REMARK ID 114277 DOMAINID 110982 MODEL 1 2021-08-21_00000149_1_11
MODEL     1
REMARK    Rerank model01.pdb score: 45.615
REMARK    CLUSTER 0001 t000_.out.valid.rescored.best_scoring.binary cluster_size: 20 cluster_threshold: 2.900464
REMARK    SCORE     hbond_sr_bb:         -43.705
REMARK    SCORE     rama_prepro:           8.843
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE          fa_sol:         239.717
REMARK    SCORE       dslf_fa13:           0.243
REMARK    SCORE         fa_elec:        -100.932
REMARK    SCORE          fa_atr:        -408.967
REMARK    SCORE        hbond_sc:          -2.883
REMARK    SCORE     hbond_bb_sc:          -5.864
REMARK    SCORE          fa_rep:          50.752
REMARK    SCORE    fa_intra_rep:           0.700
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE          fa_dun:         111.393
REMARK    SCORE atom_pair_constraint:        -205.495
REMARK    SCORE     hbond_lr_bb:          -4.679
REMARK    SCORE     description: cluster0001_0001
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE     total_score:        -251.134
REMARK    SCORE fa_intra_sol_xover4:          15.436
REMARK    SCORE     lk_ball_wtd:         -10.862
REMARK    SCORE           omega:           1.793
REMARK    SCORE           score:        -251.134
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE         p_aa_pp:         -10.073
REMARK    SCORE            time:           0.000
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE             ref:          27.225
REMARK    SCORE     cart_bonded:          86.223
SSBOND     CYS A   35    CYS A   38                                       2.12  
ATOM      1  N   CYS A   1      -0.623   0.485  -0.151  1.00  4.610          N  
ATOM      2  CA  CYS A   1       0.827   0.438  -0.025  1.00  3.770          C  
ATOM      3  C   CYS A   1       1.416   1.834   0.071  1.00  3.290          C  
ATOM      4  O   CYS A   1       1.284   2.656  -0.832  1.00  3.620          O  
ATOM      5  CB  CYS A   1       1.475  -0.294  -1.200  1.00  5.610          C  
ATOM      6  SG  CYS A   1       3.321  -0.369  -1.118  1.00  5.610          S  
ATOM      7 1H   CYS A   1      -0.964  -0.342  -0.618  1.00  5.530          H  
ATOM      8 2H   CYS A   1      -1.012   0.538   0.786  1.00  5.530          H  
ATOM      9 3H   CYS A   1      -0.892   1.308  -0.672  1.00  5.530          H  
ATOM     10  HA  CYS A   1       1.071  -0.103   0.892  1.00  4.520          H  
ATOM     11 1HB  CYS A   1       1.091  -1.305  -1.247  1.00  6.740          H  
ATOM     12 2HB  CYS A   1       1.199   0.195  -2.127  1.00  6.740          H  
ATOM     13  HG  CYS A   1       3.488  -0.945  -2.311  1.00  6.740          H  
ATOM     14  N   VAL A   2       2.152   2.075   1.134  1.00  3.030          N  
ATOM     15  CA  VAL A   2       2.777   3.371   1.358  1.00  3.140          C  
ATOM     16  C   VAL A   2       3.693   3.746   0.204  1.00  3.200          C  
ATOM     17  O   VAL A   2       3.780   4.914  -0.174  1.00  3.730          O  
ATOM     18  CB  VAL A   2       3.582   3.366   2.672  1.00  4.350          C  
ATOM     19  CG1 VAL A   2       4.408   4.632   2.821  1.00  4.350          C  
ATOM     20  CG2 VAL A   2       2.626   3.241   3.837  1.00  4.350          C  
ATOM     21  H   VAL A   2       2.253   1.345   1.826  1.00  3.640          H  
ATOM     22  HA  VAL A   2       1.993   4.124   1.433  1.00  3.770          H  
ATOM     23  HB  VAL A   2       4.267   2.545   2.654  1.00  5.220          H  
