 -4.94283 0.56844 0.85739 -0.32152 0.21061 0.07043 0.47523 -1.26177 -3e-05 -0.00013 -0.31563 -0.58651 0 0 0 0 0 -0.02103 0.00351 0.19809 0 -0.39603 0 1.9342 0.00151 0.40749 -3.11858
SER_36 -3.53375 0.40814 3.50833 -0.02987 6e-05 0.05541 1.78998 -1.6925 -0.0457 -0.35295 -1.012 -0.92232 0 0 0 0 0 -0.01315 4e-05 0.12533 0 -0.20085 0.62605 -0.77834 -0.00681 0.61305 -1.46188
VAL:CtermProteinFull_37 -3.29316 0.56933 1.16335 -0.49618 0.4162 0.22142 0.42107 -0.83446 -0.00992 -0.07615 -1.31169 -1.61269 0 0 0 0 0 0 0.0351 1.04257 0 0 0 1.9342 0.22613 0.62979 -0.97508
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691851 DOMAINID 682966 MODEL 4 pep1_AB
MODEL     4
REMARK    Rerank model03.pdb to model04.pdb score: 19.350
REMARK    CLUSTER 0003 t000_.out.valid.rescored.best_scoring.binary cluster_size: 10 cluster_threshold: 2.176304
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE          fa_sol:         125.211
REMARK    SCORE           score:         -63.785
REMARK    SCORE     cart_bonded:          19.960
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE        hbond_sc:          -2.655
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE         fa_elec:         -67.191
REMARK    SCORE     description: cluster0003_0001
REMARK    SCORE          fa_atr:        -193.371
REMARK    SCORE     hbond_bb_sc:          -3.143
REMARK    SCORE            time:           0.000
REMARK    SCORE    fa_intra_rep:           0.470
REMARK    SCORE     hbond_sr_bb:         -26.562
REMARK    SCORE          fa_dun:          50.116
REMARK    SCORE          fa_rep:          20.751
REMARK    SCORE     total_score:         -63.785
REMARK    SCORE             ref:           9.690
REMARK    SCORE     lk_ball_wtd:          -3.031
REMARK    SCORE         p_aa_pp:          -5.760
REMARK    SCORE     rama_prepro:           3.870
REMARK    SCORE fa_intra_sol_xover4:           8.494
REMARK    SCORE           omega:           0.267
REMARK    SCORE     hbond_lr_bb:          -0.900
ATOM      1  N   ASP A   1      -0.964   0.161   0.134  1.00  3.050          N  
ATOM      2  CA  ASP A   1       0.487   0.051   0.219  1.00  2.680          C  
ATOM      3  C   ASP A   1       1.117   1.442   0.180  1.00  2.390          C  
ATOM      4  O   ASP A   1       1.307   2.016  -0.902  1.00  2.090          O  
ATOM      5  CB  ASP A   1       1.019  -0.836  -0.921  1.00  3.900          C  
ATOM      6  CG  ASP A   1       2.524  -1.118  -0.854  1.00  3.900          C  
ATOM      7  OD1 ASP A   1       3.225  -0.411  -0.151  1.00  3.900          O  
ATOM      8  OD2 ASP A   1       2.961  -2.023  -1.508  1.00  3.900          O  
ATOM      9 1H   ASP A   1      -1.388  -0.546   0.719  1.00  3.660          H  
ATOM     10 2H   ASP A   1      -1.255   1.076   0.449  1.00  3.660          H  
ATOM     11 3H   ASP A   1      -1.259   0.025  -0.822  1.00  3.660          H  
ATOM     12  HA  ASP A   1       0.746  -0.417   1.170  1.00  3.220          H  
ATOM     13 1HB  ASP A   1       0.490  -1.791  -0.911  1.00  4.680          H  
ATOM     14 2HB  ASP A   1       0.803  -0.359  -1.879  1.00  4.680          H  
ATOM     15  N   TRP A   2       1.387   2.001   1.372  1.00  2.520          N  
ATOM     16  CA  TRP A   2       1.978   3.338   1.492  1.00  2.310          C  
ATOM     17  C   TRP A   2       3.332   3.406   0.841  1.00  2.040          C  
ATOM     18  O   TRP A   2       3.661   4.380   0.175  1.00  1.750          O  
ATOM     19  CB  TRP A   2       2.140   3.782   2.948  1.00  3.320          C  
ATOM     20  CG  TRP A   2       2.754   5.170   3.056  1.00  3.320          C  
ATOM     21  CD1 TRP A   2       2.071   6.345   3.028  1.00  3.320          C  
ATOM     22  CD2 TRP A   2       4.164   5.536   3.196  1.00  3.320          C  
ATOM     23  NE1 TRP A   2       2.937   7.401   3.133  1.00  3.320          N  
ATOM     24  CE2 TRP A   2       4.219   6.923   3.236  1.00  3.320          C  
ATOM     25  CE3 TRP A   2       5.351   4.811   3.285  1.00  3.320          C  
ATOM     26  CZ2 TRP A   2       5.417   7.603   3.358  1.00  3.320          C  
ATOM     27  CZ3 TRP A   2       6.547   5.488   3.397  1.00  3.320          C  
ATOM     28  CH2 TRP A   2       6.582   6.844   3.433  1.00  3.320          C  
ATOM     29  H   TRP A   2       1.196   1.480   2.218  1.00  3.020          H  
ATOM     30  HA  TRP A   2       1.324   4.048   0.988  1.00  2.770          H  
ATOM     31 1HB  TRP A   2       1.170   3.793   3.442  1.00  3.980          H  
ATOM     32 2HB  TRP A   2       2.779   3.082   3.481  1.00  3.980          H  
ATOM     33  HD1 TRP A   2       0.990   6.435   2.931  1.00  3.980          H  
ATOM     34  HE1 TRP A   2       2.675   8.375   3.133  1.00  3.980          H  
ATOM     35  HE3 TRP A   2       5.333   3.738   3.262  1.00  3.980          H  
ATOM     36  HZ2 TRP A   2       5.466   8.692   3.387  1.00  3.980          H  
ATOM     37  HZ3 TRP A   2       7.463   4.913   3.460  1.00  3.980          H  
ATOM     38  HH2 TRP A   2       7.544   7.349   3.522  1.00  3.980          H  
ATOM     39  N   PHE A   3       4.165   2.404   1.083  1.00  2.210          N  
ATOM     40  CA  PHE A   3       5.510   2.457   0.551  1.00  2.080          C  
ATOM     41  C   PHE A   3       5.506   2.457  -0.951  1.00  1.790          C  
ATOM     42  O   PHE A   3       6.199   3.259  -1.572  1.00  1.580          O  
ATOM     43  CB  PHE A   3       6.332   1.280   1.065  1.00  2.960          C  
ATOM     44  CG  PHE A   3       6.841   1.488   2.447  1.00  2.960          C  
ATOM     45  CD1 PHE A   3       6.119   1.083   3.559  1.00  2.960          C  
ATOM     46  CD2 PHE A   3       8.064   2.091   2.637  1.00  2.960          C  
ATOM     47  CE1 PHE A   3       6.614   1.301   4.828  1.00  2.960          C  
ATOM     48  CE2 PHE A   3       8.564   2.308   3.895  1.00  2.960          C  
ATOM     49  CZ  PHE A   3       7.837   1.917   4.995  1.00  2.960          C  
ATOM     50  H   PHE A   3       3.854   1.605   1.618  1.00  2.650          H  
ATOM     51  HA  PHE A   3       5.979   3.381   0.881  1.00  2.500          H  
ATOM     52 1HB  PHE A   3       5.717   0.376   1.050  1.00  3.560          H  
ATOM     53 2HB  PHE A   3       7.180   1.111   0.405  1.00  3.560          H  
ATOM     54  HD1 PHE A   3       5.154   0.597   3.429  1.00  3.560          H  
ATOM     55  HD2 PHE A   3       8.637   2.394   1.768  1.00  3.560          H  
ATOM     56  HE1 PHE A   3       6.040   0.986   5.699  1.00  3.560          H  
ATOM     57  HE2 PHE A   3       9.535   2.791   4.022  1.00  3.560          H  
ATOM     58  HZ  PHE A   3       8.229   2.089   5.996  1.00  3.560          H  
ATOM     59  N   LYS A   4       4.703   1.619  -1.579  1.00  1.850          N  
ATOM     60  CA  LYS A   4       4.770   1.674  -3.019  1.00  1.670          C  
ATOM     61  C   LYS A   4       4.258   3.022  -3.498  1.00  1.310          C  
ATOM     62  O   LYS A   4       4.942   3.715  -4.251  1.00  1.140          O  
ATOM     63  CB  LYS A   4       3.993   0.550  -3.694  1.00  2.410          C  
ATOM     64  CG  LYS A   4       4.158   0.562  -5.227  1.00  2.410          C  
ATOM     65  CD  LYS A   4       3.432  -0.596  -5.904  1.00  2.410          C  
ATOM     66  CE  LYS A   4       3.798  -0.705  -7.411  1.00  2.410          C  
ATOM     67  NZ  LYS A   4       3.291   0.448  -8.250  1.00  2.410          N  
ATOM     68  H   LYS A   4       4.112   0.945  -1.066  1.00  2.220          H  
ATOM     69  HA  LYS A   4       5.812   1.588  -3.322  1.00  2.000          H  
ATOM     70 1HB  LYS A   4       4.331  -0.413  -3.308  1.00  2.890          H  
ATOM     71 2HB  LYS A   4       2.934   0.645  -3.456  1.00  2.890          H  
ATOM     72 1HG  LYS A   4       3.773   1.503  -5.629  1.00  2.890          H  
ATOM     73 2HG  LYS A   4       5.219   0.504  -5.472  1.00  2.890          H  
ATOM     74 1HD  LYS A   4       3.694  -1.531  -5.406  1.00  2.890          H  
ATOM     75 2HD  LYS A   4       2.356  -0.448  -5.813  1.00  2.890          H  
ATOM     76 1HE  LYS A   4       4.881  -0.755  -7.506  1.00  2.890          H  
ATOM     77 2HE  LYS A   4       3.368  -1.628  -7.798  1.00  2.890          H  
ATOM     78 1HZ  LYS A   4       3.558   0.299  -9.207  1.00  2.890          H  
ATOM     79 2HZ  LYS A   4       2.291   0.500  -8.190  1.00  2.890          H  
ATOM     80 3HZ  LYS A   4       3.684   1.363  -7.956  1.00  2.890          H  
ATOM     81  N   ALA A   5       3.066   3.427  -3.041  1.00  1.350          N  
ATOM     82  CA  ALA A   5       2.493   4.665  -3.546  1.00  1.190          C  
ATOM     83  C   ALA A   5       3.365   5.884  -3.278  1.00  0.860          C  
ATOM     84  O   ALA A   5       3.509   6.737  -4.159  1.00  0.670          O  
ATOM     85  CB  ALA A   5       1.136   4.882  -2.911  1.00  1.730          C  
ATOM     86  H   ALA A   5       2.533   2.854  -2.378  1.00  1.620          H  
ATOM     87  HA  ALA A   5       2.378   4.562  -4.622  1.00  1.430          H  
ATOM     88 1HB  ALA A   5       0.688   5.786  -3.309  1.00  2.080          H  
ATOM     89 2HB  ALA A   5       0.496   4.027  -3.126  1.00  2.080          H  
ATOM     90 3HB  ALA A   5       1.260   4.978  -1.830  1.00  2.080          H  
ATOM     91  N   PHE A   6       3.953   5.983  -2.088  1.00  0.960          N  
ATOM     92  CA  PHE A   6       4.788   7.115  -1.748  1.00  0.860          C  
ATOM     93  C   PHE A   6       5.995   7.200  -2.641  1.00  0.810          C  
ATOM     94  O   PHE A   6       6.278   8.257  -3.210  1.00  0.760          O  
ATOM     95  CB  PHE A   6       5.231   7.057  -0.300  1.00  1.240          C  
ATOM     96  CG  PHE A   6       6.159   8.168   0.077  1.00  1.240          C  
ATOM     97  CD1 PHE A   6       5.683   9.437   0.326  1.00  1.240          C  
ATOM     98  CD2 PHE A   6       7.508   7.943   0.192  1.00  1.240          C  
ATOM     99  CE1 PHE A   6       6.551  10.444   0.680  1.00  1.240          C  
ATOM    100  CE2 PHE A   6       8.368   8.924   0.542  1.00  1.240          C  
ATOM    101  CZ  PHE A   6       7.898  10.183   0.789  1.00  1.240          C  
ATOM    102  H   PHE A   6       3.808   5.266  -1.377  1.00  1.150          H  
ATOM    103  HA  PHE A   6       4.200   8.021  -1.890  1.00  1.030          H  
ATOM    104 1HB  PHE A   6       4.356   7.099   0.342  1.00  1.490          H  
ATOM    105 2HB  PHE A   6       5.725   6.104  -0.102  1.00  1.490          H  
ATOM    106  HD1 PHE A   6       4.615   9.636   0.241  1.00  1.490          H  
ATOM    107  HD2 PHE A   6       7.875   6.975   0.005  1.00  1.490          H  
ATOM    108  HE1 PHE A   6       6.172  11.448   0.875  1.00  1.490          H  
ATOM    109  HE2 PHE A   6       9.426   8.707   0.629  1.00  1.490          H  
ATOM    110  HZ  PHE A   6       8.585  10.978   1.071  1.00  1.490          H  
ATOM    111  N   TYR A   7       6.724   6.090  -2.756  1.00  1.050          N  
ATOM    112  CA  TYR A   7       7.932   6.065  -3.547  1.00  1.290          C  
ATOM    113  C   TYR A   7       7.623   6.342  -5.020  1.00  1.160          C  
ATOM    114  O   TYR A   7       8.362   7.095  -5.661  1.00  1.380          O  
ATOM    115  CB  TYR A   7       8.682   4.764  -3.289  1.00  1.710          C  
ATOM    116  CG  TYR A   7       9.457   4.797  -1.924  1.00  1.710          C  
ATOM    117  CD1 TYR A   7       8.780   4.683  -0.706  1.00  1.710          C  
ATOM    118  CD2 TYR A   7      10.843   4.920  -1.895  1.00  1.710          C  
ATOM    119  CE1 TYR A   7       9.444   4.711   0.484  1.00  1.710          C  
ATOM    120  CE2 TYR A   7      11.499   4.929  -0.672  1.00  1.710          C  
ATOM    121  CZ  TYR A   7      10.803   4.831   0.500  1.00  1.710          C  
ATOM    122  OH  TYR A   7      11.472   4.860   1.696  1.00  1.710          O  
ATOM    123  H   TYR A   7       6.431   5.230  -2.282  1.00  1.260          H  
ATOM    124  HA  TYR A   7       8.582   6.850  -3.184  1.00  1.550          H  
ATOM    125 1HB  TYR A   7       7.982   3.929  -3.276  1.00  2.050          H  
ATOM    126 2HB  TYR A   7       9.395   4.589  -4.091  1.00  2.050          H  
ATOM    127  HD1 TYR A   7       7.724   4.598  -0.677  1.00  2.050          H  
ATOM    128  HD2 TYR A   7      11.419   5.007  -2.820  1.00  2.050          H  
ATOM    129  HE1 TYR A   7       8.886   4.643   1.414  1.00  2.050          H  
ATOM    130  HE2 TYR A   7      12.574   5.025  -0.636  1.00  2.050          H  
ATOM    131  HH  TYR A   7      12.407   4.995   1.525  1.00  2.050          H  
ATOM    132  N   ASP A   8       6.520   5.788  -5.565  1.00  0.950          N  
ATOM    133  CA  ASP A   8       6.186   6.073  -6.960  1.00  1.030          C  
ATOM    134  C   ASP A   8       5.870   7.557  -7.171  1.00  1.030          C  
ATOM    135  O   ASP A   8       6.330   8.164  -8.146  1.00  1.360          O  
ATOM    136  CB  ASP A   8       4.945   5.291  -7.431  1.00  1.410          C  
ATOM    137  CG  ASP A   8       5.102   3.763  -7.671  1.00  1.410          C  
ATOM    138  OD1 ASP A   8       6.191   3.254  -7.692  1.00  1.410          O  
ATOM    139  OD2 ASP A   8       4.072   3.127  -7.882  1.00  1.410          O  
ATOM    140  H   ASP A   8       5.935   5.139  -5.026  1.00  1.140          H  
ATOM    141  HA  ASP A   8       7.038   5.806  -7.583  1.00  1.240          H  
ATOM    142 1HB  ASP A   8       4.159   5.422  -6.679  1.00  1.690          H  
ATOM    143 2HB  ASP A   8       4.576   5.742  -8.350  1.00  1.690          H  
ATOM    144  N   LYS A   9       5.111   8.160  -6.247  1.00  0.780          N  
ATOM    145  CA  LYS A   9       4.753   9.565  -6.385  1.00  0.910          C  
ATOM    146  C   LYS A   9       5.960  10.483  -6.300  1.00  1.080          C  
ATOM    147  O   LYS A   9       6.086  11.421  -7.104  1.00  1.380          O  
ATOM    148  CB  LYS A   9       3.711   9.956  -5.340  1.00  1.220          C  
ATOM    149  CG  LYS A   9       2.318   9.369  -5.601  1.00  1.220          C  
ATOM    150  CD  LYS A   9       1.335   9.741  -4.501  1.00  1.220          C  
ATOM    151  CE  LYS A   9      -0.043   9.138  -4.757  1.00  1.220          C  
ATOM    152  NZ  LYS A   9      -1.015   9.484  -3.675  1.00  1.220          N  
ATOM    153  H   LYS A   9       4.731   7.611  -5.468  1.00  0.940          H  
ATOM    154  HA  LYS A   9       4.309   9.702  -7.370  1.00  1.090          H  
ATOM    155 1HB  LYS A   9       4.044   9.606  -4.357  1.00  1.470          H  
ATOM    156 2HB  LYS A   9       3.629  11.040  -5.294  1.00  1.470          H  
ATOM    157 1HG  LYS A   9       1.947   9.757  -6.549  1.00  1.470          H  
ATOM    158 2HG  LYS A   9       2.383   8.289  -5.683  1.00  1.470          H  
ATOM    159 1HD  LYS A   9       1.710   9.364  -3.546  1.00  1.470          H  
ATOM    160 2HD  LYS A   9       1.245  10.823  -4.438  1.00  1.470          H  
ATOM    161 1HE  LYS A   9      -0.424   9.509  -5.707  1.00  1.470          H  
ATOM    162 2HE  LYS A   9       0.050   8.052  -4.813  1.00  1.470          H  