ATOM     24 1HG1 VAL A   2       4.966   4.586   3.754  1.00  5.220          H  
ATOM     25 2HG1 VAL A   2       5.108   4.735   2.002  1.00  5.220          H  
ATOM     26 3HG1 VAL A   2       3.747   5.498   2.835  1.00  5.220          H  
ATOM     27 1HG2 VAL A   2       3.189   3.221   4.770  1.00  5.220          H  
ATOM     28 2HG2 VAL A   2       1.950   4.095   3.840  1.00  5.220          H  
ATOM     29 3HG2 VAL A   2       2.050   2.342   3.750  1.00  5.220          H  
ATOM     30  N   PHE A   3       4.404   2.767  -0.328  1.00  3.200          N  
ATOM     31  CA  PHE A   3       5.376   3.014  -1.360  1.00  3.630          C  
ATOM     32  C   PHE A   3       4.920   2.664  -2.786  1.00  3.460          C  
ATOM     33  O   PHE A   3       5.776   2.444  -3.642  1.00  3.960          O  
ATOM     34  CB  PHE A   3       6.598   2.176  -1.038  1.00  4.910          C  
ATOM     35  CG  PHE A   3       7.049   2.387   0.363  1.00  4.910          C  
ATOM     36  CD1 PHE A   3       6.923   1.357   1.277  1.00  4.910          C  
ATOM     37  CD2 PHE A   3       7.538   3.594   0.797  1.00  4.910          C  
ATOM     38  CE1 PHE A   3       7.288   1.512   2.572  1.00  4.910          C  
ATOM     39  CE2 PHE A   3       7.900   3.761   2.116  1.00  4.910          C  
ATOM     40  CZ  PHE A   3       7.774   2.711   3.003  1.00  4.910          C  
ATOM     41  H   PHE A   3       4.301   1.829   0.026  1.00  3.840          H  
ATOM     42  HA  PHE A   3       5.634   4.072  -1.337  1.00  4.360          H  
ATOM     43 1HB  PHE A   3       6.361   1.136  -1.181  1.00  5.890          H  
ATOM     44 2HB  PHE A   3       7.419   2.430  -1.709  1.00  5.890          H  
ATOM     45  HD1 PHE A   3       6.527   0.412   0.952  1.00  5.890          H  
ATOM     46  HD2 PHE A   3       7.634   4.421   0.095  1.00  5.890          H  
ATOM     47  HE1 PHE A   3       7.190   0.677   3.268  1.00  5.890          H  
ATOM     48  HE2 PHE A   3       8.287   4.719   2.456  1.00  5.890          H  
ATOM     49  HZ  PHE A   3       8.066   2.835   4.044  1.00  5.890          H  
ATOM     50  N   GLY A   4       3.610   2.588  -3.077  1.00  3.230          N  
ATOM     51  CA  GLY A   4       3.225   2.288  -4.473  1.00  3.410          C  
ATOM     52  C   GLY A   4       1.725   2.055  -4.719  1.00  3.340          C  
ATOM     53  O   GLY A   4       0.931   1.964  -3.788  1.00  3.670          O  
ATOM     54  H   GLY A   4       2.900   2.760  -2.353  1.00  3.880          H  
ATOM     55 1HA  GLY A   4       3.556   3.111  -5.109  1.00  4.090          H  
ATOM     56 2HA  GLY A   4       3.783   1.420  -4.814  1.00  4.090          H  
ATOM     57  N   CYS A   5       1.336   1.946  -5.996  1.00  3.270          N  
ATOM     58  CA  CYS A   5      -0.076   1.743  -6.351  1.00  3.390          C  
ATOM     59  C   CYS A   5      -0.635   0.299  -6.184  1.00  3.110          C  
ATOM     60  O   CYS A   5      -0.439  -0.532  -7.078  1.00  3.190          O  
ATOM     61  CB  CYS A   5      -0.286   2.129  -7.805  1.00  4.700          C  
ATOM     62  SG  CYS A   5      -1.952   1.876  -8.360  1.00  4.700          S  
ATOM     63  H   CYS A   5       2.054   2.083  -6.727  1.00  3.920          H  
ATOM     64  HA  CYS A   5      -0.621   2.459  -5.756  1.00  4.070          H  
ATOM     65 1HB  CYS A   5      -0.028   3.180  -7.947  1.00  5.640          H  
ATOM     66 2HB  CYS A   5       0.383   1.542  -8.442  1.00  5.640          H  
ATOM     67  HG  CYS A   5      -1.828   0.535  -8.409  1.00  5.640          H  
ATOM     68  N   PRO A   6      -1.554   0.065  -5.204  1.00  3.200          N  
ATOM     69  CA  PRO A   6      -2.117  -1.221  -4.776  1.00  3.190          C  
ATOM     70  C   PRO A   6      -2.968  -1.937  -5.810  1.00  3.150          C  
ATOM     71  O   PRO A   6      -3.287  -3.111  -5.641  1.00  3.410          O  
ATOM     72  CB  PRO A   6      -2.978  -0.843  -3.570  1.00  4.790          C  
ATOM     73  CG  PRO A   6      -3.366   0.587  -3.803  1.00  4.790          C  
ATOM     74  CD  PRO A   6      -2.188   1.217  -4.501  1.00  4.790          C  
ATOM     75  HA  PRO A   6      -1.301  -1.876  -4.450  1.00  3.830          H  
ATOM     76 1HB  PRO A   6      -3.852  -1.512  -3.513  1.00  5.740          H  
ATOM     77 2HB  PRO A   6      -2.408  -0.988  -2.646  1.00  5.740          H  
ATOM     78 1HG  PRO A   6      -4.287   0.635  -4.405  1.00  5.740          H  
ATOM     79 2HG  PRO A   6      -3.595   1.076  -2.844  1.00  5.740          H  
ATOM     80 1HD  PRO A   6      -2.601   1.953  -5.209  1.00  5.740          H  
ATOM     81 2HD  PRO A   6      -1.501   1.666  -3.766  1.00  5.740          H  
ATOM     82  N   SER A   7      -3.401  -1.224  -6.848  1.00  3.210          N  
ATOM     83  CA  SER A   7      -4.262  -1.826  -7.855  1.00  3.410          C  
ATOM     84  C   SER A   7      -3.627  -3.021  -8.553  1.00  3.030          C  
ATOM     85  O   SER A   7      -4.343  -3.919  -9.007  1.00  3.240          O  
ATOM     86  CB  SER A   7      -4.622  -0.813  -8.915  1.00  4.690          C  
ATOM     87  OG  SER A   7      -3.503  -0.477  -9.683  1.00  4.690          O  
ATOM     88  H   SER A   7      -3.125  -0.263  -6.963  1.00  3.850          H  
ATOM     89  HA  SER A   7      -5.172  -2.166  -7.363  1.00  4.090          H  
ATOM     90 1HB  SER A   7      -5.400  -1.221  -9.559  1.00  5.630          H  
ATOM     91 2HB  SER A   7      -5.022   0.081  -8.440  1.00  5.630          H  
ATOM     92  HG  SER A   7      -3.812   0.153 -10.343  1.00  5.630          H  
ATOM     93  N   ALA A   8      -2.296  -3.057  -8.660  1.00  2.730          N  
ATOM     94  CA  ALA A   8      -1.681  -4.195  -9.325  1.00  2.530          C  
ATOM     95  C   ALA A   8      -0.222  -4.332  -8.996  1.00  2.190          C  
ATOM     96  O   ALA A   8       0.512  -3.353  -8.931  1.00  1.960          O  
ATOM     97  CB  ALA A   8      -1.815  -4.065 -10.831  1.00  3.620          C  
ATOM     98  H   ALA A   8      -1.718  -2.296  -8.284  1.00  3.280          H  
ATOM     99  HA  ALA A   8      -2.190  -5.097  -8.987  1.00  3.040          H  
ATOM    100 1HB  ALA A   8      -1.365  -4.933 -11.318  1.00  4.350          H  
ATOM    101 2HB  ALA A   8      -2.864  -4.000 -11.107  1.00  4.350          H  
ATOM    102 3HB  ALA A   8      -1.306  -3.175 -11.150  1.00  4.350          H  
ATOM    103  N   ALA A   9       0.248  -5.561  -8.921  1.00  2.260          N  
ATOM    104  CA  ALA A   9       1.667  -5.814  -8.733  1.00  2.120          C  
ATOM    105  C   ALA A   9       2.491  -5.258  -9.883  1.00  1.650          C  
ATOM    106  O   ALA A   9       3.539  -4.632  -9.661  1.00  1.500          O  
ATOM    107  CB  ALA A   9       1.894  -7.276  -8.638  1.00  3.020          C  
ATOM    108  H   ALA A   9      -0.385  -6.346  -9.006  1.00  2.710          H  
ATOM    109  HA  ALA A   9       1.980  -5.329  -7.808  1.00  2.540          H  
ATOM    110 1HB  ALA A   9       2.889  -7.445  -8.484  1.00  3.630          H  