ATOM    163 1HZ  LYS A   9      -1.913   9.066  -3.880  1.00  1.470          H  
ATOM    164 2HZ  LYS A   9      -0.676   9.133  -2.791  1.00  1.470          H  
ATOM    165 3HZ  LYS A   9      -1.119  10.488  -3.620  1.00  1.470          H  
ATOM    166  N   VAL A  10       6.875  10.213  -5.364  1.00  1.070          N  
ATOM    167  CA  VAL A  10       8.026  11.085  -5.287  1.00  1.380          C  
ATOM    168  C   VAL A  10       8.923  10.835  -6.487  1.00  1.410          C  
ATOM    169  O   VAL A  10       9.471  11.777  -7.035  1.00  1.420          O  
ATOM    170  CB  VAL A  10       8.796  10.986  -3.949  1.00  1.810          C  
ATOM    171  CG1 VAL A  10       7.877  11.325  -2.801  1.00  1.810          C  
ATOM    172  CG2 VAL A  10       9.390   9.635  -3.743  1.00  1.810          C  
ATOM    173  H   VAL A  10       6.732   9.438  -4.706  1.00  1.280          H  
ATOM    174  HA  VAL A  10       7.671  12.112  -5.349  1.00  1.660          H  
ATOM    175  HB  VAL A  10       9.564  11.716  -3.955  1.00  2.170          H  
ATOM    176 1HG1 VAL A  10       8.440  11.294  -1.871  1.00  2.170          H  
ATOM    177 2HG1 VAL A  10       7.470  12.323  -2.948  1.00  2.170          H  
ATOM    178 3HG1 VAL A  10       7.062  10.606  -2.752  1.00  2.170          H  
ATOM    179 1HG2 VAL A  10       9.904   9.626  -2.799  1.00  2.170          H  
ATOM    180 2HG2 VAL A  10       8.601   8.933  -3.727  1.00  2.170          H  
ATOM    181 3HG2 VAL A  10      10.084   9.386  -4.532  1.00  2.170          H  
ATOM    182  N   ALA A  11       9.011   9.591  -6.980  1.00  1.490          N  
ATOM    183  CA  ALA A  11       9.847   9.355  -8.144  1.00  1.550          C  
ATOM    184  C   ALA A  11       9.403  10.218  -9.310  1.00  1.470          C  
ATOM    185  O   ALA A  11      10.258  10.761 -10.014  1.00  1.460          O  
ATOM    186  CB  ALA A  11       9.789   7.893  -8.550  1.00  2.150          C  
ATOM    187  H   ALA A  11       8.558   8.799  -6.517  1.00  1.790          H  
ATOM    188  HA  ALA A  11      10.867   9.625  -7.892  1.00  1.860          H  
ATOM    189 1HB  ALA A  11      10.434   7.727  -9.411  1.00  2.580          H  
ATOM    190 2HB  ALA A  11      10.112   7.265  -7.728  1.00  2.580          H  
ATOM    191 3HB  ALA A  11       8.763   7.636  -8.809  1.00  2.580          H  
ATOM    192  N   GLU A  12       8.095  10.394  -9.515  1.00  1.470          N  
ATOM    193  CA  GLU A  12       7.681  11.240 -10.628  1.00  1.480          C  
ATOM    194  C   GLU A  12       8.060  12.704 -10.392  1.00  1.380          C  
ATOM    195  O   GLU A  12       8.586  13.378 -11.293  1.00  1.470          O  
ATOM    196  CB  GLU A  12       6.169  11.132 -10.848  1.00  2.070          C  
ATOM    197  CG  GLU A  12       5.691   9.786 -11.390  1.00  2.070          C  
ATOM    198  CD  GLU A  12       6.242   9.495 -12.756  1.00  2.070          C  
ATOM    199  OE1 GLU A  12       6.222  10.371 -13.579  1.00  2.070          O  
ATOM    200  OE2 GLU A  12       6.706   8.398 -12.982  1.00  2.070          O  
ATOM    201  H   GLU A  12       7.413   9.873  -8.947  1.00  1.760          H  
ATOM    202  HA  GLU A  12       8.189  10.899 -11.527  1.00  1.780          H  
ATOM    203 1HB  GLU A  12       5.658  11.302  -9.897  1.00  2.480          H  
ATOM    204 2HB  GLU A  12       5.846  11.911 -11.536  1.00  2.480          H  
ATOM    205 1HG  GLU A  12       6.008   8.999 -10.706  1.00  2.480          H  
ATOM    206 2HG  GLU A  12       4.604   9.783 -11.428  1.00  2.480          H  
ATOM    207  N   LYS A  13       7.875  13.176  -9.151  1.00  1.270          N  
ATOM    208  CA  LYS A  13       8.205  14.557  -8.812  1.00  1.240          C  
ATOM    209  C   LYS A  13       9.693  14.818  -8.970  1.00  1.120          C  
ATOM    210  O   LYS A  13      10.098  15.899  -9.411  1.00  1.080          O  
ATOM    211  CB  LYS A  13       7.784  14.879  -7.377  1.00  1.750          C  
ATOM    212  CG  LYS A  13       6.271  14.964  -7.160  1.00  1.750          C  
ATOM    213  CD  LYS A  13       5.930  15.263  -5.697  1.00  1.750          C  
ATOM    214  CE  LYS A  13       4.421  15.335  -5.477  1.00  1.750          C  
ATOM    215  NZ  LYS A  13       4.077  15.602  -4.048  1.00  1.750          N  
ATOM    216  H   LYS A  13       7.429  12.568  -8.453  1.00  1.520          H  
ATOM    217  HA  LYS A  13       7.673  15.217  -9.497  1.00  1.490          H  
ATOM    218 1HB  LYS A  13       8.179  14.113  -6.709  1.00  2.100          H  
ATOM    219 2HB  LYS A  13       8.224  15.828  -7.077  1.00  2.100          H  
ATOM    220 1HG  LYS A  13       5.859  15.747  -7.794  1.00  2.100          H  
ATOM    221 2HG  LYS A  13       5.818  14.015  -7.446  1.00  2.100          H  
ATOM    222 1HD  LYS A  13       6.343  14.474  -5.064  1.00  2.100          H  
ATOM    223 2HD  LYS A  13       6.378  16.212  -5.405  1.00  2.100          H  
ATOM    224 1HE  LYS A  13       4.009  16.131  -6.094  1.00  2.100          H  
ATOM    225 2HE  LYS A  13       3.973  14.386  -5.776  1.00  2.100          H  
ATOM    226 1HZ  LYS A  13       3.072  15.643  -3.944  1.00  2.100          H  
ATOM    227 2HZ  LYS A  13       4.445  14.863  -3.467  1.00  2.100          H  
ATOM    228 3HZ  LYS A  13       4.478  16.485  -3.763  1.00  2.100          H  
ATOM    229  N   PHE A  14      10.488  13.828  -8.584  1.00  1.140          N  
ATOM    230  CA  PHE A  14      11.930  13.864  -8.599  1.00  1.110          C  
ATOM    231  C   PHE A  14      12.499  13.786 -10.000  1.00  1.060          C  
ATOM    232  O   PHE A  14      13.470  14.471 -10.328  1.00  1.020          O  
ATOM    233  CB  PHE A  14      12.475  12.744  -7.754  1.00  1.570          C  
ATOM    234  CG  PHE A  14      12.214  12.876  -6.264  1.00  1.570          C  
ATOM    235  CD1 PHE A  14      11.709  14.053  -5.663  1.00  1.570          C  
ATOM    236  CD2 PHE A  14      12.512  11.825  -5.447  1.00  1.570          C  
ATOM    237  CE1 PHE A  14      11.543  14.118  -4.309  1.00  1.570          C  
ATOM    238  CE2 PHE A  14      12.350  11.913  -4.110  1.00  1.570          C  
ATOM    239  CZ  PHE A  14      11.871  13.053  -3.535  1.00  1.570          C  
ATOM    240  H   PHE A  14      10.035  12.997  -8.204  1.00  1.370          H  
ATOM    241  HA  PHE A  14      12.252  14.801  -8.181  1.00  1.330          H  
ATOM    242 1HB  PHE A  14      12.042  11.806  -8.091  1.00  1.880          H  
ATOM    243 2HB  PHE A  14      13.533  12.688  -7.911  1.00  1.880          H  
ATOM    244  HD1 PHE A  14      11.446  14.924  -6.251  1.00  1.880          H  
ATOM    245  HD2 PHE A  14      12.899  10.912  -5.885  1.00  1.880          H  
ATOM    246  HE1 PHE A  14      11.157  15.025  -3.849  1.00  1.880          H  
ATOM    247  HE2 PHE A  14      12.601  11.086  -3.490  1.00  1.880          H  
ATOM    248  HZ  PHE A  14      11.750  13.105  -2.454  1.00  1.880          H  
ATOM    249  N   LYS A  15      11.915  12.964 -10.870  1.00  1.120          N  
ATOM    250  CA  LYS A  15      12.432  12.922 -12.227  1.00  1.160          C  
ATOM    251  C   LYS A  15      12.408  14.328 -12.821  1.00  1.120          C  
ATOM    252  O   LYS A  15      13.346  14.710 -13.529  1.00  1.240          O  
ATOM    253  CB  LYS A  15      11.658  11.926 -13.093  1.00  1.610          C  
ATOM    254  CG  LYS A  15      11.990  10.431 -12.809  1.00  1.610          C  
ATOM    255  CD  LYS A  15      11.320   9.485 -13.816  1.00  1.610          C  
ATOM    256  CE  LYS A  15       9.831   9.337 -13.512  1.00  1.610          C  
ATOM    257  NZ  LYS A  15       9.159   8.313 -14.360  1.00  1.610          N  
ATOM    258  H   LYS A  15      11.155  12.340 -10.581  1.00  1.340          H  
ATOM    259  HA  LYS A  15      13.470  12.600 -12.186  1.00  1.390          H  
ATOM    260 1HB  LYS A  15      10.593  12.075 -12.905  1.00  1.930          H  
ATOM    261 2HB  LYS A  15      11.837  12.138 -14.146  1.00  1.930          H  
ATOM    262 1HG  LYS A  15      13.070  10.279 -12.848  1.00  1.930          H  
ATOM    263 2HG  LYS A  15      11.668  10.168 -11.820  1.00  1.930          H  
ATOM    264 1HD  LYS A  15      11.444   9.879 -14.825  1.00  1.930          H  
ATOM    265 2HD  LYS A  15      11.794   8.504 -13.766  1.00  1.930          H  
ATOM    266 1HE  LYS A  15       9.714   9.054 -12.466  1.00  1.930          H  
ATOM    267 2HE  LYS A  15       9.331  10.288 -13.676  1.00  1.930          H  
ATOM    268 1HZ  LYS A  15       8.170   8.297 -14.055  1.00  1.930          H  
ATOM    269 2HZ  LYS A  15       9.217   8.561 -15.333  1.00  1.930          H  
ATOM    270 3HZ  LYS A  15       9.567   7.411 -14.213  1.00  1.930          H  
ATOM    271  N   GLU A  16      11.355  15.106 -12.541  1.00  1.050          N  
ATOM    272  CA  GLU A  16      11.343  16.479 -13.033  1.00  1.110          C  
ATOM    273  C   GLU A  16      12.197  17.442 -12.167  1.00  1.000          C  
ATOM    274  O   GLU A  16      12.922  18.279 -12.707  1.00  1.080          O  
ATOM    275  CB  GLU A  16       9.913  17.010 -13.131  1.00  1.530          C  
ATOM    276  CG  GLU A  16       9.064  16.344 -14.215  1.00  1.530          C  
ATOM    277  CD  GLU A  16       7.671  16.924 -14.316  1.00  1.530          C  
ATOM    278  OE1 GLU A  16       7.334  17.757 -13.506  1.00  1.530          O  
ATOM    279  OE2 GLU A  16       6.951  16.542 -15.209  1.00  1.530          O  
ATOM    280  H   GLU A  16      10.560  14.713 -12.016  1.00  1.260          H  
ATOM    281  HA  GLU A  16      11.763  16.479 -14.037  1.00  1.330          H  
ATOM    282 1HB  GLU A  16       9.408  16.860 -12.172  1.00  1.840          H  
ATOM    283 2HB  GLU A  16       9.934  18.081 -13.327  1.00  1.840          H  
ATOM    284 1HG  GLU A  16       9.566  16.456 -15.175  1.00  1.840          H  
ATOM    285 2HG  GLU A  16       8.993  15.278 -13.994  1.00  1.840          H  
ATOM    286  N   ALA A  17      12.095  17.343 -10.831  1.00  0.920          N  
ATOM    287  CA  ALA A  17      12.803  18.230  -9.894  1.00  0.940          C  
ATOM    288  C   ALA A  17      14.340  18.164  -9.927  1.00  0.950          C  
ATOM    289  O   ALA A  17      15.006  19.179  -9.712  1.00  1.060          O  
ATOM    290  CB  ALA A  17      12.362  17.930  -8.471  1.00  1.310          C  
ATOM    291  H   ALA A  17      11.463  16.649 -10.430  1.00  1.100          H  
ATOM    292  HA  ALA A  17      12.513  19.249 -10.145  1.00  1.130          H  
ATOM    293 1HB  ALA A  17      12.842  18.630  -7.791  1.00  1.570          H  
ATOM    294 2HB  ALA A  17      11.279  18.025  -8.394  1.00  1.570          H  
ATOM    295 3HB  ALA A  17      12.656  16.934  -8.215  1.00  1.570          H  
ATOM    296  N   PHE A  18      14.908  16.981 -10.148  1.00  0.930          N  
ATOM    297  CA  PHE A  18      16.356  16.807 -10.098  1.00  1.030          C  
ATOM    298  C   PHE A  18      17.072  16.744 -11.462  1.00  0.920          C  
ATOM    299  O   PHE A  18      16.504  16.302 -12.458  1.00  0.830          O  
ATOM    300  CB  PHE A  18      16.713  15.528  -9.360  1.00  1.400          C  
ATOM    301  CG  PHE A  18      16.513  15.491  -7.886  1.00  1.400          C  
ATOM    302  CD1 PHE A  18      15.340  15.071  -7.341  1.00  1.400          C  
ATOM    303  CD2 PHE A  18      17.557  15.819  -7.035  1.00  1.400          C  
ATOM    304  CE1 PHE A  18      15.190  14.978  -5.975  1.00  1.400          C  
ATOM    305  CE2 PHE A  18      17.411  15.725  -5.674  1.00  1.400          C  
ATOM    306  CZ  PHE A  18      16.221  15.298  -5.147  1.00  1.400          C  
ATOM    307  H   PHE A  18      14.317  16.165 -10.317  1.00  1.120          H  
ATOM    308  HA  PHE A  18      16.726  17.636  -9.516  1.00  1.240          H  
ATOM    309 1HB  PHE A  18      16.148  14.697  -9.798  1.00  1.680          H  
ATOM    310 2HB  PHE A  18      17.737  15.338  -9.539  1.00  1.680          H  
ATOM    311  HD1 PHE A  18      14.540  14.808  -8.001  1.00  1.680          H  
ATOM    312  HD2 PHE A  18      18.507  16.142  -7.451  1.00  1.680          H  
ATOM    313  HE1 PHE A  18      14.270  14.643  -5.545  1.00  1.680          H  
ATOM    314  HE2 PHE A  18      18.242  15.975  -5.012  1.00  1.680          H  
ATOM    315  HZ  PHE A  18      16.100  15.211  -4.064  1.00  1.680          H  
ATOM    316  N   PRO A  19      18.376  17.102 -11.523  1.00  1.070          N  
ATOM    317  CA  PRO A  19      19.234  16.974 -12.690  1.00  1.180          C  
ATOM    318  C   PRO A  19      19.225  15.533 -13.172  1.00  1.120          C  
ATOM    319  O   PRO A  19      19.128  14.612 -12.347  1.00  1.070          O  
ATOM    320  CB  PRO A  19      20.613  17.375 -12.150  1.00  1.770          C  
ATOM    321  CG  PRO A  19      20.316  18.297 -10.996  1.00  1.770          C  
ATOM    322  CD  PRO A  19      19.057  17.751 -10.362  1.00  1.770          C  
ATOM    323  HA  PRO A  19      18.889  17.659 -13.479  1.00  1.420          H  
ATOM    324 1HB  PRO A  19      21.174  16.480 -11.845  1.00  2.120          H  
ATOM    325 2HB  PRO A  19      21.198  17.862 -12.946  1.00  2.120          H  
ATOM    326 1HG  PRO A  19      21.168  18.311 -10.296  1.00  2.120          H  
ATOM    327 2HG  PRO A  19      20.192  19.328 -11.359  1.00  2.120          H  
ATOM    328 1HD  PRO A  19      19.304  17.028  -9.577  1.00  2.120          H  
ATOM    329 2HD  PRO A  19      18.501  18.621  -9.988  1.00  2.120          H  
ATOM    330  N   TRP A  20      19.344  15.365 -14.496  1.00  1.260          N  
ATOM    331  CA  TRP A  20      19.317  14.073 -15.184  1.00  1.350          C  
ATOM    332  C   TRP A  20      20.084  12.930 -14.512  1.00  1.440          C  
ATOM    333  O   TRP A  20      19.676  11.780 -14.639  1.00  1.460          O  
ATOM    334  CB  TRP A  20      19.821  14.201 -16.624  1.00  1.850          C  
ATOM    335  CG  TRP A  20      21.290  14.468 -16.769  1.00  1.850          C  
ATOM    336  CD1 TRP A  20      21.909  15.676 -16.847  1.00  1.850          C  
ATOM    337  CD2 TRP A  20      22.340  13.472 -16.884  1.00  1.850          C  
ATOM    338  NE1 TRP A  20      23.262  15.503 -16.991  1.00  1.850          N  
ATOM    339  CE2 TRP A  20      23.540  14.162 -17.018  1.00  1.850          C  
ATOM    340  CE3 TRP A  20      22.351  12.070 -16.883  1.00  1.850          C  
ATOM    341  CZ2 TRP A  20      24.747  13.505 -17.148  1.00  1.850          C  
ATOM    342  CZ3 TRP A  20      23.556  11.413 -17.007  1.00  1.850          C  
ATOM    343  CH2 TRP A  20      24.727  12.111 -17.138  1.00  1.850          C  
ATOM    344  H   TRP A  20      19.423  16.196 -15.067  1.00  1.510          H  
ATOM    345  HA  TRP A  20      18.272  13.781 -15.250  1.00  1.620          H  
ATOM    346 1HB  TRP A  20      19.593  13.283 -17.162  1.00  2.220          H  
ATOM    347 2HB  TRP A  20      19.282  15.005 -17.122  1.00  2.220          H  
ATOM    348  HD1 TRP A  20      21.409  16.640 -16.803  1.00  2.220          H  
ATOM    349  HE1 TRP A  20      23.945  16.244 -17.074  1.00  2.220          H  
ATOM    350  HE3 TRP A  20      21.424  11.510 -16.777  1.00  2.220          H  
ATOM    351  HZ2 TRP A  20      25.689  14.042 -17.255  1.00  2.220          H  
ATOM    352  HZ3 TRP A  20      23.550  10.325 -16.999  1.00  2.220          H  
ATOM    353  HH2 TRP A  20      25.662  11.562 -17.236  1.00  2.220          H  
ATOM    354  N   LYS A  21      21.198  13.204 -13.820  1.00  1.550          N  
ATOM    355  CA  LYS A  21      21.948  12.106 -13.220  1.00  1.740          C  
ATOM    356  C   LYS A  21      21.102  11.362 -12.191  1.00  1.670          C  
ATOM    357  O   LYS A  21      21.187  10.131 -12.059  1.00  1.870          O  
ATOM    358  CB  LYS A  21      23.221  12.625 -12.557  1.00  2.360          C  
ATOM    359  CG  LYS A  21      24.272  13.095 -13.534  1.00  2.360          C  
ATOM    360  CD  LYS A  21      25.515  13.617 -12.836  1.00  2.360          C  
ATOM    361  CE  LYS A  21      26.555  14.087 -13.850  1.00  2.360          C  
ATOM    362  NZ  LYS A  21      27.772  14.641 -13.186  1.00  2.360          N  
ATOM    363  H   LYS A  21      21.535  14.151 -13.723  1.00  1.860          H  
ATOM    364  HA  LYS A  21      22.220  11.400 -14.002  1.00  2.090          H  
ATOM    365 1HB  LYS A  21      22.971  13.455 -11.896  1.00  2.830          H  
ATOM    366 2HB  LYS A  21      23.656  11.837 -11.944  1.00  2.830          H  
ATOM    367 1HG  LYS A  21      24.549  12.266 -14.179  1.00  2.830          H  
ATOM    368 2HG  LYS A  21      23.855  13.886 -14.148  1.00  2.830          H  
ATOM    369 1HD  LYS A  21      25.248  14.451 -12.187  1.00  2.830          H  
ATOM    370 2HD  LYS A  21      25.949  12.825 -12.225  1.00  2.830          H  
ATOM    371 1HE  LYS A  21      26.845  13.245 -14.477  1.00  2.830          H  
ATOM    372 2HE  LYS A  21      26.112  14.859 -14.481  1.00  2.830          H  
ATOM    373 1HZ  LYS A  21      28.433  14.940 -13.890  1.00  2.830          H  
ATOM    374 2HZ  LYS A  21      27.515  15.432 -12.610  1.00  2.830          H  
ATOM    375 3HZ  LYS A  21      28.197  13.930 -12.608  1.00  2.830          H  
ATOM    376  N   VAL A  22      20.295  12.124 -11.454  1.00  1.490          N  
ATOM    377  CA  VAL A  22      19.445  11.603 -10.413  1.00  1.550          C  
ATOM    378  C   VAL A  22      18.280  10.934 -11.084  1.00  1.370          C  
ATOM    379  O   VAL A  22      17.905   9.817 -10.743  1.00  1.370          O  
ATOM    380  CB  VAL A  22      18.965  12.720  -9.502  1.00  2.150          C  
ATOM    381  CG1 VAL A  22      17.987  12.182  -8.509  1.00  2.150          C  
ATOM    382  CG2 VAL A  22      20.143  13.363  -8.809  1.00  2.150          C  
ATOM    383  H   VAL A  22      20.230  13.123 -11.660  1.00  1.790          H  
ATOM    384  HA  VAL A  22      19.999  10.868  -9.828  1.00  1.860          H  
ATOM    385  HB  VAL A  22      18.463  13.440 -10.103  1.00  2.580          H  
ATOM    386 1HG1 VAL A  22      17.631  12.969  -7.866  1.00  2.580          H  
ATOM    387 2HG1 VAL A  22      17.142  11.741  -9.023  1.00  2.580          H  
ATOM    388 3HG1 VAL A  22      18.476  11.424  -7.901  1.00  2.580          H  
ATOM    389 1HG2 VAL A  22      19.796  14.171  -8.171  1.00  2.580          H  
ATOM    390 2HG2 VAL A  22      20.653  12.616  -8.202  1.00  2.580          H  
ATOM    391 3HG2 VAL A  22      20.834  13.760  -9.552  1.00  2.580          H  
ATOM    392  N   ARG A  23      17.703  11.623 -12.068  1.00  1.310          N  
ATOM    393  CA  ARG A  23      16.581  11.070 -12.813  1.00  1.250          C  
ATOM    394  C   ARG A  23      16.897   9.646 -13.266  1.00  1.150          C  
ATOM    395  O   ARG A  23      16.073   8.738 -13.092  1.00  1.170          O  
ATOM    396  CB  ARG A  23      16.286  11.924 -14.035  1.00  1.770          C  
ATOM    397  CG  ARG A  23      15.129  11.487 -14.902  1.00  1.770          C  
ATOM    398  CD  ARG A  23      14.996  12.350 -16.095  1.00  1.770          C  
ATOM    399  NE  ARG A  23      14.630  13.705 -15.717  1.00  1.770          N  
ATOM    400  CZ  ARG A  23      14.706  14.807 -16.477  1.00  1.770          C  
ATOM    401  NH1 ARG A  23      15.151  14.771 -17.720  1.00  1.770          N  
ATOM    402  NH2 ARG A  23      14.308  15.933 -15.924  1.00  1.770          N  
ATOM    403  H   ARG A  23      18.071  12.555 -12.285  1.00  1.570          H  
ATOM    404  HA  ARG A  23      15.705  11.053 -12.165  1.00  1.500          H  
ATOM    405 1HB  ARG A  23      16.121  12.959 -13.724  1.00  2.130          H  
ATOM    406 2HB  ARG A  23      17.147  11.908 -14.676  1.00  2.130          H  
ATOM    407 1HG  ARG A  23      15.263  10.455 -15.228  1.00  2.130          H  
ATOM    408 2HG  ARG A  23      14.225  11.577 -14.346  1.00  2.130          H  
ATOM    409 1HD  ARG A  23      15.949  12.380 -16.621  1.00  2.130          H  
ATOM    410 2HD  ARG A  23      14.220  11.951 -16.748  1.00  2.130          H  
ATOM    411  HE  ARG A  23      14.271  13.870 -14.768  1.00  2.130          H  
ATOM    412 1HH1 ARG A  23      15.446  13.899 -18.129  1.00  2.130          H  
ATOM    413 2HH1 ARG A  23      15.191  15.620 -18.267  1.00  2.130          H  
ATOM    414 1HH2 ARG A  23      13.960  15.881 -14.943  1.00  2.130          H  
ATOM    415 2HH2 ARG A  23      14.335  16.804 -16.426  1.00  2.130          H  
ATOM    416  N   LYS A  24      18.096   9.451 -13.840  1.00  1.130          N  
ATOM    417  CA  LYS A  24      18.493   8.139 -14.316  1.00  1.150          C  
ATOM    418  C   LYS A  24      18.646   7.150 -13.172  1.00  1.100          C  
ATOM    419  O   LYS A  24      18.165   6.023 -13.286  1.00  1.150          O  
ATOM    420  CB  LYS A  24      19.812   8.222 -15.093  1.00  1.600          C  
ATOM    421  CG  LYS A  24      19.748   8.936 -16.457  1.00  1.600          C  
ATOM    422  CD  LYS A  24      18.965   8.141 -17.510  1.00  1.600          C  
ATOM    423  CE  LYS A  24      19.029   8.832 -18.869  1.00  1.600          C  
ATOM    424  NZ  LYS A  24      18.242   8.101 -19.911  1.00  1.600          N  
ATOM    425  H   LYS A  24      18.721  10.252 -13.977  1.00  1.360          H  
ATOM    426  HA  LYS A  24      17.711   7.762 -14.969  1.00  1.380          H  
ATOM    427 1HB  LYS A  24      20.542   8.767 -14.484  1.00  1.920          H  
ATOM    428 2HB  LYS A  24      20.204   7.220 -15.250  1.00  1.920          H  
ATOM    429 1HG  LYS A  24      19.263   9.902 -16.325  1.00  1.920          H  
ATOM    430 2HG  LYS A  24      20.761   9.108 -16.816  1.00  1.920          H  
ATOM    431 1HD  LYS A  24      19.375   7.134 -17.594  1.00  1.920          H  
ATOM    432 2HD  LYS A  24      17.919   8.067 -17.220  1.00  1.920          H  
ATOM    433 1HE  LYS A  24      18.633   9.843 -18.769  1.00  1.920          H  
ATOM    434 2HE  LYS A  24      20.069   8.891 -19.190  1.00  1.920          H  
ATOM    435 1HZ  LYS A  24      18.310   8.593 -20.792  1.00  1.920          H  
ATOM    436 2HZ  LYS A  24      18.609   7.166 -20.020  1.00  1.920          H  
ATOM    437 3HZ  LYS A  24      17.272   8.050 -19.632  1.00  1.920          H  
ATOM    438  N   SER A  25      19.257   7.563 -12.056  1.00  1.100          N  
ATOM    439  CA  SER A  25      19.411   6.661 -10.922  1.00  1.150          C  
ATOM    440  C   SER A  25      18.066   6.194 -10.376  1.00  1.100          C  
ATOM    441  O   SER A  25      17.851   4.995 -10.182  1.00  1.120          O  
ATOM    442  CB  SER A  25      20.189   7.348  -9.819  1.00  1.590          C  
ATOM    443  OG  SER A  25      20.338   6.514  -8.703  1.00  1.590          O  
ATOM    444  H   SER A  25      19.684   8.497 -12.015  1.00  1.320          H  
ATOM    445  HA  SER A  25      19.969   5.785 -11.254  1.00  1.380          H  
ATOM    446 1HB  SER A  25      21.167   7.643 -10.197  1.00  1.910          H  
ATOM    447 2HB  SER A  25      19.668   8.259  -9.526  1.00  1.910          H  
ATOM    448  HG  SER A  25      20.890   7.000  -8.088  1.00  1.910          H  
ATOM    449  N   PHE A  26      17.148   7.137 -10.159  1.00  1.150          N  
ATOM    450  CA  PHE A  26      15.841   6.827  -9.589  1.00  1.240          C  
ATOM    451  C   PHE A  26      15.053   5.888 -10.503  1.00  1.260          C  
ATOM    452  O   PHE A  26      14.355   4.969 -10.032  1.00  1.360          O  
ATOM    453  CB  PHE A  26      15.080   8.124  -9.304  1.00  1.700          C  
ATOM    454  CG  PHE A  26      15.633   8.957  -8.105  1.00  1.700          C  
ATOM    455  CD1 PHE A  26      16.677   8.500  -7.271  1.00  1.700          C  
ATOM    456  CD2 PHE A  26      15.072  10.181  -7.795  1.00  1.700          C  
ATOM    457  CE1 PHE A  26      17.110   9.251  -6.199  1.00  1.700          C  
ATOM    458  CE2 PHE A  26      15.529  10.929  -6.704  1.00  1.700          C  
ATOM    459  CZ  PHE A  26      16.536  10.456  -5.917  1.00  1.700          C  
ATOM    460  H   PHE A  26      17.392   8.106 -10.376  1.00  1.380          H  
ATOM    461  HA  PHE A  26      15.987   6.294  -8.657  1.00  1.490          H  
ATOM    462 1HB  PHE A  26      15.132   8.756 -10.196  1.00  2.040          H  
ATOM    463 2HB  PHE A  26      14.037   7.909  -9.129  1.00  2.040          H  
ATOM    464  HD1 PHE A  26      17.162   7.552  -7.450  1.00  2.040          H  
ATOM    465  HD2 PHE A  26      14.267  10.552  -8.418  1.00  2.040          H  
ATOM    466  HE1 PHE A  26      17.920   8.886  -5.564  1.00  2.040          H  
ATOM    467  HE2 PHE A  26      15.098  11.895  -6.462  1.00  2.040          H  
ATOM    468  HZ  PHE A  26      16.898  11.045  -5.061  1.00  2.040          H  
ATOM    469  N   PHE A  27      15.140   6.135 -11.818  1.00  1.300          N  
ATOM    470  CA  PHE A  27      14.537   5.283 -12.830  1.00  1.540          C  
ATOM    471  C   PHE A  27      15.101   3.865 -12.804  1.00  1.500          C  
ATOM    472  O   PHE A  27      14.353   2.888 -12.717  1.00  1.730          O  
ATOM    473  CB  PHE A  27      14.741   5.867 -14.224  1.00  2.060          C  
ATOM    474  CG  PHE A  27      14.308   4.940 -15.301  1.00  2.060          C  
ATOM    475  CD1 PHE A  27      12.973   4.766 -15.598  1.00  2.060          C  
ATOM    476  CD2 PHE A  27      15.255   4.219 -16.021  1.00  2.060          C  
ATOM    477  CE1 PHE A  27      12.584   3.890 -16.586  1.00  2.060          C  
ATOM    478  CE2 PHE A  27      14.871   3.344 -17.004  1.00  2.060          C  
ATOM    479  CZ  PHE A  27      13.533   3.178 -17.288  1.00  2.060          C  
ATOM    480  H   PHE A  27      15.656   6.960 -12.139  1.00  1.560          H  
ATOM    481  HA  PHE A  27      13.468   5.229 -12.631  1.00  1.850          H  
ATOM    482 1HB  PHE A  27      14.189   6.800 -14.317  1.00  2.470          H  
ATOM    483 2HB  PHE A  27      15.794   6.099 -14.370  1.00  2.470          H  
ATOM    484  HD1 PHE A  27      12.225   5.324 -15.039  1.00  2.470          H  
ATOM    485  HD2 PHE A  27      16.313   4.350 -15.792  1.00  2.470          H  
ATOM    486  HE1 PHE A  27      11.527   3.756 -16.813  1.00  2.470          H  
ATOM    487  HE2 PHE A  27      15.622   2.781 -17.560  1.00  2.470          H  
ATOM    488  HZ  PHE A  27      13.224   2.484 -18.068  1.00  2.470          H  
ATOM    489  N   LYS A  28      16.433   3.735 -12.855  1.00  1.380          N  
ATOM    490  CA  LYS A  28      17.070   2.420 -12.874  1.00  1.570          C  
ATOM    491  C   LYS A  28      16.727   1.612 -11.631  1.00  1.620          C  
ATOM    492  O   LYS A  28      16.535   0.397 -11.699  1.00  1.920          O  
ATOM    493  CB  LYS A  28      18.586   2.548 -13.017  1.00  2.120          C  
ATOM    494  CG  LYS A  28      19.054   3.001 -14.404  1.00  2.120          C  
ATOM    495  CD  LYS A  28      20.569   3.134 -14.464  1.00  2.120          C  
ATOM    496  CE  LYS A  28      21.038   3.589 -15.842  1.00  2.120          C  
ATOM    497  NZ  LYS A  28      22.526   3.734 -15.907  1.00  2.120          N  
ATOM    498  H   LYS A  28      17.018   4.574 -12.906  1.00  1.660          H  
ATOM    499  HA  LYS A  28      16.694   1.875 -13.739  1.00  1.880          H  
ATOM    500 1HB  LYS A  28      18.948   3.281 -12.289  1.00  2.550          H  
ATOM    501 2HB  LYS A  28      19.057   1.594 -12.786  1.00  2.550          H  
ATOM    502 1HG  LYS A  28      18.728   2.271 -15.147  1.00  2.550          H  
ATOM    503 2HG  LYS A  28      18.600   3.957 -14.646  1.00  2.550          H  
ATOM    504 1HD  LYS A  28      20.892   3.867 -13.720  1.00  2.550          H  
ATOM    505 2HD  LYS A  28      21.029   2.176 -14.229  1.00  2.550          H  
ATOM    506 1HE  LYS A  28      20.721   2.858 -16.584  1.00  2.550          H  
ATOM    507 2HE  LYS A  28      20.578   4.551 -16.074  1.00  2.550          H  
ATOM    508 1HZ  LYS A  28      22.796   4.035 -16.834  1.00  2.550          H  
ATOM    509 2HZ  LYS A  28      22.830   4.419 -15.230  1.00  2.550          H  
ATOM    510 3HZ  LYS A  28      22.962   2.845 -15.704  1.00  2.550          H  
ATOM    511  N   LEU A  29      16.592   2.303 -10.502  1.00  1.460          N  
ATOM    512  CA  LEU A  29      16.263   1.683  -9.233  1.00  1.570          C  
ATOM    513  C   LEU A  29      14.773   1.392  -9.090  1.00  1.540          C  
ATOM    514  O   LEU A  29      14.341   0.845  -8.072  1.00  1.840          O  
ATOM    515  CB  LEU A  29      16.717   2.613  -8.100  1.00  2.150          C  
ATOM    516  CG  LEU A  29      18.243   2.813  -7.937  1.00  2.150          C  
ATOM    517  CD1 LEU A  29      18.471   3.924  -6.944  1.00  2.150          C  
ATOM    518  CD2 LEU A  29      18.892   1.522  -7.426  1.00  2.150          C  
ATOM    519  H   LEU A  29      16.806   3.307 -10.515  1.00  1.750          H  
ATOM    520  HA  LEU A  29      16.785   0.737  -9.172  1.00  1.880          H  
ATOM    521 1HB  LEU A  29      16.289   3.598  -8.293  1.00  2.580          H  
ATOM    522 2HB  LEU A  29      16.326   2.253  -7.160  1.00  2.580          H  
ATOM    523  HG  LEU A  29      18.691   3.092  -8.889  1.00  2.580          H  
ATOM    524 1HD1 LEU A  29      19.540   4.085  -6.816  1.00  2.580          H  
ATOM    525 2HD1 LEU A  29      18.015   4.836  -7.329  1.00  2.580          H  
ATOM    526 3HD1 LEU A  29      18.025   3.652  -5.991  1.00  2.580          H  
ATOM    527 1HD2 LEU A  29      19.962   1.687  -7.299  1.00  2.580          H  
ATOM    528 2HD2 LEU A  29      18.450   1.246  -6.464  1.00  2.580          H  
ATOM    529 3HD2 LEU A  29      18.743   0.716  -8.133  1.00  2.580          H  
ATOM    530  N   GLN A  30      13.968   1.797 -10.068  1.00  1.600          N  
ATOM    531  CA  GLN A  30      12.536   1.568 -10.080  1.00  1.850          C  
ATOM    532  C   GLN A  30      11.850   1.957  -8.785  1.00  1.590          C  
ATOM    533  O   GLN A  30      11.041   1.191  -8.259  1.00  1.620          O  
ATOM    534  CB  GLN A  30      12.260   0.095 -10.410  1.00  2.490          C  
ATOM    535  CG  GLN A  30      12.711  -0.298 -11.808  1.00  2.490          C  
ATOM    536  CD  GLN A  30      11.810   0.277 -12.885  1.00  2.490          C  