ATOM    111 2HB  ALA A   9       1.326  -7.651  -7.836  1.00  3.630          H  
ATOM    112 3HB  ALA A   9       1.579  -7.766  -9.559  1.00  3.630          H  
ATOM    113  N   ASP A  10       1.880  -5.371 -11.099  1.00  1.560          N  
ATOM    114  CA  ASP A  10       2.999  -4.842 -11.915  1.00  1.310          C  
ATOM    115  C   ASP A  10       2.966  -3.324 -12.091  1.00  1.100          C  
ATOM    116  O   ASP A  10       3.669  -2.781 -12.950  1.00  1.000          O  
ATOM    117  CB  ASP A  10       3.053  -5.536 -13.294  1.00  1.930          C  
ATOM    118  CG  ASP A  10       1.815  -5.322 -14.148  1.00  1.930          C  
ATOM    119  OD1 ASP A  10       0.838  -4.856 -13.598  1.00  1.930          O  
ATOM    120  OD2 ASP A  10       1.844  -5.563 -15.332  1.00  1.930          O  
ATOM    121  H   ASP A  10       1.575  -5.359 -12.074  1.00  1.870          H  
ATOM    122  HA  ASP A  10       3.956  -5.126 -11.484  1.00  1.570          H  
ATOM    123 1HB  ASP A  10       3.921  -5.170 -13.846  1.00  2.320          H  
ATOM    124 2HB  ASP A  10       3.193  -6.608 -13.150  1.00  2.320          H  
ATOM    125  N   LYS A  11       2.114  -2.639 -11.320  1.00  1.250          N  
ATOM    126  CA  LYS A  11       2.021  -1.204 -11.360  1.00  1.280          C  
ATOM    127  C   LYS A  11       2.489  -0.671 -10.016  1.00  1.080          C  
ATOM    128  O   LYS A  11       2.366   0.515  -9.741  1.00  1.060          O  
ATOM    129  CB  LYS A  11       0.588  -0.773 -11.666  1.00  1.780          C  
ATOM    130  CG  LYS A  11       0.042  -1.343 -12.996  1.00  1.780          C  
ATOM    131  CD  LYS A  11       0.779  -0.824 -14.236  1.00  1.780          C  
ATOM    132  CE  LYS A  11       0.209  -1.445 -15.508  1.00  1.780          C  
ATOM    133  NZ  LYS A  11       0.663  -2.870 -15.684  1.00  1.780          N  
ATOM    134  H   LYS A  11       1.538  -3.120 -10.623  1.00  1.500          H  
ATOM    135  HA  LYS A  11       2.700  -0.811 -12.115  1.00  1.540          H  
ATOM    136 1HB  LYS A  11      -0.064  -1.111 -10.854  1.00  2.140          H  
ATOM    137 2HB  LYS A  11       0.529   0.314 -11.698  1.00  2.140          H  
ATOM    138 1HG  LYS A  11       0.128  -2.428 -12.971  1.00  2.140          H  
ATOM    139 2HG  LYS A  11      -1.012  -1.087 -13.078  1.00  2.140          H  
ATOM    140 1HD  LYS A  11       0.704   0.262 -14.294  1.00  2.140          H  
ATOM    141 2HD  LYS A  11       1.831  -1.099 -14.188  1.00  2.140          H  
ATOM    142 1HE  LYS A  11      -0.876  -1.429 -15.452  1.00  2.140          H  
ATOM    143 2HE  LYS A  11       0.530  -0.864 -16.371  1.00  2.140          H  
ATOM    144 1HZ  LYS A  11       0.276  -3.264 -16.524  1.00  2.140          H  
ATOM    145 2HZ  LYS A  11       1.672  -2.905 -15.749  1.00  2.140          H  
ATOM    146 3HZ  LYS A  11       0.379  -3.475 -14.879  1.00  2.140          H  
ATOM    147  N   LEU A  12       2.966  -1.579  -9.153  1.00  1.220          N  
ATOM    148  CA  LEU A  12       3.436  -1.218  -7.821  1.00  1.360          C  
ATOM    149  C   LEU A  12       4.938  -1.438  -7.745  1.00  1.210          C  
ATOM    150  O   LEU A  12       5.707  -0.570  -7.282  1.00  1.290          O  
ATOM    151  CB  LEU A  12       2.718  -2.078  -6.769  1.00  1.850          C  
ATOM    152  CG  LEU A  12       2.920  -1.724  -5.276  1.00  1.850          C  
ATOM    153  CD1 LEU A  12       1.695  -2.179  -4.553  1.00  1.850          C  
ATOM    154  CD2 LEU A  12       4.175  -2.407  -4.681  1.00  1.850          C  