ATOM    537  OE1 GLN A  30      10.670  -0.174 -13.044  1.00  2.490          O  
ATOM    538  NE2 GLN A  30      12.286   1.278 -13.611  1.00  2.490          N  
ATOM    539  H   GLN A  30      14.363   2.249 -10.892  1.00  1.920          H  
ATOM    540  HA  GLN A  30      12.113   2.187 -10.871  1.00  2.220          H  
ATOM    541 1HB  GLN A  30      12.769  -0.545  -9.692  1.00  2.990          H  
ATOM    542 2HB  GLN A  30      11.192  -0.104 -10.333  1.00  2.990          H  
ATOM    543 1HG  GLN A  30      13.723   0.078 -11.975  1.00  2.990          H  
ATOM    544 2HG  GLN A  30      12.698  -1.382 -11.893  1.00  2.990          H  
ATOM    545 1HE2 GLN A  30      11.715   1.683 -14.326  1.00  2.990          H  
ATOM    546 2HE2 GLN A  30      13.231   1.650 -13.443  1.00  2.990          H  
ATOM    547  N   GLY A  31      12.152   3.143  -8.255  1.00  1.950          N  
ATOM    548  CA  GLY A  31      11.490   3.578  -7.023  1.00  2.170          C  
ATOM    549  C   GLY A  31      12.101   3.064  -5.709  1.00  1.960          C  
ATOM    550  O   GLY A  31      11.599   3.393  -4.639  1.00  2.320          O  
ATOM    551  H   GLY A  31      12.838   3.740  -8.734  1.00  2.340          H  
ATOM    552 1HA  GLY A  31      11.435   4.656  -7.001  1.00  2.600          H  
ATOM    553 2HA  GLY A  31      10.454   3.244  -7.066  1.00  2.600          H  
ATOM    554  N   SER A  32      13.192   2.293  -5.761  1.00  1.620          N  
ATOM    555  CA  SER A  32      13.808   1.732  -4.547  1.00  1.660          C  
ATOM    556  C   SER A  32      14.887   2.616  -3.910  1.00  1.800          C  
ATOM    557  O   SER A  32      15.635   2.163  -3.038  1.00  2.280          O  
ATOM    558  CB  SER A  32      14.395   0.356  -4.812  1.00  2.310          C  
ATOM    559  OG  SER A  32      15.456   0.420  -5.705  1.00  2.310          O  
ATOM    560  H   SER A  32      13.572   2.010  -6.665  1.00  1.940          H  
ATOM    561  HA  SER A  32      13.017   1.608  -3.807  1.00  1.990          H  
ATOM    562 1HB  SER A  32      14.738  -0.070  -3.871  1.00  2.770          H  
ATOM    563 2HB  SER A  32      13.622  -0.299  -5.210  1.00  2.770          H  
ATOM    564  HG  SER A  32      15.052   0.418  -6.593  1.00  2.770          H  
ATOM    565  N   PHE A  33      14.992   3.861  -4.352  1.00  1.930          N  
ATOM    566  CA  PHE A  33      15.974   4.789  -3.823  1.00  2.240          C  
ATOM    567  C   PHE A  33      15.585   5.238  -2.408  1.00  1.810          C  
ATOM    568  O   PHE A  33      14.550   4.838  -1.885  1.00  1.910          O  
ATOM    569  CB  PHE A  33      16.125   5.958  -4.806  1.00  3.010          C  
ATOM    570  CG  PHE A  33      14.833   6.609  -5.231  1.00  3.010          C  
ATOM    571  CD1 PHE A  33      14.304   7.642  -4.535  1.00  3.010          C  
ATOM    572  CD2 PHE A  33      14.161   6.183  -6.360  1.00  3.010          C  
ATOM    573  CE1 PHE A  33      13.144   8.239  -4.908  1.00  3.010          C  
ATOM    574  CE2 PHE A  33      13.000   6.805  -6.733  1.00  3.010          C  
ATOM    575  CZ  PHE A  33      12.499   7.826  -5.990  1.00  3.010          C  
ATOM    576  H   PHE A  33      14.354   4.171  -5.070  1.00  2.320          H  
ATOM    577  HA  PHE A  33      16.935   4.275  -3.757  1.00  2.690          H  
ATOM    578 1HB  PHE A  33      16.760   6.724  -4.366  1.00  3.610          H  
ATOM    579 2HB  PHE A  33      16.616   5.616  -5.693  1.00  3.610          H  
ATOM    580  HD1 PHE A  33      14.822   7.989  -3.700  1.00  3.610          H  
ATOM    581  HD2 PHE A  33      14.561   5.362  -6.963  1.00  3.610          H  
ATOM    582  HE1 PHE A  33      12.744   9.051  -4.339  1.00  3.610          H  
ATOM    583  HE2 PHE A  33      12.477   6.485  -7.630  1.00  3.610          H  
ATOM    584  HZ  PHE A  33      11.588   8.315  -6.267  1.00  3.610          H  
ATOM    585  N   ASP A  34      16.413   6.059  -1.758  1.00  1.590          N  
ATOM    586  CA  ASP A  34      16.161   6.462  -0.372  1.00  1.340          C  
ATOM    587  C   ASP A  34      15.467   7.808  -0.150  1.00  1.330          C  
ATOM    588  O   ASP A  34      15.375   8.309   0.972  1.00  1.990          O  
ATOM    589  CB  ASP A  34      17.475   6.342   0.387  1.00  1.980          C  
ATOM    590  CG  ASP A  34      18.571   7.119  -0.278  1.00  1.980          C  
ATOM    591  OD1 ASP A  34      18.340   7.550  -1.402  1.00  1.980          O  
ATOM    592  OD2 ASP A  34      19.634   7.230   0.280  1.00  1.980          O  
ATOM    593  H   ASP A  34      17.274   6.412  -2.189  1.00  1.910          H  
ATOM    594  HA  ASP A  34      15.503   5.707   0.058  1.00  1.610          H  
ATOM    595 1HB  ASP A  34      17.346   6.713   1.403  1.00  2.370          H  
ATOM    596 2HB  ASP A  34      17.769   5.294   0.451  1.00  2.370          H  
ATOM    597  N   VAL A  35      14.936   8.353  -1.228  1.00  1.120          N  
ATOM    598  CA  VAL A  35      14.109   9.569  -1.318  1.00  1.560          C  
ATOM    599  C   VAL A  35      14.715  10.906  -0.873  1.00  1.480          C  
ATOM    600  O   VAL A  35      14.605  11.895  -1.593  1.00  1.870          O  
ATOM    601  CB  VAL A  35      12.778   9.314  -0.567  1.00  2.010          C  
ATOM    602  CG1 VAL A  35      11.901  10.579  -0.486  1.00  2.010          C  
ATOM    603  CG2 VAL A  35      12.041   8.210  -1.298  1.00  2.010          C  
ATOM    604  H   VAL A  35      15.152   7.844  -2.070  1.00  1.340          H  
ATOM    605  HA  VAL A  35      13.860   9.682  -2.365  1.00  1.870          H  
ATOM    606  HB  VAL A  35      12.994   9.001   0.454  1.00  2.410          H  
ATOM    607 1HG1 VAL A  35      10.989  10.348   0.044  1.00  2.410          H  
ATOM    608 2HG1 VAL A  35      12.417  11.375   0.043  1.00  2.410          H  
ATOM    609 3HG1 VAL A  35      11.652  10.915  -1.472  1.00  2.410          H  
ATOM    610 1HG2 VAL A  35      11.112   7.976  -0.789  1.00  2.410          H  
ATOM    611 2HG2 VAL A  35      11.827   8.515  -2.302  1.00  2.410          H  
ATOM    612 3HG2 VAL A  35      12.671   7.330  -1.326  1.00  2.410          H  
ATOM    613  N   SER A  36      15.316  10.958   0.307  1.00  1.640          N  
ATOM    614  CA  SER A  36      15.883  12.184   0.870  1.00  2.130          C  
ATOM    615  C   SER A  36      17.191  12.658   0.226  1.00  2.560          C  
ATOM    616  O   SER A  36      17.660  13.759   0.526  1.00  2.910          O  
ATOM    617  CB  SER A  36      16.104  12.010   2.361  1.00  2.790          C  
ATOM    618  OG  SER A  36      17.109  11.070   2.620  1.00  2.790          O  
ATOM    619  H   SER A  36      15.368  10.097   0.850  1.00  1.970          H  
ATOM    620  HA  SER A  36      15.146  12.975   0.732  1.00  2.560          H  
ATOM    621 1HB  SER A  36      16.379  12.968   2.799  1.00  3.340          H  
ATOM    622 2HB  SER A  36      15.175  11.689   2.828  1.00  3.340          H  
ATOM    623  HG  SER A  36      17.200  11.038   3.576  1.00  3.340          H  
ATOM    624  N   VAL A  37      17.793  11.827  -0.622  1.00  3.030          N  
ATOM    625  CA  VAL A  37      19.060  12.156  -1.262  1.00  3.650          C  
ATOM    626  C   VAL A  37      18.989  12.095  -2.785  1.00  4.150          C  
ATOM    627  O   VAL A  37      19.558  12.965  -3.443  1.00  4.570          O  
ATOM    628  OXT VAL A  37      18.812  10.994  -3.298  1.00  5.470          O  
ATOM    629  CB  VAL A  37      20.170  11.205  -0.774  1.00  4.560          C  
ATOM    630  CG1 VAL A  37      21.485  11.529  -1.484  1.00  4.560          C  
ATOM    631  CG2 VAL A  37      20.323  11.338   0.730  1.00  4.560          C  
ATOM    632  H   VAL A  37      17.331  10.952  -0.830  1.00  3.640          H  
ATOM    633  HA  VAL A  37      19.332  13.171  -0.975  1.00  4.380          H  
ATOM    634  HB  VAL A  37      19.901  10.169  -1.021  1.00  5.470          H  
ATOM    635 1HG1 VAL A  37      22.256  10.846  -1.135  1.00  5.470          H  
ATOM    636 2HG1 VAL A  37      21.366  11.411  -2.561  1.00  5.470          H  
ATOM    637 3HG1 VAL A  37      21.774  12.553  -1.262  1.00  5.470          H  
ATOM    638 1HG2 VAL A  37      21.101  10.661   1.073  1.00  5.470          H  
ATOM    639 2HG2 VAL A  37      20.589  12.363   0.978  1.00  5.470          H  
ATOM    640 3HG2 VAL A  37      19.386  11.079   1.216  1.00  5.470          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 -193.233 20.7553 149.755 -15.7525 3.64344 9.885 82.0003 -82.8765 -0.20403 -1.39319 -74.9601 -10.7267 -30.1019 -1.02147 -3.37607 -2.74781 0 0.31078 2.01725 19.3798 38.4255 -5.85655 2.94883 -3.16841 4.28778 20.0277 -71.9821
ASP:NtermProteinFull_1 -2.84145 0.07983 4.48969 -0.24526 0.06516 0.80068 2.05016 -1.90608 -0 -0 -3.72146 -0.21589 0 0 -0.58763 0 0 -0.00818 0.01849 0 1.89772 0 0 -2.3716 0 0.07493 -2.4209
TRP_2 -5.95033 0.57224 2.13196 -1.40922 0.15245 0.68114 1.4955 -1.81591 -0.01401 -0.07346 -1.5906 -0.2123 0 0 0 0 0 -0.00358 2e-05 0 1.70995 -0.20292 0 1.6906 -0.05916 0.26044 -2.63718
PHE_3 -5.45091 0.85139 3.49595 -0.60419 0.0254 0.25587 1.8506 -2.15707 -0 -0 -1.51528 0.04176 0 0 0 0 0 -0.01855 0.09679 0 3.04312 -0.12759 0 1.0402 -0.13599 0.52058 1.21207
LYS_4 -4.72792 0.25761 7.44164 -0.45912 0.07629 0.31929 2.90947 -3.08824 -0.00386 -0.02897 -5.07167 0.0827 0 0 -0.58763 -0.74326 0 0.02855 0.10914 2.26017 0 0.06841 0 -1.5107 -0.00817 0.70466 -1.97163
ALA_5 -4.20364 0.20504 4.66166 -0.02236 0 0 2.16622 -2.39288 -0 -0 -2.04241 -0.34559 0 0 0 0 0 -0.0323 0 0 0 -0.24032 0 1.8394 -0.11942 0.49205 -0.03455
PHE_6 -8.23656 0.82522 3.36094 -0.95564 0.06036 0.33211 2.63437 -2.6997 -0 -0 -2.8999 0.01256 0 0 0 0 0 -0.00314 0.0021 0 1.78602 -0.36475 0 1.0402 -0.14316 0.23842 -5.01056
TYR_7 -8.43884 1.36613 4.33244 -0.57596 0.09595 0.27098 3.56315 -3.13323 -0.02533 -0.21029 -3.00111 -0.21177 0 0 0 0 0 0.07125 0.07089 0 3.44042 0.10469 0.00433 1.2797 -0.07823 0.56863 -0.5062
ASP_8 -4.81074 0.16493 7.00706 -0.09868 0.00193 0.29126 3.23527 -3.13465 -0 -0 -4.60102 -0.36754 0 0 0 -0.74326 0 -0.0277 0.01288 0 1.77439 0.28001 0 -2.3716 -0.19309 0.77297 -2.80756
LYS_9 -4.77966 0.25683 5.39099 -0.30323 0.02738 0.13473 2.50897 -2.52882 -0.00386 -0.02897 -2.37519 -0.01444 0 0 0 0 0 0.00334 0.02831 1.77434 0 0.00598 0 -1.5107 -0.24108 0.48397 -1.1711
VAL_10 -8.25694 1.04278 3.16003 -0.26675 0.11696 0.04361 3.18576 -2.95512 -0 -0 -2.35569 0.30025 0 0 0 0 0 -0.01559 0.0044 0.79825 0 -0.03529 0 1.9342 -0.237 0.7323 -2.80382
ALA_11 -5.72323 0.65713 4.56017 -0.02228 0 0 2.72243 -2.789 -0 -0 -2.60703 -0.37109 0 0 0 0 0 -0.00014 0 0 0 -0.3362 0 1.8394 -0.30543 0.79474 -1.58054
GLU_12 -4.7582 0.2926 6.8368 -0.44317 0.06079 0.87056 2.99312 -2.90554 -0 -0 -3.63944 -0.46859 0 0 0 -0.63064 0 0.0036 0.00181 0 3.39356 -0.22655 0 -2.7348 -0.42948 0.36254 -1.42103
LYS_13 -4.5846 0.15833 4.75251 -0.30072 0.02479 0.13339 2.45281 -2.33221 -0.00018 -0.0044 -2.26827 -0.01504 0 0 0 0 0 -0.05435 0.00138 1.73691 0 -0.02628 0 -1.5107 -0.43393 0.27532 -1.99525
PHE_14 -10.1701 1.74682 3.57806 -0.58256 0.41933 0.27884 3.30006 -3.14399 -0.0116 -0.05758 -2.23408 -0.2138 0 0 0 0 0 0.12574 0.08427 0 3.2255 -0.00211 0 1.0402 -0.25857 0.55465 -2.32088
LYS_15 -6.41942 0.48378 7.51948 -0.44012 0.12 0.22994 3.67526 -3.06374 -0 -0 -4.74413 0.06844 0 0 -1.10041 -0.63064 0 0.17147 0.14605 2.46019 0 -0.05328 0 -1.5107 -0.22008 0.70918 -2.59873
GLU_16 -2.72851 0.22499 3.58269 -0.20695 0.02539 0.28159 1.16408 -1.69077 -0.00018 -0.0044 0.0481 -0.55246 0 0 0 0 0 -0.04303 0.03114 0 3.15217 -0.15948 0 -2.7348 -0.19839 0.46328 0.65447
ALA_17 -2.73279 0.19387 1.83194 -0.02403 1e-05 0 1.37692 -1.31197 -0 -0 -0.9027 -0.32142 0 0 0 0 0 -0.00664 0 0 0 -0.27187 0 1.8394 -0.2959 0.4753 -0.14989
PHE_18 -6.19135 1.21626 2.23898 -0.53127 0.02293 0.21568 1.5727 -1.78729 -0.04008 -0.26059 -1.02939 0.20467 0 0 0 0 0 0.07869 0.08935 0 2.01595 -0.37008 0 1.0402 -0.21824 1.34344 -0.38942
PRO_19 -3.07873 0.61653 2.84336 -0.12314 0.00077 0.09116 2.01931 -1.29247 -0 -0 -1.9236 0.24152 0 0 0 0 0 -0.01655 0.02743 0.11274 0 -1.15995 0 -2.4119 -0.18606 1.27543 -2.96414
TRP_20 -5.68949 0.56638 4.13602 -1.3415 0.17949 0.47016 1.77452 -2.03498 -0 -0 -0.76089 -0.55814 0 0 0 0 0 -0.16107 0.05611 0 1.23655 -0.21834 0 1.6906 -0.04751 0.58806 -0.11401
LYS_21 -4.82089 0.44211 3.81973 -0.31137 0.03139 0.14259 1.3769 -1.92795 -0 -0 -0.72371 -0.00935 0 0 0 0 0 -0.06017 0.00041 1.71742 0 -0.04372 0 -1.5107 -0.0457 0.43693 -1.48608
VAL_22 -6.63556 1.06313 3.75521 -0.30379 0.23476 0.06747 2.66432 -2.46591 -0.01269 -0.0788 -1.97851 -0.14346 0 0 0 0 0 0.01722 0.01003 0.19291 0 -0.40027 0 1.9342 -0.26736 0.29767 -2.04944
ARG_23 -7.1644 0.46134 7.17967 -0.75687 0.12683 0.49403 3.50193 -3.24037 -0.02848 -0.20301 -3.48386 0.37742 0 0 -1.10041 0 0 -0.01608 0.02537 2.51875 0 -0.20022 0 -1.2888 0.1185 0.5426 -2.13605
LYS_24 -5.29673 0.33039 5.66864 -0.48714 0.13746 0.28764 2.57253 -2.5439 -0 -0 -2.53908 0.1537 0 0 0 0 0 0.03624 0.03292 2.3586 0 0.00696 0 -1.5107 -0.04165 0.51195 -0.32217
SER_25 -4.83993 0.26059 5.30282 -0.0273 0 0.0636 2.67407 -2.57705 -0 -0 -1.88882 -0.63042 0 0 0 0 0 -0.01403 0.00089 0.60115 0 0.35443 0.60951 -0.77834 0.01848 0.23314 -0.6372
PHE_26 -9.75844 1.05747 2.9413 -0.53341 0.39669 0.24381 2.51418 -2.73412 -0 -0 -2.65117 -0.24052 0 0 0 0 0 0.31627 0.02097 0 3.43395 0.03861 0 1.0402 0.063 0.36394 -3.48726
PHE_27 -5.01318 0.30291 5.40988 -0.99257 0.07648 0.32399 2.62852 -2.62971 -0.01269 -0.0788 -2.62925 -0.02013 0 0 0 0 0 -0.00027 0.1165 0 1.76639 -0.41163 0 1.0402 -0.05168 0.39354 0.21849
LYS_28 -4.13948 0.24528 4.19203 -0.30299 0.02511 0.13419 1.6571 -1.92773 -0 -0 -1.05088 -0.01624 0 0 0 0 0 -0.03958 0.01693 1.71518 0 -0.07034 0 -1.5107 -0.22825 0.18462 -1.11575
LEU_29 -6.13576 0.5566 5.31306 -0.51667 0.22668 0.15117 2.47543 -2.67589 -0 -0 -2.81337 0.1357 0 0 0 0 0 -0.01544 0.15788 0.117 0 -0.10803 0 0.18072 -0.54309 0.27484 -3.21917
GLN_30 -3.31917 0.26166 4.28463 -0.6473 0.13725 0.65193 2.24458 -2.01315 -0 -0 -2.12001 -0.48537 0 0 0 0 0 -0.05437 0.03395 0 2.51908 -0.22288 0 -0.18838 -0.38576 0.32157 1.01827
GLY_31 -2.83025 0.45685 2.38564 -5e-05 0 0 1.14462 -1.39882 -0.01989 -0.11354 -0.11366 -0.38018 0 0 0 0 0 -0.18217 0 0 0 -1.45336 0 0.83697 -0.69656 0.4664 -1.89801
SER_32 -2.70784 0.14426 3.09998 -0.04452 0.01332 0.0681 1.61212 -1.48471 -0 -0 -1.96711 -0.10135 0 0 0 0 0 -0.07815 0.02078 0.41955 0 -0.01631 1.73379 -0.77834 -0.57461 0.53576 -0.10531
PHE_33 -9.23545 1.64109 0.75943 -0.92147 0.13117 0.51793 1.71449 -2.03419 -0.0312 -0.25037 1.02333 0.0346 0 0 0 0 0 0.11169 0.24666 0 1.5394 0.70706 0 1.0402 0.47641 0.5749 -1.95433
ASP_34 -2.47668 0.24182 3.22956 -0.21715 0.09456 0.73168 1.40137 -1.51168 -0 -0 -1.49449 -3.47075 0 0 0 0 0 0.24607 0.55064 0 2.49133 -0.4317 0 -2.3716 0.13204 1.0732 -1.78177
VAL_35 -5.44017 1.10253 0.65244 -0.30841 0.24363 0.07104 1.31339 -1.43562 -0 -0 0.30219 -0.49021 0 0 0 0 0 0.00078 0.00237 0.0868 0 0.08523 0 1.9342 5.18317 1.19687 4.50024
SER_36 -1.60748 0.23395 1.77005 -0.03159 0.00254 0.05394 0.96081 -0.89677 -0 -0 -1.23656 -0.94262 0 0 0 0 0 -0.04905 0.00023 0.19733 0 -0.35446 0.60119 -0.77834 5.23924 0.61054 3.77294