ATOM    155  H   LEU A  12       3.040  -2.551  -9.444  1.00  1.460          H  
ATOM    156  HA  LEU A  12       3.220  -0.164  -7.643  1.00  1.630          H  
ATOM    157 1HB  LEU A  12       1.650  -2.029  -6.979  1.00  2.220          H  
ATOM    158 2HB  LEU A  12       3.031  -3.112  -6.910  1.00  2.220          H  
ATOM    159  HG  LEU A  12       2.996  -0.659  -5.170  1.00  2.220          H  
ATOM    160 1HD1 LEU A  12       1.755  -1.928  -3.524  1.00  2.220          H  
ATOM    161 2HD1 LEU A  12       0.849  -1.696  -4.982  1.00  2.220          H  
ATOM    162 3HD1 LEU A  12       1.601  -3.251  -4.664  1.00  2.220          H  
ATOM    163 1HD2 LEU A  12       4.266  -2.152  -3.633  1.00  2.220          H  
ATOM    164 2HD2 LEU A  12       4.076  -3.484  -4.788  1.00  2.220          H  
ATOM    165 3HD2 LEU A  12       5.076  -2.086  -5.178  1.00  2.220          H  
ATOM    166  N   TRP A  13       5.404  -2.612  -8.175  1.00  1.190          N  
ATOM    167  CA  TRP A  13       6.826  -2.721  -8.042  1.00  1.350          C  
ATOM    168  C   TRP A  13       7.293  -1.873  -9.202  1.00  1.280          C  
ATOM    169  O   TRP A  13       6.478  -1.294  -9.914  1.00  1.640          O  
ATOM    170  CB  TRP A  13       7.340  -4.161  -8.044  1.00  1.830          C  
ATOM    171  CG  TRP A  13       8.786  -4.239  -7.592  1.00  1.830          C  
ATOM    172  CD1 TRP A  13       9.194  -4.180  -6.295  1.00  1.830          C  
ATOM    173  CD2 TRP A  13      10.002  -4.400  -8.380  1.00  1.830          C  
ATOM    174  NE1 TRP A  13      10.560  -4.254  -6.222  1.00  1.830          N  
ATOM    175  CE2 TRP A  13      11.073  -4.394  -7.476  1.00  1.830          C  
ATOM    176  CE3 TRP A  13      10.263  -4.531  -9.751  1.00  1.830          C  
ATOM    177  CZ2 TRP A  13      12.390  -4.518  -7.890  1.00  1.830          C  
ATOM    178  CZ3 TRP A  13      11.587  -4.655 -10.167  1.00  1.830          C  
ATOM    179  CH2 TRP A  13      12.623  -4.648  -9.256  1.00  1.830          C  
ATOM    180  H   TRP A  13       4.808  -3.346  -8.566  1.00  1.430          H  
ATOM    181  HA  TRP A  13       7.153  -2.262  -7.111  1.00  1.620          H  
ATOM    182 1HB  TRP A  13       6.731  -4.767  -7.382  1.00  2.190          H  
ATOM    183 2HB  TRP A  13       7.265  -4.569  -9.045  1.00  2.190          H  
ATOM    184  HD1 TRP A  13       8.532  -4.069  -5.441  1.00  2.190          H  
ATOM    185  HE1 TRP A  13      11.120  -4.210  -5.377  1.00  2.190          H  
ATOM    186  HE3 TRP A  13       9.451  -4.536 -10.477  1.00  2.190          H  
ATOM    187  HZ2 TRP A  13      13.225  -4.515  -7.187  1.00  2.190          H  
ATOM    188  HZ3 TRP A  13      11.785  -4.756 -11.234  1.00  2.190          H  
ATOM    189  HH2 TRP A  13      13.655  -4.748  -9.612  1.00  2.190          H  
ATOM    190  N   ASP A  14       8.568  -1.684  -9.351  1.00  1.070          N  
ATOM    191  CA  ASP A  14       9.154  -0.822 -10.380  1.00  1.400          C  
ATOM    192  C   ASP A  14       8.847   0.688 -10.078  1.00  1.550          C  
ATOM    193  O   ASP A  14       9.621   1.564 -10.463  1.00  1.950          O  
ATOM    194  CB  ASP A  14       8.645  -1.222 -11.785  1.00  1.830          C  
ATOM    195  CG  ASP A  14       9.622  -0.855 -12.955  1.00  1.830          C  
ATOM    196  OD1 ASP A  14      10.813  -0.864 -12.730  1.00  1.830          O  
ATOM    197  OD2 ASP A  14       9.160  -0.602 -14.054  1.00  1.830          O  