VAL:CtermProteinFull_37 -2.03828 0.17457 2.63816 -0.39372 0.29018 0.18089 0.89328 -1.21531 -0 -0 -0.35941 -1.58128 0 0 0 0 0 0 0.00017 0.31249 0 0 0 1.9342 -0.29953 0.31832 0.85473
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 691851 DOMAINID 682966 MODEL 5 pep1_AB
MODEL     5
REMARK    Rerank model01.pdb to model05.pdb score: 16.216
REMARK    CLUSTER 0001 t000_.out.valid.rescored.best_scoring.binary cluster_size: 20 cluster_threshold: 2.176304
REMARK    SCORE          fa_rep:          20.089
REMARK    SCORE     hbond_sr_bb:         -18.194
REMARK    SCORE          fa_dun:          49.872
REMARK    SCORE    fa_intra_rep:           0.466
REMARK    SCORE            time:           0.000
REMARK    SCORE          fa_atr:        -188.887
REMARK    SCORE     hbond_bb_sc:          -1.619
REMARK    SCORE     description: cluster0001_0001
REMARK    SCORE         fa_elec:         -53.615
REMARK    SCORE     hbond_lr_bb:          -6.227
REMARK    SCORE           omega:          -0.246
REMARK    SCORE     rama_prepro:          -2.172
REMARK    SCORE fa_intra_sol_xover4:           6.540
REMARK    SCORE     lk_ball_wtd:          -5.172
REMARK    SCORE             ref:           9.690
REMARK    SCORE     total_score:         -81.536
REMARK    SCORE         p_aa_pp:          -7.067
REMARK    SCORE           score:         -81.536
REMARK    SCORE          fa_sol:         100.911
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE        hbond_sc:          -2.105
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE     cart_bonded:          16.200
ATOM      1  N   ASP A   1      -0.799   0.426  -0.094  1.00  2.250          N  
ATOM      2  CA  ASP A   1       0.645   0.474   0.074  1.00  1.660          C  
ATOM      3  C   ASP A   1       1.205   1.893   0.154  1.00  1.420          C  
ATOM      4  O   ASP A   1       2.374   2.078   0.504  1.00  1.300          O  
ATOM      5  CB  ASP A   1       1.319  -0.269  -1.071  1.00  2.560          C  
ATOM      6  CG  ASP A   1       0.915  -1.706  -1.057  1.00  2.560          C  
ATOM      7  OD1 ASP A   1       0.392  -2.113  -0.046  1.00  2.560          O  
ATOM      8  OD2 ASP A   1       1.092  -2.377  -2.032  1.00  2.560          O  
ATOM      9 1H   ASP A   1      -1.103  -0.510   0.152  1.00  2.700          H  
ATOM     10 2H   ASP A   1      -1.243   1.097   0.512  1.00  2.700          H  
ATOM     11 3H   ASP A   1      -1.041   0.606  -1.058  1.00  2.700          H  
ATOM     12  HA  ASP A   1       0.894  -0.035   1.007  1.00  1.990          H  
ATOM     13 1HB  ASP A   1       1.037   0.177  -2.025  1.00  3.070          H  
ATOM     14 2HB  ASP A   1       2.404  -0.199  -0.973  1.00  3.070          H  
ATOM     15  N   TRP A   2       0.395   2.914  -0.159  1.00  1.520          N  
ATOM     16  CA  TRP A   2       0.922   4.282  -0.136  1.00  1.550          C  
ATOM     17  C   TRP A   2       1.447   4.692   1.225  1.00  1.330          C  
ATOM     18  O   TRP A   2       2.550   5.218   1.322  1.00  1.280          O  
ATOM     19  CB  TRP A   2      -0.125   5.301  -0.573  1.00  2.160          C  
ATOM     20  CG  TRP A   2       0.416   6.702  -0.569  1.00  2.160          C  
ATOM     21  CD1 TRP A   2       1.091   7.285  -1.592  1.00  2.160          C  
ATOM     22  CD2 TRP A   2       0.335   7.710   0.481  1.00  2.160          C  
ATOM     23  NE1 TRP A   2       1.441   8.563  -1.260  1.00  2.160          N  
ATOM     24  CE2 TRP A   2       0.987   8.840   0.001  1.00  2.160          C  
ATOM     25  CE3 TRP A   2      -0.227   7.743   1.761  1.00  2.160          C  
ATOM     26  CZ2 TRP A   2       1.094   9.991   0.748  1.00  2.160          C  
ATOM     27  CZ3 TRP A   2      -0.110   8.900   2.503  1.00  2.160          C  
ATOM     28  CH2 TRP A   2       0.527   9.988   2.012  1.00  2.160          C  
ATOM     29  H   TRP A   2      -0.563   2.771  -0.441  1.00  1.820          H  
ATOM     30  HA  TRP A   2       1.753   4.333  -0.840  1.00  1.860          H  
ATOM     31 1HB  TRP A   2      -0.469   5.069  -1.579  1.00  2.590          H  
ATOM     32 2HB  TRP A   2      -0.984   5.261   0.092  1.00  2.590          H  
ATOM     33  HD1 TRP A   2       1.324   6.802  -2.539  1.00  2.590          H  
ATOM     34  HE1 TRP A   2       1.952   9.202  -1.851  1.00  2.590          H  
ATOM     35  HE3 TRP A   2      -0.744   6.882   2.164  1.00  2.590          H  
ATOM     36  HZ2 TRP A   2       1.606  10.879   0.376  1.00  2.590          H  
ATOM     37  HZ3 TRP A   2      -0.539   8.928   3.487  1.00  2.590          H  
ATOM     38  HH2 TRP A   2       0.597  10.882   2.631  1.00  2.590          H  
ATOM     39  N   PHE A   3       0.670   4.434   2.282  1.00  1.300          N  
ATOM     40  CA  PHE A   3       1.082   4.843   3.619  1.00  1.240          C  
ATOM     41  C   PHE A   3       2.363   4.171   4.037  1.00  0.950          C  
ATOM     42  O   PHE A   3       3.181   4.764   4.743  1.00  0.920          O  
ATOM     43  CB  PHE A   3       0.026   4.541   4.661  1.00  1.760          C  
ATOM     44  CG  PHE A   3      -1.085   5.498   4.711  1.00  1.760          C  
ATOM     45  CD1 PHE A   3      -2.322   5.190   4.180  1.00  1.760          C  
ATOM     46  CD2 PHE A   3      -0.904   6.731   5.317  1.00  1.760          C  
ATOM     47  CE1 PHE A   3      -3.355   6.098   4.250  1.00  1.760          C  
ATOM     48  CE2 PHE A   3      -1.933   7.635   5.388  1.00  1.760          C  
ATOM     49  CZ  PHE A   3      -3.162   7.320   4.852  1.00  1.760          C  
ATOM     50  H   PHE A   3      -0.219   3.983   2.142  1.00  1.560          H  
ATOM     51  HA  PHE A   3       1.238   5.919   3.611  1.00  1.490          H  
ATOM     52 1HB  PHE A   3      -0.379   3.545   4.500  1.00  2.110          H  
ATOM     53 2HB  PHE A   3       0.502   4.548   5.612  1.00  2.110          H  
ATOM     54  HD1 PHE A   3      -2.488   4.220   3.707  1.00  2.110          H  
ATOM     55  HD2 PHE A   3       0.074   6.991   5.746  1.00  2.110          H  
ATOM     56  HE1 PHE A   3      -4.330   5.848   3.829  1.00  2.110          H  
ATOM     57  HE2 PHE A   3      -1.776   8.601   5.871  1.00  2.110          H  
ATOM     58  HZ  PHE A   3      -3.981   8.037   4.906  1.00  2.110          H  
ATOM     59  N   LYS A   4       2.516   2.905   3.662  1.00  0.930          N  
ATOM     60  CA  LYS A   4       3.707   2.167   4.021  1.00  0.890          C  
ATOM     61  C   LYS A   4       4.924   2.818   3.352  1.00  0.820          C  
ATOM     62  O   LYS A   4       5.924   3.138   4.001  1.00  0.860          O  
ATOM     63  CB  LYS A   4       3.569   0.699   3.619  1.00  1.260          C  
ATOM     64  CG  LYS A   4       4.746  -0.183   4.013  1.00  1.260          C  
ATOM     65  CD  LYS A   4       4.500  -1.642   3.638  1.00  1.260          C  
ATOM     66  CE  LYS A   4       5.694  -2.518   4.003  1.00  1.260          C  
ATOM     67  NZ  LYS A   4       5.470  -3.949   3.643  1.00  1.260          N  
ATOM     68  H   LYS A   4       1.800   2.465   3.103  1.00  1.120          H  
ATOM     69  HA  LYS A   4       3.825   2.204   5.096  1.00  1.070          H  
ATOM     70 1HB  LYS A   4       2.673   0.284   4.073  1.00  1.510          H  
ATOM     71 2HB  LYS A   4       3.447   0.631   2.537  1.00  1.510          H  
ATOM     72 1HG  LYS A   4       5.654   0.170   3.521  1.00  1.510          H  
ATOM     73 2HG  LYS A   4       4.892  -0.122   5.089  1.00  1.510          H  
ATOM     74 1HD  LYS A   4       3.614  -2.008   4.162  1.00  1.510          H  
ATOM     75 2HD  LYS A   4       4.321  -1.713   2.564  1.00  1.510          H  
ATOM     76 1HE  LYS A   4       6.575  -2.154   3.476  1.00  1.510          H  
ATOM     77 2HE  LYS A   4       5.871  -2.447   5.077  1.00  1.510          H  
ATOM     78 1HZ  LYS A   4       6.282  -4.493   3.901  1.00  1.510          H  
ATOM     79 2HZ  LYS A   4       4.660  -4.301   4.136  1.00  1.510          H  
ATOM     80 3HZ  LYS A   4       5.316  -4.029   2.647  1.00  1.510          H  
ATOM     81  N   ALA A   5       4.841   3.030   2.034  1.00  0.850          N  
ATOM     82  CA  ALA A   5       5.971   3.619   1.323  1.00  0.930          C  
ATOM     83  C   ALA A   5       6.285   5.008   1.864  1.00  0.900          C  
ATOM     84  O   ALA A   5       7.456   5.385   2.016  1.00  1.030          O  
ATOM     85  CB  ALA A   5       5.655   3.704  -0.158  1.00  1.270          C  
ATOM     86  H   ALA A   5       3.990   2.769   1.526  1.00  1.020          H  
ATOM     87  HA  ALA A   5       6.841   2.984   1.480  1.00  1.120          H  
ATOM     88 1HB  ALA A   5       6.502   4.127  -0.687  1.00  1.520          H  
ATOM     89 2HB  ALA A   5       5.443   2.706  -0.539  1.00  1.520          H  
ATOM     90 3HB  ALA A   5       4.776   4.339  -0.298  1.00  1.520          H  
ATOM     91  N   PHE A   6       5.220   5.749   2.151  1.00  0.860          N  
ATOM     92  CA  PHE A   6       5.256   7.093   2.665  1.00  1.030          C  
ATOM     93  C   PHE A   6       5.968   7.218   3.986  1.00  0.920          C  
ATOM     94  O   PHE A   6       6.956   7.941   4.084  1.00  0.870          O  
ATOM     95  CB  PHE A   6       3.815   7.580   2.784  1.00  1.370          C  
ATOM     96  CG  PHE A   6       3.572   8.842   3.494  1.00  1.370          C  
ATOM     97  CD1 PHE A   6       3.809  10.062   2.907  1.00  1.370          C  
ATOM     98  CD2 PHE A   6       3.041   8.800   4.785  1.00  1.370          C  
ATOM     99  CE1 PHE A   6       3.528  11.227   3.590  1.00  1.370          C  
ATOM    100  CE2 PHE A   6       2.766   9.953   5.469  1.00  1.370          C  
ATOM    101  CZ  PHE A   6       3.007  11.171   4.872  1.00  1.370          C  
ATOM    102  H   PHE A   6       4.296   5.355   1.966  1.00  1.030          H  
ATOM    103  HA  PHE A   6       5.775   7.716   1.936  1.00  1.240          H  
ATOM    104 1HB  PHE A   6       3.386   7.664   1.787  1.00  1.650          H  
ATOM    105 2HB  PHE A   6       3.261   6.829   3.284  1.00  1.650          H  
ATOM    106  HD1 PHE A   6       4.212  10.099   1.896  1.00  1.650          H  
ATOM    107  HD2 PHE A   6       2.841   7.827   5.254  1.00  1.650          H  
ATOM    108  HE1 PHE A   6       3.718  12.191   3.119  1.00  1.650          H  
ATOM    109  HE2 PHE A   6       2.351   9.911   6.487  1.00  1.650          H  
ATOM    110  HZ  PHE A   6       2.786  12.090   5.415  1.00  1.650          H  
ATOM    111  N   TYR A   7       5.565   6.467   5.009  1.00  0.950          N  
ATOM    112  CA  TYR A   7       6.208   6.704   6.293  1.00  0.950          C  
ATOM    113  C   TYR A   7       7.712   6.404   6.241  1.00  0.750          C  
ATOM    114  O   TYR A   7       8.488   7.054   6.941  1.00  0.700          O  
ATOM    115  CB  TYR A   7       5.516   5.946   7.417  1.00  1.330          C  
ATOM    116  CG  TYR A   7       5.984   4.560   7.683  1.00  1.330          C  
ATOM    117  CD1 TYR A   7       6.890   4.337   8.673  1.00  1.330          C  
ATOM    118  CD2 TYR A   7       5.528   3.538   6.955  1.00  1.330          C  
ATOM    119  CE1 TYR A   7       7.317   3.046   8.936  1.00  1.330          C  
ATOM    120  CE2 TYR A   7       5.944   2.252   7.195  1.00  1.330          C  
ATOM    121  CZ  TYR A   7       6.831   2.002   8.186  1.00  1.330          C  
ATOM    122  OH  TYR A   7       7.235   0.709   8.450  1.00  1.330          O  
ATOM    123  H   TYR A   7       4.783   5.813   4.909  1.00  1.140          H  
ATOM    124  HA  TYR A   7       6.097   7.763   6.518  1.00  1.140          H  
ATOM    125 1HB  TYR A   7       5.604   6.506   8.339  1.00  1.600          H  
ATOM    126 2HB  TYR A   7       4.460   5.904   7.181  1.00  1.600          H  
ATOM    127  HD1 TYR A   7       7.258   5.180   9.253  1.00  1.600          H  
ATOM    128  HD2 TYR A   7       4.826   3.747   6.184  1.00  1.600          H  
ATOM    129  HE1 TYR A   7       8.028   2.850   9.727  1.00  1.600          H  
ATOM    130  HE2 TYR A   7       5.562   1.438   6.598  1.00  1.600          H  
ATOM    131  HH  TYR A   7       7.974   0.724   9.059  1.00  1.600          H  
ATOM    132  N   ASP A   8       8.175   5.487   5.377  1.00  0.760          N  
ATOM    133  CA  ASP A   8       9.619   5.296   5.381  1.00  0.770          C  
ATOM    134  C   ASP A   8      10.319   6.423   4.619  1.00  0.700          C  
ATOM    135  O   ASP A   8      11.379   6.884   5.057  1.00  0.720          O  
ATOM    136  CB  ASP A   8      10.029   3.949   4.790  1.00  1.070          C  
ATOM    137  CG  ASP A   8       9.721   2.730   5.677  1.00  1.070          C  
ATOM    138  OD1 ASP A   8      10.168   2.681   6.831  1.00  1.070          O  
ATOM    139  OD2 ASP A   8       9.082   1.843   5.188  1.00  1.070          O  
ATOM    140  H   ASP A   8       7.543   4.909   4.801  1.00  0.910          H  
ATOM    141  HA  ASP A   8       9.964   5.321   6.414  1.00  0.920          H  
ATOM    142 1HB  ASP A   8       9.499   3.817   3.841  1.00  1.290          H  
ATOM    143 2HB  ASP A   8      11.094   3.961   4.565  1.00  1.290          H  
ATOM    144  N   LYS A   9       9.730   6.895   3.509  1.00  0.690          N  
ATOM    145  CA  LYS A   9      10.338   7.998   2.764  1.00  0.720          C  
ATOM    146  C   LYS A   9      10.366   9.269   3.613  1.00  0.640          C  
ATOM    147  O   LYS A   9      11.349  10.024   3.602  1.00  0.670          O  
ATOM    148  CB  LYS A   9       9.589   8.244   1.455  1.00  1.000          C  
ATOM    149  CG  LYS A   9       9.790   7.153   0.401  1.00  1.000          C  
ATOM    150  CD  LYS A   9       8.978   7.432  -0.861  1.00  1.000          C  
ATOM    151  CE  LYS A   9       9.161   6.328  -1.899  1.00  1.000          C  
ATOM    152  NZ  LYS A   9       8.363   6.585  -3.139  1.00  1.000          N  
ATOM    153  H   LYS A   9       8.868   6.457   3.156  1.00  0.830          H  
ATOM    154  HA  LYS A   9      11.369   7.730   2.531  1.00  0.860          H  
ATOM    155 1HB  LYS A   9       8.518   8.308   1.668  1.00  1.200          H  
ATOM    156 2HB  LYS A   9       9.899   9.197   1.031  1.00  1.200          H  
ATOM    157 1HG  LYS A   9      10.847   7.107   0.139  1.00  1.200          H  
ATOM    158 2HG  LYS A   9       9.501   6.190   0.813  1.00  1.200          H  
ATOM    159 1HD  LYS A   9       7.920   7.495  -0.596  1.00  1.200          H  
ATOM    160 2HD  LYS A   9       9.287   8.383  -1.293  1.00  1.200          H  
ATOM    161 1HE  LYS A   9      10.215   6.260  -2.164  1.00  1.200          H  
ATOM    162 2HE  LYS A   9       8.843   5.379  -1.465  1.00  1.200          H  
ATOM    163 1HZ  LYS A   9       8.510   5.832  -3.797  1.00  1.200          H  
ATOM    164 2HZ  LYS A   9       7.382   6.638  -2.905  1.00  1.200          H  
ATOM    165 3HZ  LYS A   9       8.656   7.457  -3.557  1.00  1.200          H  
ATOM    166  N   VAL A  10       9.286   9.489   4.368  1.00  0.620          N  
ATOM    167  CA  VAL A  10       9.165  10.647   5.228  1.00  0.640          C  
ATOM    168  C   VAL A  10      10.210  10.599   6.305  1.00  0.600          C  
ATOM    169  O   VAL A  10      10.872  11.601   6.559  1.00  0.640          O  
ATOM    170  CB  VAL A  10       7.771  10.726   5.870  1.00  0.890          C  
ATOM    171  CG1 VAL A  10       7.735  11.790   6.917  1.00  0.890          C  
ATOM    172  CG2 VAL A  10       6.756  11.065   4.833  1.00  0.890          C  
ATOM    173  H   VAL A  10       8.518   8.820   4.317  1.00  0.740          H  
ATOM    174  HA  VAL A  10       9.321  11.542   4.628  1.00  0.770          H  
ATOM    175  HB  VAL A  10       7.532   9.772   6.328  1.00  1.070          H  
ATOM    176 1HG1 VAL A  10       6.738  11.835   7.354  1.00  1.070          H  
ATOM    177 2HG1 VAL A  10       8.453  11.585   7.704  1.00  1.070          H  
ATOM    178 3HG1 VAL A  10       7.973  12.743   6.455  1.00  1.070          H  
ATOM    179 1HG2 VAL A  10       5.791  11.110   5.311  1.00  1.070          H  
ATOM    180 2HG2 VAL A  10       6.993  12.030   4.390  1.00  1.070          H  
ATOM    181 3HG2 VAL A  10       6.742  10.317   4.057  1.00  1.070          H  
ATOM    182  N   ALA A  11      10.382   9.446   6.941  1.00  0.600          N  
ATOM    183  CA  ALA A  11      11.368   9.351   7.985  1.00  0.670          C  
ATOM    184  C   ALA A  11      12.756   9.678   7.488  1.00  0.660          C  
ATOM    185  O   ALA A  11      13.504  10.348   8.202  1.00  0.730          O  
ATOM    186  CB  ALA A  11      11.359   7.978   8.571  1.00  0.910          C  
ATOM    187  H   ALA A  11       9.787   8.641   6.726  1.00  0.720          H  
ATOM    188  HA  ALA A  11      11.112  10.072   8.747  1.00  0.800          H  
ATOM    189 1HB  ALA A  11      12.081   7.919   9.384  1.00  1.090          H  
ATOM    190 2HB  ALA A  11      10.367   7.768   8.944  1.00  1.090          H  
ATOM    191 3HB  ALA A  11      11.616   7.258   7.789  1.00  1.090          H  
ATOM    192  N   GLU A  12      13.118   9.255   6.270  1.00  0.650          N  
ATOM    193  CA  GLU A  12      14.459   9.586   5.802  1.00  0.720          C  
ATOM    194  C   GLU A  12      14.604  11.100   5.620  1.00  0.690          C  
ATOM    195  O   GLU A  12      15.611  11.695   6.032  1.00  0.750          O  
ATOM    196  CB  GLU A  12      14.759   8.872   4.482  1.00  0.980          C  
ATOM    197  CG  GLU A  12      14.880   7.350   4.591  1.00  0.980          C  
ATOM    198  CD  GLU A  12      16.029   6.883   5.449  1.00  0.980          C  
ATOM    199  OE1 GLU A  12      17.140   7.269   5.206  1.00  0.980          O  
ATOM    200  OE2 GLU A  12      15.774   6.168   6.398  1.00  0.980          O  
ATOM    201  H   GLU A  12      12.494   8.645   5.725  1.00  0.780          H  
ATOM    202  HA  GLU A  12      15.178   9.260   6.548  1.00  0.860          H  
ATOM    203 1HB  GLU A  12      13.956   9.086   3.772  1.00  1.180          H  
ATOM    204 2HB  GLU A  12      15.683   9.260   4.058  1.00  1.180          H  
ATOM    205 1HG  GLU A  12      13.956   6.960   5.011  1.00  1.180          H  
ATOM    206 2HG  GLU A  12      14.989   6.937   3.590  1.00  1.180          H  
ATOM    207  N   LYS A  13      13.553  11.738   5.080  1.00  0.680          N  
ATOM    208  CA  LYS A  13      13.576  13.182   4.886  1.00  0.770          C  
ATOM    209  C   LYS A  13      13.655  13.903   6.222  1.00  0.760          C  
ATOM    210  O   LYS A  13      14.395  14.886   6.361  1.00  0.860          O  
ATOM    211  CB  LYS A  13      12.338  13.642   4.114  1.00  1.040          C  
ATOM    212  CG  LYS A  13      12.327  13.231   2.645  1.00  1.040          C  
ATOM    213  CD  LYS A  13      11.050  13.689   1.943  1.00  1.040          C  
ATOM    214  CE  LYS A  13      11.037  13.265   0.479  1.00  1.040          C  
ATOM    215  NZ  LYS A  13       9.785  13.690  -0.214  1.00  1.040          N  
ATOM    216  H   LYS A  13      12.758  11.184   4.741  1.00  0.820          H  
ATOM    217  HA  LYS A  13      14.466  13.439   4.312  1.00  0.920          H  
ATOM    218 1HB  LYS A  13      11.447  13.222   4.585  1.00  1.250          H  
ATOM    219 2HB  LYS A  13      12.257  14.726   4.169  1.00  1.250          H  
ATOM    220 1HG  LYS A  13      13.190  13.667   2.145  1.00  1.250          H  
ATOM    221 2HG  LYS A  13      12.402  12.147   2.576  1.00  1.250          H  
ATOM    222 1HD  LYS A  13      10.187  13.247   2.446  1.00  1.250          H  
ATOM    223 2HD  LYS A  13      10.969  14.773   2.001  1.00  1.250          H  
ATOM    224 1HE  LYS A  13      11.891  13.709  -0.029  1.00  1.250          H  
ATOM    225 2HE  LYS A  13      11.118  12.177   0.425  1.00  1.250          H  
ATOM    226 1HZ  LYS A  13       9.814  13.390  -1.178  1.00  1.250          H  
ATOM    227 2HZ  LYS A  13       8.986  13.273   0.243  1.00  1.250          H  
ATOM    228 3HZ  LYS A  13       9.703  14.696  -0.179  1.00  1.250          H  
ATOM    229  N   PHE A  14      12.910  13.402   7.209  1.00  0.710          N  
ATOM    230  CA  PHE A  14      12.896  13.985   8.531  1.00  0.790          C  
ATOM    231  C   PHE A  14      14.232  13.841   9.223  1.00  0.740          C  
ATOM    232  O   PHE A  14      14.709  14.780   9.847  1.00  0.860          O  
ATOM    233  CB  PHE A  14      11.825  13.371   9.407  1.00  1.070          C  
ATOM    234  CG  PHE A  14      10.413  13.803   9.141  1.00  1.070          C  
ATOM    235  CD1 PHE A  14      10.041  14.666   8.109  1.00  1.070          C  
ATOM    236  CD2 PHE A  14       9.451  13.367   9.985  1.00  1.070          C  
ATOM    237  CE1 PHE A  14       8.728  15.049   7.970  1.00  1.070          C  
ATOM    238  CE2 PHE A  14       8.143  13.741   9.859  1.00  1.070          C  
ATOM    239  CZ  PHE A  14       7.779  14.585   8.852  1.00  1.070          C  
ATOM    240  H   PHE A  14      12.301  12.607   7.006  1.00  0.850          H  
ATOM    241  HA  PHE A  14      12.691  15.040   8.428  1.00  0.950          H  
ATOM    242 1HB  PHE A  14      11.867  12.298   9.285  1.00  1.290          H  
ATOM    243 2HB  PHE A  14      12.052  13.585  10.436  1.00  1.290          H  
ATOM    244  HD1 PHE A  14      10.772  15.047   7.404  1.00  1.290          H  
ATOM    245  HD2 PHE A  14       9.750  12.716  10.786  1.00  1.290          H  
ATOM    246  HE1 PHE A  14       8.441  15.721   7.163  1.00  1.290          H  
ATOM    247  HE2 PHE A  14       7.391  13.371  10.563  1.00  1.290          H  
ATOM    248  HZ  PHE A  14       6.737  14.887   8.747  1.00  1.290          H  
ATOM    249  N   LYS A  15      14.895  12.697   9.093  1.00  0.660          N  
ATOM    250  CA  LYS A  15      16.189  12.568   9.749  1.00  0.730          C  
ATOM    251  C   LYS A  15      17.143  13.665   9.298  1.00  0.820          C  
ATOM    252  O   LYS A  15      17.923  14.169  10.109  1.00  0.960          O  
ATOM    253  CB  LYS A  15      16.777  11.180   9.540  1.00  0.990          C  
ATOM    254  CG  LYS A  15      16.086  10.099  10.382  1.00  0.990          C  
ATOM    255  CD  LYS A  15      16.785   8.754  10.289  1.00  0.990          C  
ATOM    256  CE  LYS A  15      16.481   8.081   8.964  1.00  0.990          C  
ATOM    257  NZ  LYS A  15      17.026   6.698   8.878  1.00  0.990          N  
ATOM    258  H   LYS A  15      14.472  11.902   8.600  1.00  0.790          H  
ATOM    259  HA  LYS A  15      16.038  12.699  10.820  1.00  0.880          H  
ATOM    260 1HB  LYS A  15      16.673  10.921   8.485  1.00  1.190          H  
ATOM    261 2HB  LYS A  15      17.838  11.192   9.778  1.00  1.190          H  
ATOM    262 1HG  LYS A  15      16.088  10.417  11.424  1.00  1.190          H  
ATOM    263 2HG  LYS A  15      15.057   9.989  10.068  1.00  1.190          H  
ATOM    264 1HD  LYS A  15      17.863   8.891  10.382  1.00  1.190          H  
ATOM    265 2HD  LYS A  15      16.443   8.112  11.101  1.00  1.190          H  
ATOM    266 1HE  LYS A  15      15.399   8.038   8.834  1.00  1.190          H  
ATOM    267 2HE  LYS A  15      16.911   8.660   8.152  1.00  1.190          H  
ATOM    268 1HZ  LYS A  15      16.746   6.345   7.945  1.00  1.190          H  
ATOM    269 2HZ  LYS A  15      18.029   6.706   8.959  1.00  1.190          H  
ATOM    270 3HZ  LYS A  15      16.632   6.117   9.594  1.00  1.190          H  
ATOM    271  N   GLU A  16      17.102  14.042   8.016  1.00  0.870          N  
ATOM    272  CA  GLU A  16      17.952  15.146   7.587  1.00  1.070          C  
ATOM    273  C   GLU A  16      17.396  16.520   8.037  1.00  1.110          C  
ATOM    274  O   GLU A  16      18.156  17.386   8.477  1.00  1.230          O  
ATOM    275  CB  GLU A  16      18.120  15.142   6.064  1.00  1.420          C  
ATOM    276  CG  GLU A  16      18.934  13.974   5.515  1.00  1.420          C  
ATOM    277  CD  GLU A  16      19.101  14.026   4.012  1.00  1.420          C  
ATOM    278  OE1 GLU A  16      18.480  14.861   3.394  1.00  1.420          O  
ATOM    279  OE2 GLU A  16      19.858  13.242   3.487  1.00  1.420          O  
ATOM    280  H   GLU A  16      16.500  13.531   7.358  1.00  1.040          H  
ATOM    281  HA  GLU A  16      18.933  15.015   8.039  1.00  1.280          H  
ATOM    282 1HB  GLU A  16      17.132  15.104   5.599  1.00  1.700          H  
ATOM    283 2HB  GLU A  16      18.595  16.070   5.749  1.00  1.700          H  
ATOM    284 1HG  GLU A  16      19.918  13.975   5.983  1.00  1.700          H  
ATOM    285 2HG  GLU A  16      18.432  13.044   5.789  1.00  1.700          H  
ATOM    286  N   ALA A  17      16.077  16.726   7.894  1.00  1.110          N  
ATOM    287  CA  ALA A  17      15.400  17.988   8.230  1.00  1.280          C  
ATOM    288  C   ALA A  17      15.390  18.377   9.719  1.00  1.200          C  
ATOM    289  O   ALA A  17      15.469  19.562  10.054  1.00  1.420          O  
ATOM    290  CB  ALA A  17      13.958  17.926   7.758  1.00  1.720          C  
ATOM    291  H   ALA A  17      15.508  15.972   7.498  1.00  1.330          H  
ATOM    292  HA  ALA A  17      15.916  18.779   7.688  1.00  1.540          H  
ATOM    293 1HB  ALA A  17      13.469  18.879   7.953  1.00  2.070          H  
ATOM    294 2HB  ALA A  17      13.933  17.709   6.691  1.00  2.070          H  
ATOM    295 3HB  ALA A  17      13.450  17.150   8.292  1.00  2.070          H  
ATOM    296  N   PHE A  18      15.242  17.395  10.601  1.00  0.990          N  
ATOM    297  CA  PHE A  18      15.109  17.633  12.032  1.00  1.040          C  
ATOM    298  C   PHE A  18      16.311  17.157  12.842  1.00  1.090          C  
ATOM    299  O   PHE A  18      16.612  15.965  12.851  1.00  1.190          O  
ATOM    300  CB  PHE A  18      13.900  16.873  12.574  1.00  1.440          C  
ATOM    301  CG  PHE A  18      12.579  17.347  12.097  1.00  1.440          C  
ATOM    302  CD1 PHE A  18      12.072  16.893  10.911  1.00  1.440          C  
ATOM    303  CD2 PHE A  18      11.823  18.220  12.850  1.00  1.440          C  
ATOM    304  CE1 PHE A  18      10.847  17.299  10.459  1.00  1.440          C  
ATOM    305  CE2 PHE A  18      10.587  18.629  12.408  1.00  1.440          C  
ATOM    306  CZ  PHE A  18      10.100  18.164  11.205  1.00  1.440          C  
ATOM    307  H   PHE A  18      15.186  16.442  10.255  1.00  1.190          H  
ATOM    308  HA  PHE A  18      14.933  18.693  12.156  1.00  1.250          H  
ATOM    309 1HB  PHE A  18      13.997  15.820  12.292  1.00  1.720          H  
ATOM    310 2HB  PHE A  18      13.906  16.917  13.662  1.00  1.720          H  
ATOM    311  HD1 PHE A  18      12.661  16.208  10.339  1.00  1.720          H  
ATOM    312  HD2 PHE A  18      12.206  18.580  13.806  1.00  1.720          H  
ATOM    313  HE1 PHE A  18      10.463  16.936   9.519  1.00  1.720          H  
ATOM    314  HE2 PHE A  18       9.989  19.314  13.013  1.00  1.720          H  
ATOM    315  HZ  PHE A  18       9.121  18.482  10.854  1.00  1.720          H  
ATOM    316  N   PRO A  19      16.933  18.005  13.674  1.00  1.350          N  
ATOM    317  CA  PRO A  19      18.075  17.659  14.499  1.00  1.650          C  
ATOM    318  C   PRO A  19      17.626  16.885  15.739  1.00  1.570          C  
ATOM    319  O   PRO A  19      17.754  17.383  16.858  1.00  1.920          O  
ATOM    320  CB  PRO A  19      18.643  19.037  14.855  1.00  2.470          C  
ATOM    321  CG  PRO A  19      17.420  19.932  14.919  1.00  2.470          C  
ATOM    322  CD  PRO A  19      16.488  19.408  13.817  1.00  2.470          C  
ATOM    323  HA  PRO A  19      18.788  17.069  13.904  1.00  1.980          H  
ATOM    324 1HB  PRO A  19      19.187  18.987  15.811  1.00  2.970          H  
ATOM    325 2HB  PRO A  19      19.368  19.353  14.091  1.00  2.970          H  
ATOM    326 1HG  PRO A  19      16.969  19.872  15.925  1.00  2.970          H  
ATOM    327 2HG  PRO A  19      17.714  20.983  14.768  1.00  2.970          H  
ATOM    328 1HD  PRO A  19      15.446  19.459  14.176  1.00  2.970          H  
ATOM    329 2HD  PRO A  19      16.648  19.971  12.877  1.00  2.970          H  
ATOM    330  N   TRP A  20      17.094  15.682  15.521  1.00  1.440          N  
ATOM    331  CA  TRP A  20      16.539  14.852  16.591  1.00  1.560          C  
ATOM    332  C   TRP A  20      16.067  13.500  16.064  1.00  1.240          C  
ATOM    333  O   TRP A  20      15.700  13.362  14.900  1.00  1.490          O  
ATOM    334  CB  TRP A  20      15.341  15.550  17.257  1.00  2.140          C  
ATOM    335  CG  TRP A  20      14.867  14.849  18.483  1.00  2.140          C  
ATOM    336  CD1 TRP A  20      13.749  14.091  18.626  1.00  2.140          C  
ATOM    337  CD2 TRP A  20      15.525  14.837  19.768  1.00  2.140          C  
ATOM    338  NE1 TRP A  20      13.668  13.610  19.903  1.00  2.140          N  
ATOM    339  CE2 TRP A  20      14.745  14.054  20.616  1.00  2.140          C  
ATOM    340  CE3 TRP A  20      16.700  15.416  20.257  1.00  2.140          C  
ATOM    341  CZ2 TRP A  20      15.094  13.831  21.936  1.00  2.140          C  
ATOM    342  CZ3 TRP A  20      17.052  15.194  21.579  1.00  2.140          C  
ATOM    343  CH2 TRP A  20      16.270  14.421  22.397  1.00  2.140          C  
ATOM    344  H   TRP A  20      17.042  15.367  14.548  1.00  1.730          H  
ATOM    345  HA  TRP A  20      17.313  14.681  17.336  1.00  1.870          H  
ATOM    346 1HB  TRP A  20      15.585  16.568  17.530  1.00  2.560          H  
ATOM    347 2HB  TRP A  20      14.513  15.590  16.550  1.00  2.560          H  
ATOM    348  HD1 TRP A  20      13.026  13.889  17.841  1.00  2.560          H  
ATOM    349  HE1 TRP A  20      12.928  13.018  20.259  1.00  2.560          H  
ATOM    350  HE3 TRP A  20      17.327  16.035  19.610  1.00  2.560          H  
ATOM    351  HZ2 TRP A  20      14.486  13.219  22.602  1.00  2.560          H  
ATOM    352  HZ3 TRP A  20      17.969  15.649  21.952  1.00  2.560          H  
ATOM    353  HH2 TRP A  20      16.576  14.265  23.430  1.00  2.560          H  
ATOM    354  N   LYS A  21      16.080  12.495  16.933  1.00  1.340          N  