ATOM    198  H   ASP A  14       9.184  -2.180  -8.720  1.00  1.280          H  
ATOM    199  HA  ASP A  14      10.232  -0.969 -10.372  1.00  1.680          H  
ATOM    200 1HB  ASP A  14       8.454  -2.295 -11.814  1.00  2.190          H  
ATOM    201 2HB  ASP A  14       7.693  -0.721 -11.983  1.00  2.190          H  
ATOM    202  N   GLU A  15       7.805   1.009  -9.253  1.00  1.360          N  
ATOM    203  CA  GLU A  15       7.638   2.381  -8.786  1.00  1.660          C  
ATOM    204  C   GLU A  15       8.624   2.433  -7.659  1.00  1.800          C  
ATOM    205  O   GLU A  15       9.330   3.416  -7.467  1.00  2.120          O  
ATOM    206  CB  GLU A  15       6.223   2.711  -8.307  1.00  2.200          C  
ATOM    207  CG  GLU A  15       5.160   2.770  -9.393  1.00  2.200          C  
ATOM    208  CD  GLU A  15       3.785   3.137  -8.831  1.00  2.200          C  
ATOM    209  OE1 GLU A  15       3.515   2.766  -7.697  1.00  2.200          O  
ATOM    210  OE2 GLU A  15       3.055   3.834  -9.497  1.00  2.200          O  
ATOM    211  H   GLU A  15       7.120   0.305  -8.950  1.00  1.630          H  
ATOM    212  HA  GLU A  15       7.933   3.085  -9.561  1.00  1.990          H  
ATOM    213 1HB  GLU A  15       5.907   1.968  -7.576  1.00  2.640          H  
ATOM    214 2HB  GLU A  15       6.236   3.676  -7.799  1.00  2.640          H  
ATOM    215 1HG  GLU A  15       5.452   3.498 -10.148  1.00  2.640          H  
ATOM    216 2HG  GLU A  15       5.101   1.788  -9.870  1.00  2.640          H  
ATOM    217  N   ASN A  16       8.704   1.289  -6.979  1.00  1.720          N  
ATOM    218  CA  ASN A  16       9.625   1.025  -5.899  1.00  2.060          C  
ATOM    219  C   ASN A  16      11.062   1.253  -6.412  1.00  1.890          C  
ATOM    220  O   ASN A  16      11.832   2.069  -5.877  1.00  1.920          O  
ATOM    221  CB  ASN A  16       9.392  -0.425  -5.449  1.00  2.750          C  
ATOM    222  CG  ASN A  16      10.205  -0.869  -4.310  1.00  2.750          C  
ATOM    223  OD1 ASN A  16      11.200  -0.236  -4.033  1.00  2.750          O  
ATOM    224  ND2 ASN A  16       9.820  -1.931  -3.665  1.00  2.750          N  
ATOM    225  H   ASN A  16       7.989   0.590  -7.197  1.00  2.060          H  
ATOM    226  HA  ASN A  16       9.426   1.715  -5.078  1.00  2.470          H  
ATOM    227 1HB  ASN A  16       8.337  -0.547  -5.189  1.00  3.300          H  
ATOM    228 2HB  ASN A  16       9.587  -1.092  -6.289  1.00  3.300          H  
ATOM    229 1HD2 ASN A  16      10.350  -2.269  -2.885  1.00  3.300          H  
ATOM    230 2HD2 ASN A  16       8.990  -2.410  -3.946  1.00  3.300          H  
ATOM    231  N   LYS A  17      11.405   0.585  -7.518  1.00  1.850          N  
ATOM    232  CA  LYS A  17      12.742   0.707  -8.079  1.00  1.970          C  
ATOM    233  C   LYS A  17      13.086   2.155  -8.444  1.00  1.920          C  
ATOM    234  O   LYS A  17      14.210   2.599  -8.198  1.00  2.170          O  
ATOM    235  CB  LYS A  17      12.910  -0.232  -9.261  1.00  2.710          C  
ATOM    236  CG  LYS A  17      14.307  -0.277  -9.817  1.00  2.710          C  
ATOM    237  CD  LYS A  17      14.427  -1.372 -10.864  1.00  2.710          C  
ATOM    238  CE  LYS A  17      15.800  -1.391 -11.517  1.00  2.710          C  
ATOM    239  NZ  LYS A  17      16.888  -1.697 -10.527  1.00  2.710          N  
ATOM    240  H   LYS A  17      10.742  -0.044  -7.941  1.00  2.220          H  
ATOM    241  HA  LYS A  17      13.459   0.393  -7.336  1.00  2.360          H  