ATOM    355  CA  LYS A  21      15.618  11.159  16.584  1.00  1.490          C  
ATOM    356  C   LYS A  21      14.198  11.155  16.029  1.00  1.130          C  
ATOM    357  O   LYS A  21      13.278  11.710  16.624  1.00  1.200          O  
ATOM    358  CB  LYS A  21      15.697  10.242  17.806  1.00  2.030          C  
ATOM    359  CG  LYS A  21      15.303   8.784  17.533  1.00  2.030          C  
ATOM    360  CD  LYS A  21      15.491   7.906  18.769  1.00  2.030          C  
ATOM    361  CE  LYS A  21      15.097   6.459  18.482  1.00  2.030          C  
ATOM    362  NZ  LYS A  21      15.283   5.582  19.677  1.00  2.030          N  
ATOM    363  H   LYS A  21      16.408  12.670  17.874  1.00  1.610          H  
ATOM    364  HA  LYS A  21      16.275  10.763  15.808  1.00  1.790          H  
ATOM    365 1HB  LYS A  21      16.713  10.250  18.198  1.00  2.430          H  
ATOM    366 2HB  LYS A  21      15.041  10.629  18.588  1.00  2.430          H  
ATOM    367 1HG  LYS A  21      14.252   8.738  17.234  1.00  2.430          H  
ATOM    368 2HG  LYS A  21      15.909   8.390  16.718  1.00  2.430          H  
ATOM    369 1HD  LYS A  21      16.535   7.933  19.084  1.00  2.430          H  
ATOM    370 2HD  LYS A  21      14.873   8.287  19.582  1.00  2.430          H  
ATOM    371 1HE  LYS A  21      14.051   6.429  18.179  1.00  2.430          H  
ATOM    372 2HE  LYS A  21      15.711   6.079  17.666  1.00  2.430          H  
ATOM    373 1HZ  LYS A  21      15.012   4.635  19.446  1.00  2.430          H  
ATOM    374 2HZ  LYS A  21      16.254   5.593  19.959  1.00  2.430          H  
ATOM    375 3HZ  LYS A  21      14.709   5.918  20.438  1.00  2.430          H  
ATOM    376  N   VAL A  22      14.027  10.483  14.897  1.00  1.030          N  
ATOM    377  CA  VAL A  22      12.736  10.390  14.232  1.00  0.930          C  
ATOM    378  C   VAL A  22      12.064   9.049  14.526  1.00  0.900          C  
ATOM    379  O   VAL A  22      12.664   7.994  14.317  1.00  1.120          O  
ATOM    380  CB  VAL A  22      12.949  10.572  12.716  1.00  1.340          C  
ATOM    381  CG1 VAL A  22      11.674  10.438  11.978  1.00  1.340          C  
ATOM    382  CG2 VAL A  22      13.538  11.939  12.453  1.00  1.340          C  
ATOM    383  H   VAL A  22      14.831  10.037  14.481  1.00  1.240          H  
ATOM    384  HA  VAL A  22      12.094  11.185  14.605  1.00  1.120          H  
ATOM    385  HB  VAL A  22      13.627   9.801  12.357  1.00  1.610          H  
ATOM    386 1HG1 VAL A  22      11.867  10.568  10.922  1.00  1.610          H  
ATOM    387 2HG1 VAL A  22      11.249   9.449  12.145  1.00  1.610          H  
ATOM    388 3HG1 VAL A  22      10.981  11.202  12.326  1.00  1.610          H  
ATOM    389 1HG2 VAL A  22      13.692  12.050  11.407  1.00  1.610          H  
ATOM    390 2HG2 VAL A  22      12.859  12.691  12.797  1.00  1.610          H  
ATOM    391 3HG2 VAL A  22      14.490  12.052  12.972  1.00  1.610          H  
ATOM    392  N   ARG A  23      10.826   9.089  15.027  1.00  1.060          N  
ATOM    393  CA  ARG A  23      10.109   7.871  15.378  1.00  1.370          C  
ATOM    394  C   ARG A  23       9.071   7.490  14.330  1.00  1.130          C  
ATOM    395  O   ARG A  23       8.244   8.306  13.915  1.00  1.060          O  
ATOM    396  CB  ARG A  23       9.435   8.036  16.733  1.00  1.790          C  
ATOM    397  CG  ARG A  23       8.685   6.809  17.254  1.00  1.790          C  
ATOM    398  CD  ARG A  23       8.170   7.038  18.624  1.00  1.790          C  
ATOM    399  NE  ARG A  23       7.455   5.876  19.141  1.00  1.790          N  
ATOM    400  CZ  ARG A  23       6.855   5.804  20.351  1.00  1.790          C  
ATOM    401  NH1 ARG A  23       6.886   6.834  21.176  1.00  1.790          N  
ATOM    402  NH2 ARG A  23       6.235   4.691  20.710  1.00  1.790          N  
ATOM    403  H   ARG A  23      10.354   9.991  15.162  1.00  1.270          H  
ATOM    404  HA  ARG A  23      10.831   7.058  15.454  1.00  1.640          H  
ATOM    405 1HB  ARG A  23      10.186   8.304  17.474  1.00  2.150          H  
ATOM    406 2HB  ARG A  23       8.724   8.863  16.676  1.00  2.150          H  
ATOM    407 1HG  ARG A  23       7.830   6.592  16.607  1.00  2.150          H  
ATOM    408 2HG  ARG A  23       9.352   5.947  17.273  1.00  2.150          H  
ATOM    409 1HD  ARG A  23       9.007   7.252  19.291  1.00  2.150          H  
ATOM    410 2HD  ARG A  23       7.486   7.886  18.607  1.00  2.150          H  
ATOM    411  HE  ARG A  23       7.404   5.057  18.545  1.00  2.150          H  
ATOM    412 1HH1 ARG A  23       7.357   7.685  20.910  1.00  2.150          H  
ATOM    413 2HH1 ARG A  23       6.436   6.773  22.078  1.00  2.150          H  
ATOM    414 1HH2 ARG A  23       6.210   3.900  20.080  1.00  2.150          H  
ATOM    415 2HH2 ARG A  23       5.785   4.628  21.611  1.00  2.150          H  
ATOM    416  N   LYS A  24       9.067   6.229  13.933  1.00  1.240          N  
ATOM    417  CA  LYS A  24       8.103   5.775  12.942  1.00  1.140          C  
ATOM    418  C   LYS A  24       7.019   4.950  13.616  1.00  1.260          C  
ATOM    419  O   LYS A  24       7.310   4.240  14.583  1.00  1.730          O  
ATOM    420  CB  LYS A  24       8.820   4.930  11.901  1.00  1.640          C  
ATOM    421  CG  LYS A  24       9.933   5.670  11.160  1.00  1.640          C  
ATOM    422  CD  LYS A  24      10.482   4.889   9.934  1.00  1.640          C  
ATOM    423  CE  LYS A  24      11.156   3.584  10.290  1.00  1.640          C  
ATOM    424  NZ  LYS A  24      11.851   2.992   9.096  1.00  1.640          N  
ATOM    425  H   LYS A  24       9.756   5.589  14.308  1.00  1.490          H  
ATOM    426  HA  LYS A  24       7.631   6.633  12.463  1.00  1.370          H  
ATOM    427 1HB  LYS A  24       9.255   4.062  12.393  1.00  1.960          H  
ATOM    428 2HB  LYS A  24       8.104   4.578  11.204  1.00  1.960          H  
ATOM    429 1HG  LYS A  24       9.538   6.625  10.826  1.00  1.960          H  
ATOM    430 2HG  LYS A  24      10.754   5.873  11.847  1.00  1.960          H  
ATOM    431 1HD  LYS A  24       9.702   4.713   9.203  1.00  1.960          H  
ATOM    432 2HD  LYS A  24      11.241   5.470   9.461  1.00  1.960          H  
ATOM    433 1HE  LYS A  24      11.882   3.750  11.082  1.00  1.960          H  
ATOM    434 2HE  LYS A  24      10.407   2.875  10.635  1.00  1.960          H  
ATOM    435 1HZ  LYS A  24      12.284   2.120   9.351  1.00  1.960          H  
ATOM    436 2HZ  LYS A  24      11.179   2.819   8.320  1.00  1.960          H  
ATOM    437 3HZ  LYS A  24      12.556   3.628   8.762  1.00  1.960          H  
ATOM    438  N   SER A  25       5.788   4.991  13.094  1.00  1.090          N  
ATOM    439  CA  SER A  25       4.741   4.152  13.680  1.00  1.350          C  
ATOM    440  C   SER A  25       3.639   3.698  12.718  1.00  1.080          C  
ATOM    441  O   SER A  25       3.363   4.312  11.677  1.00  0.970          O  
ATOM    442  CB  SER A  25       4.090   4.868  14.852  1.00  1.790          C  
ATOM    443  OG  SER A  25       3.401   6.009  14.434  1.00  1.790          O  
ATOM    444  H   SER A  25       5.566   5.627  12.321  1.00  1.310          H  
ATOM    445  HA  SER A  25       5.221   3.253  14.066  1.00  1.620          H  
ATOM    446 1HB  SER A  25       3.396   4.190  15.347  1.00  2.140          H  
ATOM    447 2HB  SER A  25       4.852   5.147  15.579  1.00  2.140          H  
ATOM    448  HG  SER A  25       2.932   6.329  15.208  1.00  2.140          H  
ATOM    449  N   PHE A  26       2.973   2.609  13.125  1.00  1.290          N  
ATOM    450  CA  PHE A  26       1.852   2.023  12.394  1.00  1.270          C  
ATOM    451  C   PHE A  26       0.558   2.091  13.167  1.00  1.310          C  
ATOM    452  O   PHE A  26       0.406   1.515  14.253  1.00  1.730          O  
ATOM    453  CB  PHE A  26       2.114   0.557  12.052  1.00  1.790          C  
ATOM    454  CG  PHE A  26       0.971  -0.139  11.269  1.00  1.790          C  
ATOM    455  CD1 PHE A  26       0.232   0.513  10.275  1.00  1.790          C  
ATOM    456  CD2 PHE A  26       0.664  -1.455  11.524  1.00  1.790          C  
ATOM    457  CE1 PHE A  26      -0.758  -0.118   9.585  1.00  1.790          C  
ATOM    458  CE2 PHE A  26      -0.333  -2.097  10.821  1.00  1.790          C  
ATOM    459  CZ  PHE A  26      -1.043  -1.422   9.849  1.00  1.790          C  
ATOM    460  H   PHE A  26       3.264   2.171  13.989  1.00  1.550          H  
ATOM    461  HA  PHE A  26       1.721   2.586  11.473  1.00  1.520          H  
ATOM    462 1HB  PHE A  26       3.023   0.478  11.481  1.00  2.140          H  
ATOM    463 2HB  PHE A  26       2.267   0.003  12.975  1.00  2.140          H  
ATOM    464  HD1 PHE A  26       0.447   1.537  10.031  1.00  2.140          H  
ATOM    465  HD2 PHE A  26       1.222  -1.993  12.290  1.00  2.140          H  
ATOM    466  HE1 PHE A  26      -1.308   0.427   8.817  1.00  2.140          H  
ATOM    467  HE2 PHE A  26      -0.565  -3.142  11.034  1.00  2.140          H  
ATOM    468  HZ  PHE A  26      -1.829  -1.932   9.298  1.00  2.140          H  
ATOM    469  N   PHE A  27      -0.400   2.779  12.595  1.00  1.110          N  
ATOM    470  CA  PHE A  27      -1.688   2.947  13.206  1.00  1.420          C  
ATOM    471  C   PHE A  27      -2.528   1.770  12.761  1.00  1.480          C  
ATOM    472  O   PHE A  27      -3.384   1.881  11.870  1.00  1.280          O  
ATOM    473  CB  PHE A  27      -2.305   4.275  12.800  1.00  1.860          C  
ATOM    474  CG  PHE A  27      -1.503   5.423  13.260  1.00  1.860          C  
ATOM    475  CD1 PHE A  27      -0.517   5.936  12.440  1.00  1.860          C  
ATOM    476  CD2 PHE A  27      -1.706   5.996  14.503  1.00  1.860          C  
ATOM    477  CE1 PHE A  27       0.258   6.978  12.847  1.00  1.860          C  
ATOM    478  CE2 PHE A  27      -0.930   7.059  14.914  1.00  1.860          C  
ATOM    479  CZ  PHE A  27       0.057   7.549  14.082  1.00  1.860          C  
ATOM    480  H   PHE A  27      -0.242   3.193  11.676  1.00  1.330          H  
ATOM    481  HA  PHE A  27      -1.579   2.920  14.292  1.00  1.700          H  
ATOM    482 1HB  PHE A  27      -2.410   4.337  11.722  1.00  2.240          H  
ATOM    483 2HB  PHE A  27      -3.283   4.358  13.233  1.00  2.240          H  
ATOM    484  HD1 PHE A  27      -0.356   5.488  11.462  1.00  2.240          H  
ATOM    485  HD2 PHE A  27      -2.482   5.601  15.158  1.00  2.240          H  
ATOM    486  HE1 PHE A  27       1.029   7.349  12.195  1.00  2.240          H  
ATOM    487  HE2 PHE A  27      -1.090   7.509  15.893  1.00  2.240          H  
ATOM    488  HZ  PHE A  27       0.676   8.384  14.404  1.00  2.240          H  
ATOM    489  N   LYS A  28      -2.263   0.627  13.383  1.00  2.000          N  
ATOM    490  CA  LYS A  28      -2.875  -0.647  13.008  1.00  2.380          C  
ATOM    491  C   LYS A  28      -4.393  -0.635  13.119  1.00  2.320          C  
ATOM    492  O   LYS A  28      -5.076  -1.419  12.466  1.00  2.590          O  
ATOM    493  CB  LYS A  28      -2.317  -1.787  13.866  1.00  3.180          C  
ATOM    494  CG  LYS A  28      -2.742  -1.766  15.337  1.00  3.180          C  
ATOM    495  CD  LYS A  28      -2.088  -2.893  16.130  1.00  3.180          C  
ATOM    496  CE  LYS A  28      -2.568  -2.901  17.583  1.00  3.180          C  
ATOM    497  NZ  LYS A  28      -1.912  -3.983  18.381  1.00  3.180          N  
ATOM    498  H   LYS A  28      -1.506   0.672  14.076  1.00  2.400          H  
ATOM    499  HA  LYS A  28      -2.636  -0.842  11.971  1.00  2.860          H  
ATOM    500 1HB  LYS A  28      -2.618  -2.741  13.437  1.00  3.820          H  
ATOM    501 2HB  LYS A  28      -1.229  -1.746  13.841  1.00  3.820          H  
ATOM    502 1HG  LYS A  28      -2.492  -0.806  15.789  1.00  3.820          H  
ATOM    503 2HG  LYS A  28      -3.817  -1.911  15.399  1.00  3.820          H  
ATOM    504 1HD  LYS A  28      -2.335  -3.850  15.668  1.00  3.820          H  
ATOM    505 2HD  LYS A  28      -1.005  -2.768  16.114  1.00  3.820          H  
ATOM    506 1HE  LYS A  28      -2.341  -1.939  18.039  1.00  3.820          H  
ATOM    507 2HE  LYS A  28      -3.648  -3.053  17.600  1.00  3.820          H  
ATOM    508 1HZ  LYS A  28      -2.254  -3.957  19.333  1.00  3.820          H  
ATOM    509 2HZ  LYS A  28      -2.126  -4.883  17.973  1.00  3.820          H  
ATOM    510 3HZ  LYS A  28      -0.911  -3.845  18.382  1.00  3.820          H  
ATOM    511  N   LEU A  29      -4.928   0.265  13.937  1.00  2.140          N  
ATOM    512  CA  LEU A  29      -6.364   0.355  14.132  1.00  2.170          C  
ATOM    513  C   LEU A  29      -7.006   1.349  13.166  1.00  1.770          C  
ATOM    514  O   LEU A  29      -8.223   1.546  13.187  1.00  1.900          O  
ATOM    515  CB  LEU A  29      -6.672   0.770  15.576  1.00  3.030          C  
ATOM    516  CG  LEU A  29      -6.146  -0.182  16.701  1.00  3.030          C  
ATOM    517  CD1 LEU A  29      -6.478   0.427  18.050  1.00  3.030          C  
ATOM    518  CD2 LEU A  29      -6.754  -1.582  16.565  1.00  3.030          C  
ATOM    519  H   LEU A  29      -4.307   0.884  14.437  1.00  2.570          H  
ATOM    520  HA  LEU A  29      -6.805  -0.617  13.928  1.00  2.600          H  
ATOM    521 1HB  LEU A  29      -6.245   1.755  15.745  1.00  3.630          H  
ATOM    522 2HB  LEU A  29      -7.754   0.845  15.686  1.00  3.630          H  
ATOM    523  HG  LEU A  29      -5.068  -0.256  16.633  1.00  3.630          H  
ATOM    524 1HD1 LEU A  29      -6.095  -0.214  18.843  1.00  3.630          H  
ATOM    525 2HD1 LEU A  29      -6.018   1.412  18.130  1.00  3.630          H  
ATOM    526 3HD1 LEU A  29      -7.559   0.523  18.152  1.00  3.630          H  
ATOM    527 1HD2 LEU A  29      -6.370  -2.218  17.361  1.00  3.630          H  
ATOM    528 2HD2 LEU A  29      -7.839  -1.519  16.643  1.00  3.630          H  
ATOM    529 3HD2 LEU A  29      -6.486  -2.022  15.609  1.00  3.630          H  
ATOM    530  N   GLN A  30      -6.185   2.005  12.342  1.00  1.460          N  
ATOM    531  CA  GLN A  30      -6.651   2.974  11.363  1.00  1.520          C  
ATOM    532  C   GLN A  30      -6.386   2.443   9.957  1.00  1.790          C  
ATOM    533  O   GLN A  30      -7.139   2.722   9.022  1.00  2.270          O  
ATOM    534  CB  GLN A  30      -5.933   4.316  11.525  1.00  2.100          C  
ATOM    535  CG  GLN A  30      -6.164   5.024  12.851  1.00  2.100          C  
ATOM    536  CD  GLN A  30      -5.369   6.329  12.938  1.00  2.100          C  
ATOM    537  OE1 GLN A  30      -4.848   6.813  11.929  1.00  2.100          O  
ATOM    538  NE2 GLN A  30      -5.270   6.888  14.137  1.00  2.100          N  
ATOM    539  H   GLN A  30      -5.190   1.804  12.357  1.00  1.750          H  
ATOM    540  HA  GLN A  30      -7.724   3.118  11.483  1.00  1.820          H  
ATOM    541 1HB  GLN A  30      -4.868   4.163  11.393  1.00  2.520          H  
ATOM    542 2HB  GLN A  30      -6.256   4.986  10.732  1.00  2.520          H  
ATOM    543 1HG  GLN A  30      -7.223   5.253  12.950  1.00  2.520          H  
ATOM    544 2HG  GLN A  30      -5.846   4.369  13.660  1.00  2.520          H  
ATOM    545 1HE2 GLN A  30      -4.756   7.742  14.251  1.00  2.520          H  
ATOM    546 2HE2 GLN A  30      -5.708   6.460  14.928  1.00  2.520          H  
ATOM    547  N   GLY A  31      -5.311   1.655   9.815  1.00  1.760          N  
ATOM    548  CA  GLY A  31      -4.879   1.160   8.518  1.00  2.280          C  
ATOM    549  C   GLY A  31      -3.981   2.181   7.824  1.00  2.160          C  
ATOM    550  O   GLY A  31      -4.003   2.315   6.599  1.00  2.580          O  
ATOM    551  H   GLY A  31      -4.726   1.469  10.623  1.00  2.110          H  
ATOM    552 1HA  GLY A  31      -4.334   0.224   8.654  1.00  2.740          H  
ATOM    553 2HA  GLY A  31      -5.746   0.945   7.899  1.00  2.740          H  
ATOM    554  N   SER A  32      -3.190   2.904   8.620  1.00  1.810          N  
ATOM    555  CA  SER A  32      -2.301   3.940   8.094  1.00  1.830          C  
ATOM    556  C   SER A  32      -0.992   4.010   8.861  1.00  1.730          C  
ATOM    557  O   SER A  32      -0.876   3.481   9.964  1.00  1.730          O  
ATOM    558  CB  SER A  32      -2.985   5.289   8.174  1.00  2.550          C  
ATOM    559  OG  SER A  32      -3.192   5.665   9.505  1.00  2.550          O  
ATOM    560  H   SER A  32      -3.215   2.716   9.625  1.00  2.170          H  
ATOM    561  HA  SER A  32      -2.077   3.713   7.052  1.00  2.200          H  
ATOM    562 1HB  SER A  32      -2.372   6.029   7.690  1.00  3.060          H  
ATOM    563 2HB  SER A  32      -3.935   5.250   7.646  1.00  3.060          H  
ATOM    564  HG  SER A  32      -3.653   6.511   9.479  1.00  3.060          H  
ATOM    565  N   PHE A  33      -0.003   4.658   8.265  1.00  1.980          N  
ATOM    566  CA  PHE A  33       1.316   4.848   8.860  1.00  1.980          C  
ATOM    567  C   PHE A  33       1.707   6.319   8.827  1.00  1.950          C  
ATOM    568  O   PHE A  33       1.245   7.063   7.959  1.00  2.330          O  
ATOM    569  CB  PHE A  33       2.388   4.102   8.088  1.00  2.770          C  
ATOM    570  CG  PHE A  33       2.339   2.612   7.987  1.00  2.770          C  
ATOM    571  CD1 PHE A  33       1.572   1.965   7.036  1.00  2.770          C  
ATOM    572  CD2 PHE A  33       3.148   1.852   8.797  1.00  2.770          C  
ATOM    573  CE1 PHE A  33       1.609   0.602   6.911  1.00  2.770          C  
ATOM    574  CE2 PHE A  33       3.197   0.485   8.665  1.00  2.770          C  
ATOM    575  CZ  PHE A  33       2.425  -0.140   7.724  1.00  2.770          C  
ATOM    576  H   PHE A  33      -0.182   5.064   7.356  1.00  2.380          H  
ATOM    577  HA  PHE A  33       1.305   4.513   9.898  1.00  2.380          H  
ATOM    578 1HB  PHE A  33       2.454   4.506   7.092  1.00  3.330          H  
ATOM    579 2HB  PHE A  33       3.321   4.339   8.580  1.00  3.330          H  
ATOM    580  HD1 PHE A  33       0.942   2.531   6.384  1.00  3.330          H  
ATOM    581  HD2 PHE A  33       3.776   2.354   9.541  1.00  3.330          H  
ATOM    582  HE1 PHE A  33       0.997   0.105   6.160  1.00  3.330          H  
ATOM    583  HE2 PHE A  33       3.850  -0.103   9.307  1.00  3.330          H  
ATOM    584  HZ  PHE A  33       2.462  -1.222   7.624  1.00  3.330          H  
ATOM    585  N   ASP A  34       2.573   6.734   9.754  1.00  1.800          N  
ATOM    586  CA  ASP A  34       3.090   8.110   9.736  1.00  2.050          C  
ATOM    587  C   ASP A  34       4.424   8.214  10.502  1.00  1.930          C  
ATOM    588  O   ASP A  34       4.927   7.207  11.021  1.00  2.000          O  
ATOM    589  CB  ASP A  34       2.026   9.080  10.299  1.00  2.770          C  
ATOM    590  CG  ASP A  34       2.094  10.511   9.733  1.00  2.770          C  
ATOM    591  OD1 ASP A  34       3.159  10.902   9.308  1.00  2.770          O  
ATOM    592  OD2 ASP A  34       1.092  11.187   9.736  1.00  2.770          O  
ATOM    593  H   ASP A  34       2.899   6.060  10.461  1.00  2.160          H  
ATOM    594  HA  ASP A  34       3.280   8.389   8.699  1.00  2.460          H  
ATOM    595 1HB  ASP A  34       1.028   8.684  10.110  1.00  3.320          H  
ATOM    596 2HB  ASP A  34       2.154   9.150  11.380  1.00  3.320          H  
ATOM    597  N   VAL A  35       5.002   9.425  10.544  1.00  2.000          N  
ATOM    598  CA  VAL A  35       6.282   9.682  11.225  1.00  1.950          C  
ATOM    599  C   VAL A  35       6.234  10.883  12.198  1.00  1.820          C  
ATOM    600  O   VAL A  35       5.783  11.973  11.843  1.00  2.040          O  
ATOM    601  CB  VAL A  35       7.383   9.926  10.187  1.00  2.750          C  
ATOM    602  CG1 VAL A  35       8.676  10.158  10.860  1.00  2.750          C  
ATOM    603  CG2 VAL A  35       7.485   8.759   9.255  1.00  2.750          C  
ATOM    604  H   VAL A  35       4.515  10.190  10.069  1.00  2.400          H  
ATOM    605  HA  VAL A  35       6.545   8.795  11.803  1.00  2.340          H  
ATOM    606  HB  VAL A  35       7.143  10.821   9.627  1.00  3.300          H  
ATOM    607 1HG1 VAL A  35       9.414  10.347  10.111  1.00  3.300          H  
ATOM    608 2HG1 VAL A  35       8.618  11.003  11.524  1.00  3.300          H  
ATOM    609 3HG1 VAL A  35       8.945   9.270  11.432  1.00  3.300          H  
ATOM    610 1HG2 VAL A  35       8.250   8.954   8.536  1.00  3.300          H  
ATOM    611 2HG2 VAL A  35       7.728   7.856   9.810  1.00  3.300          H  
ATOM    612 3HG2 VAL A  35       6.553   8.624   8.742  1.00  3.300          H  
ATOM    613  N   SER A  36       6.746  10.694  13.418  1.00  1.760          N  
ATOM    614  CA  SER A  36       6.751  11.744  14.441  1.00  1.870          C  
ATOM    615  C   SER A  36       8.139  12.252  14.864  1.00  1.990          C  
ATOM    616  O   SER A  36       9.052  11.469  15.164  1.00  2.090          O  
ATOM    617  CB  SER A  36       6.031  11.248  15.674  1.00  2.570          C  
ATOM    618  OG  SER A  36       6.107  12.192  16.709  1.00  2.570          O  
ATOM    619  H   SER A  36       7.155   9.784  13.642  1.00  2.110          H  
ATOM    620  HA  SER A  36       6.200  12.596  14.044  1.00  2.240          H  
ATOM    621 1HB  SER A  36       4.989  11.050  15.432  1.00  3.090          H  
ATOM    622 2HB  SER A  36       6.479  10.307  15.999  1.00  3.090          H  
ATOM    623  HG  SER A  36       5.624  11.813  17.449  1.00  3.090          H  
ATOM    624  N   VAL A  37       8.277  13.580  14.888  1.00  2.310          N  
ATOM    625  CA  VAL A  37       9.502  14.268  15.303  1.00  2.590          C  
ATOM    626  C   VAL A  37       9.221  15.754  15.478  1.00  2.840          C  
ATOM    627  O   VAL A  37       9.919  16.438  16.226  1.00  2.830          O  
ATOM    628  OXT VAL A  37       8.399  16.294  14.741  1.00  3.880          O  
ATOM    629  CB  VAL A  37      10.635  14.064  14.279  1.00  3.330          C  
ATOM    630  CG1 VAL A  37      10.235  14.625  12.972  1.00  3.330          C  
ATOM    631  CG2 VAL A  37      11.936  14.734  14.774  1.00  3.330          C  
ATOM    632  H   VAL A  37       7.473  14.132  14.615  1.00  2.770          H  
ATOM    633  HA  VAL A  37       9.823  13.855  16.261  1.00  3.110          H  
ATOM    634  HB  VAL A  37      10.799  13.008  14.148  1.00  3.990          H  
ATOM    635 1HG1 VAL A  37      11.021  14.459  12.263  1.00  3.990          H  
ATOM    636 2HG1 VAL A  37       9.329  14.144  12.644  1.00  3.990          H  
ATOM    637 3HG1 VAL A  37      10.059  15.687  13.063  1.00  3.990          H  
ATOM    638 1HG2 VAL A  37      12.731  14.573  14.064  1.00  3.990          H  
ATOM    639 2HG2 VAL A  37      11.785  15.801  14.897  1.00  3.990          H  
ATOM    640 3HG2 VAL A  37      12.220  14.297  15.725  1.00  3.990          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 -188.757 20.0776 121.689 -14.4484 3.16012 7.646 68.5762 -72.903 -0.2975 -1.81082 -61.7853 -11.7769 -20.6179 -7.06132 -1.63427 -2.18021 0 -0.29579 2.08836 17.7705 40.7578 -7.18431 1.89766 -3.16841 -2.40376 16.1139 -96.5481
ASP:NtermProteinFull_1 -1.75486 0.07498 2.20029 -0.14726 0.03519 0.48932 1.23404 -1.07549 -0.03075 -0.14151 -0.69328 -1.47445 0 0 0 0 0 0.03077 0.11848 0 2.14509 0 0 -2.3716 0 0.22183 -1.1392
TRP_2 -5.39849 0.63686 1.82138 -1.35337 0.10222 0.57413 1.54231 -1.62346 -0 -0 -1.10876 -0.28406 0 0 0 0 0 -0.0192 0.00479 0 1.70354 -0.28845 0 1.6906 -0.00404 0.3605 -1.64348
PHE_3 -8.02792 0.9516 3.87001 -0.60291 0.03109 0.24798 2.44758 -2.60504 -0.0284 -0.12248 -1.22128 -0.07851 0 0 0 0 0 -0.03882 0.08103 0 2.52881 0.16384 0 1.0402 -0.13291 0.27987 -1.21627
LYS_4 -5.30873 0.65414 4.45446 -0.38882 0.04405 0.18243 1.80683 -2.34401 -0 -0 -0.06107 -0.07641 0 0 0 0 0 -0.00255 0.01793 1.90444 0 0.08312 0 -1.5107 -0.06452 0.23475 -0.37467
ALA_5 -3.84585 0.13567 4.26183 -0.02178 0 0 2.28434 -2.20345 -0 -0 -2.01428 -0.36722 0 0 0 0 0 -0.03422 0 0 0 -0.26988 0 1.8394 -0.16747 0.22272 -0.18018
PHE_6 -8.54424 1.04918 4.70617 -0.80752 0.03719 0.1783 2.98142 -3.09148 -0.01412 -0.09041 -3.17729 -0.15537 0 0 0 0 0 0.09153 0.21518 0 1.73435 -0.48394 0 1.0402 -0.08501 0.7026 -3.71326
TYR_7 -11.1003 1.59434 6.11901 -0.95183 0.0625 0.31128 2.94164 -3.81827 -0.00382 -0.02219 -2.02183 -0.4298 0 0 0 0 0 0.01032 0.65355 0 2.7634 0.18331 0.0652 1.2797 -0.01673 1.22127 -1.15929
ASP_8 -5.38219 0.31579 7.32885 -0.10227 0.00217 0.31419 3.01657 -3.35073 -0.01479 -0.1172 -3.50899 -0.46649 0 0 0 -0.45051 0 0.12789 0.09763 0 2.59948 -0.13092 0 -2.3716 -0.27591 0.88618 -1.48285
LYS_9 -4.67768 0.17143 5.32732 -0.29892 0.02602 0.13145 2.48365 -2.47121 -0 -0 -2.25371 -0.0251 0 0 0 0 0 -0.00723 0.01638 1.7461 0 -0.02217 0 -1.5107 -0.3442 0.29521 -1.41335
VAL_10 -7.64265 0.82964 3.84278 -0.31834 0.26006 0.07225 2.72788 -2.84638 -0 -0 -2.81587 -0.10128 0 0 0 0 0 -0.06432 0.02362 0.05292 0 -0.32802 0 1.9342 -0.26346 0.24457 -4.3924
ALA_11 -6.54383 0.72206 4.2458 -0.02318 0 0 2.762 -2.87884 -0.01177 -0.07138 -2.1872 -0.37169 0 0 0 0 0 -0.01837 0 0 0 -0.3385 0 1.8394 -0.30196 0.4862 -2.69125
GLU_12 -4.89502 0.28558 6.90325 -0.42323 0.04698 0.82494 3.0023 -2.945 -0.01097 -0.09501 -3.67417 -0.46865 0 0 0 -0.6396 0 0.04118 0.01016 0 3.44299 -0.23698 0 -2.7348 -0.50274 0.45512 -1.61369
LYS_13 -4.5568 0.17552 5.03994 -0.3022 0.02725 0.13344 2.62664 -2.42921 -0.00467 -0.07079 -2.22653 -0.01293 0 0 0 0 0 0.00071 0.00382 1.75081 0 -0.00627 0 -1.5107 -0.44246 0.21566 -1.58875
PHE_14 -10.1218 1.44882 3.43885 -0.55179 0.32284 0.22796 3.29847 -3.15139 -0 -0 -2.50869 -0.19579 0 0 0 0 0 0.02225 0.01444 0 3.79639 0.03549 0 1.0402 -0.29662 0.47375 -2.70665
LYS_15 -5.32753 0.37413 6.30013 -0.46437 0.14475 0.25176 2.48637 -2.74936 -0 -0 -3.65589 0.07565 0 0 0 -0.6396 0 0.19356 0.12228 2.46725 0 -0.06691 0 -1.5107 -0.31702 0.71761 -1.5979
GLU_16 -2.46943 0.18136 3.28951 -0.20693 0.02473 0.28123 1.14461 -1.54364 -0.00467 -0.07079 -0.05498 -0.55857 0 0 0 0 0 -0.03753 0.02698 0 3.15664 -0.18313 0 -2.7348 -0.26869 0.43995 0.41186
ALA_17 -2.96756 0.14831 1.76842 -0.02376 0 0 1.44472 -1.33587 -0 -0 -0.93545 -0.31606 0 0 0 0 0 0.01076 0 0 0 -0.17374 0 1.8394 -0.24739 0.4212 -0.36704
PHE_18 -6.40924 0.87827 2.27211 -0.6031 0.07439 0.30962 2.24918 -1.99061 -0 -0 -1.77782 0.03535 0 0 0 0 0 -0.04604 0.00444 0 2.18825 -0.08581 0 1.0402 0.37404 1.20995 -0.2768
PRO_19 -1.29536 0.38877 0.69893 -0.1797 0.05816 0.1275 0.25897 -0.2895 -0 -0 -0.09909 0.02459 0 0 0 0 0 0.02771 0.00442 0.17335 0 -0.81543 0 -2.4119 0.86324 1.0618 -1.40355
TRP_20 -3.5662 0.49805 2.93928 -0.95176 0.04427 0.15737 1.84134 -1.5688 -0 -0 -1.57039 -0.82495 0 0 0 0 0 0.04248 0.03671 0 1.9428 -0.04982 0 1.6906 1.14461 0.20057 2.00616
LYS_21 -2.58927 0.22884 2.14928 -0.37901 0.05403 0.17656 0.67638 -1.12062 -0.01955 -0.11763 -0.34745 0.15713 0 0 0 0 0 -0.10788 0.00398 1.61049 0 -0.00386 0 -1.5107 0.60453 0.10672 -0.42804
VAL_22 -6.17925 0.76126 0.31999 -0.28295 0.19192 0.05848 0.70237 -1.28998 -0.00688 -0.02207 -0.1406 -0.11298 0 0 0 0 0 -0.0522 0.00012 0.18101 0 -0.59315 0 1.9342 -0.4701 0.1586 -4.84222
ARG_23 -3.31285 0.10718 3.43117 -0.5092 0.06199 0.27053 1.99599 -1.64854 -0.00398 -0.01174 -2.63788 0.5255 0 0 0 0 0 -0.03997 0.00673 1.92702 0 0.09992 0 -1.2888 -0.20113 0.195 -1.03307
LYS_24 -4.47918 0.63421 2.84126 -0.45645 0.09179 0.2312 1.18551 -1.32332 -0.00688 -0.02207 -2.94864 -0.01302 0 0 0 -0.45051 0 -0.00192 0.30588 2.9155 0 0.02321 0 -1.5107 -0.0552 0.40983 -2.62952
SER_25 -2.80582 0.06893 3.14708 -0.02749 0 0.06533 1.86151 -1.52557 -0.00625 -0.02271 -1.71995 -0.15848 0 0 0 0 0 -0.00385 0.00019 0.08532 0 -0.49805 0.63035 -0.77834 -0.21693 0.55694 -1.34779
PHE_26 -6.52209 0.91965 1.16748 -0.75691 0.19819 0.12665 0.70656 -1.6514 -0 -0 -1.06965 -0.20836 0 0 0 0 0 -0.06159 0.0083 0 3.34076 -0.15669 0 1.0402 -0.10098 0.42398 -2.59589
PHE_27 -7.55733 0.66008 5.72279 -0.67662 0.0811 0.38326 3.60289 -3.15753 -0.02274 -0.17533 -3.75039 0.02457 0 0 0 0 0 0.01816 0.06958 0 2.23671 -0.03911 0 1.0402 0.21149 0.59158 -0.73664
LYS_28 -3.81265 0.46231 2.58757 -0.41838 0.0702 0.21693 1.06155 -1.38512 -0 -0 -0.29895 0.04938 0 0 0 0 0 -0.11432 0.03556 1.47673 0 -0.02753 0 -1.5107 -0.13836 0.48179 -1.26399
LEU_29 -2.37047 0.32205 1.84637 -0.51122 0.2316 0.14476 0.28772 -0.84173 -0 -0 0.30165 0.10005 0 0 0 0 0 -0.02864 0.06635 0.11645 0 -0.17902 0 0.18072 -0.59805 0.1806 -0.75082
GLN_30 -3.78196 0.23649 3.22754 -0.25689 0.03463 0.2061 1.3859 -1.51951 -0.01374 -0.07142 -0.17057 -0.67442 0 0 0 0 0 -0.0271 0.01653 0 2.95461 -0.16012 0 -0.18838 -0.07906 0.22376 1.34237
GLY_31 -1.80198 0.0414 2.04094 -6e-05 0 0 1.02423 -1.0344 -0.0086 -0.05826 -0.25848 -0.37603 0 0 0 0 0 -0.12552 0 0 0 -1.42545 0 0.83697 0.37151 0.14787 -0.62583
SER_32 -5.34464 0.39841 4.06936 -0.02829 0 0.06659 2.22976 -2.19106 -0.03883 -0.2823 -1.95447 -0.32782 0 0 0 0 0 -0.00237 0.00012 0.1191 0 -0.47739 0.60193 -0.77834 0.04424 0.07444 -3.82154
PHE_33 -9.81589 1.33647 1.41338 -0.50962 0.03677 0.24397 1.60128 -1.94514 -0 -0 -0.63478 0.015 0 0 0 0 0 0.01378 0.0002 0 1.97873 -0.31825 0 1.0402 -0.27849 0.52404 -5.29834
ASP_34 -4.01129 0.31268 4.33859 -0.1014 0.00823 0.2998 2.24398 -2.07209 -0.00018 -0.00071 -3.40157 -1.27228 0 0 -0.81714 0 0 0.00017 0.05034 0 2.24522 -0.19448 0 -2.3716 -0.12976 0.61545 -4.25803
VAL_35 -6.9139 1.24901 0.50001 -0.27537 0.24792 0.0571 1.23835 -1.68303 -0.01526 -0.05982 -2.06365 -0.25689 0 0 -0.81714 0 0 -0.06467 0.07167 0.32636 0 -0.73474 0 1.9342 -0.13445 0.35028 -7.04402
SER_36 -2.68057 0.1723 2.68529 -0.03141 1e-05 0.05637 1.94068 -1.39835 -0.01557 -0.10589 -2.47554 -0.96005 0 0 0 0 0 -0.02875 0.00065 0.8001 0 0.5146 0.60018 -0.77834 -0.03031 0.3698 -1.3648
VAL:CtermProteinFull_37 -4.94196 0.65181 -0.62778 -0.50408 0.50788 0.22722 0.25066 -0.80388 -0.01508 -0.05911 -0.64782 -2.21645 0 0 0 0 0 0 0.00033 0.11759 0 0 0 1.9342 0.14653 0.35186 -5.62808
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