ATOM    242 1HB  LYS A  17      12.611  -1.243  -8.978  1.00  3.250          H  
ATOM    243 2HB  LYS A  17      12.257   0.095 -10.073  1.00  3.250          H  
ATOM    244 1HG  LYS A  17      14.545   0.686 -10.276  1.00  3.250          H  
ATOM    245 2HG  LYS A  17      15.005  -0.459  -9.001  1.00  3.250          H  
ATOM    246 1HD  LYS A  17      14.262  -2.340 -10.388  1.00  3.250          H  
ATOM    247 2HD  LYS A  17      13.659  -1.230 -11.631  1.00  3.250          H  
ATOM    248 1HE  LYS A  17      15.804  -2.158 -12.289  1.00  3.250          H  
ATOM    249 2HE  LYS A  17      15.999  -0.424 -11.977  1.00  3.250          H  
ATOM    250 1HZ  LYS A  17      17.778  -1.719 -10.998  1.00  3.250          H  
ATOM    251 2HZ  LYS A  17      16.912  -0.993  -9.809  1.00  3.250          H  
ATOM    252 3HZ  LYS A  17      16.719  -2.620 -10.079  1.00  3.250          H  
ATOM    253  N   SER A  18      12.143   2.891  -9.035  1.00  1.800          N  
ATOM    254  CA  SER A  18      12.399   4.287  -9.380  1.00  1.980          C  
ATOM    255  C   SER A  18      12.413   5.287  -8.208  1.00  1.920          C  
ATOM    256  O   SER A  18      13.231   6.211  -8.203  1.00  2.230          O  
ATOM    257  CB  SER A  18      11.372   4.770 -10.390  1.00  2.700          C  
ATOM    258  OG  SER A  18      11.525   4.132 -11.629  1.00  2.700          O  
ATOM    259  H   SER A  18      11.247   2.472  -9.310  1.00  2.160          H  
ATOM    260  HA  SER A  18      13.378   4.325  -9.857  1.00  2.380          H  
ATOM    261 1HB  SER A  18      10.373   4.564  -9.999  1.00  3.240          H  
ATOM    262 2HB  SER A  18      11.457   5.849 -10.512  1.00  3.240          H  
ATOM    263  HG  SER A  18      10.818   4.466 -12.185  1.00  3.240          H  
ATOM    264  N   HIS A  19      11.519   5.134  -7.217  1.00  1.660          N  
ATOM    265  CA  HIS A  19      11.403   6.141  -6.156  1.00  1.710          C  
ATOM    266  C   HIS A  19      11.711   5.743  -4.694  1.00  1.650          C  
ATOM    267  O   HIS A  19      11.751   6.619  -3.830  1.00  1.820          O  
ATOM    268  CB  HIS A  19       9.980   6.696  -6.201  1.00  2.370          C  
ATOM    269  CG  HIS A  19       9.636   7.333  -7.517  1.00  2.370          C  
ATOM    270  ND1 HIS A  19      10.151   8.549  -7.924  1.00  2.370          N  
ATOM    271  CD2 HIS A  19       8.841   6.902  -8.524  1.00  2.370          C  
ATOM    272  CE1 HIS A  19       9.677   8.841  -9.125  1.00  2.370          C  
ATOM    273  NE2 HIS A  19       8.881   7.858  -9.512  1.00  2.370          N  
ATOM    274  H   HIS A  19      10.846   4.370  -7.259  1.00  1.990          H  
ATOM    275  HA  HIS A  19      12.080   6.957  -6.395  1.00  2.050          H  
ATOM    276 1HB  HIS A  19       9.272   5.884  -6.019  1.00  2.850          H  
ATOM    277 2HB  HIS A  19       9.847   7.434  -5.413  1.00  2.850          H  
ATOM    278  HD1 HIS A  19      10.922   9.030  -7.503  1.00  2.850          H  
ATOM    279  HD2 HIS A  19       8.240   5.997  -8.652  1.00  2.850          H  
ATOM    280  HE1 HIS A  19       9.964   9.766  -9.624  1.00  2.850          H  
ATOM    281  N   PHE A  20      11.898   4.460  -4.377  1.00  1.550          N  
ATOM    282  CA  PHE A  20      12.134   4.031  -2.993  1.00  1.610          C  
ATOM    283  C   PHE A  20      13.594   3.537  -2.870  1.00  1.430          C  
ATOM    284  O   PHE A  20      14.319   3.866  -1.909  1.00  1.390          O  
ATOM    285  CB  PHE A  20      11.030   3.016  -2.631  1.00  2.230          C  
ATOM    286  CG  PHE A  20      10.929   2.495  -1.232  1.00  2.230          C  
ATOM    287  CD1 PHE A  20      11.119   3.317  -0.132  1.00  2.230          C  
ATOM    288  CD2 PHE A  20      10.536   1.176  -1.010  1.00  2.230          C  
ATOM    289  CE1 PHE A  20      10.967   2.827   1.132  1.00  2.230          C  
ATOM    290  CE2 PHE A  20      10.375   0.692   0.258  1.00  2.230          C  
ATOM    291  CZ  PHE A  20      10.598   1.525   1.328  1.00  2.230          C  
ATOM    292  H   PHE A  20      11.857   3.730  -5.084  1.00  1.860          H  
ATOM    293  HA  PHE A  20      12.021   4.896  -2.342  1.00  1.930          H  
ATOM    294 1HB  PHE A  20      10.065   3.448  -2.890  1.00  2.680          H  
ATOM    295 2HB  PHE A  20      11.161   2.158  -3.275  1.00  2.680          H  
ATOM    296  HD1 PHE A  20      11.399   4.361  -0.265  1.00  2.680          H  
ATOM    297  HD2 PHE A  20      10.351   0.532  -1.852  1.00  2.680          H  
ATOM    298  HE1 PHE A  20      11.128   3.478   1.989  1.00  2.680          H  
ATOM    299  HE2 PHE A  20      10.070  -0.344   0.420  1.00  2.680          H  
ATOM    300  HZ  PHE A  20      10.473   1.169   2.334  1.00  2.680          H  
ATOM    301  N   ILE A  21      14.061   2.875  -3.937  1.00  1.420          N  
ATOM    302  CA  ILE A  21      15.417   2.330  -4.015  1.00  1.360          C  
ATOM    303  C   ILE A  21      16.451   3.406  -3.819  1.00  1.270          C  
ATOM    304  O   ILE A  21      17.487   3.147  -3.229  1.00  1.190          O  
ATOM    305  CB  ILE A  21      15.690   1.551  -5.316  1.00  1.930          C  
ATOM    306  CG1 ILE A  21      15.430   0.037  -5.097  1.00  1.930          C  
ATOM    307  CG2 ILE A  21      17.126   1.781  -5.841  1.00  1.930          C  
ATOM    308  CD1 ILE A  21      14.093  -0.315  -4.572  1.00  1.930          C  
ATOM    309  H   ILE A  21      13.403   2.662  -4.692  1.00  1.700          H  
ATOM    310  HA  ILE A  21      15.547   1.622  -3.207  1.00  1.630          H  
ATOM    311  HB  ILE A  21      14.991   1.881  -6.059  1.00  2.310          H  
ATOM    312 1HG1 ILE A  21      15.572  -0.476  -6.046  1.00  2.310          H  
ATOM    313 2HG1 ILE A  21      16.155  -0.336  -4.392  1.00  2.310          H  
ATOM    314 1HG2 ILE A  21      17.263   1.215  -6.761  1.00  2.310          H  
ATOM    315 2HG2 ILE A  21      17.310   2.827  -6.056  1.00  2.310          H  
ATOM    316 3HG2 ILE A  21      17.837   1.443  -5.107  1.00  2.310          H  
ATOM    317 1HD1 ILE A  21      14.026  -1.387  -4.463  1.00  2.310          H  
ATOM    318 2HD1 ILE A  21      13.922   0.145  -3.615  1.00  2.310          H  
ATOM    319 3HD1 ILE A  21      13.343   0.009  -5.238  1.00  2.310          H  
ATOM    320  N   GLU A  22      16.232   4.610  -4.324  1.00  1.380          N  
ATOM    321  CA  GLU A  22      17.230   5.659  -4.157  1.00  1.430          C  
ATOM    322  C   GLU A  22      17.745   5.769  -2.712  1.00  1.310          C  
ATOM    323  O   GLU A  22      18.951   5.975  -2.511  1.00  1.330          O  
ATOM    324  CB  GLU A  22      16.666   7.016  -4.586  1.00  1.980          C  
ATOM    325  CG  GLU A  22      17.684   8.164  -4.503  1.00  1.980          C  
ATOM    326  CD  GLU A  22      17.150   9.480  -4.984  1.00  1.980          C  
ATOM    327  OE1 GLU A  22      16.014   9.532  -5.379  1.00  1.980          O  
ATOM    328  OE2 GLU A  22      17.884  10.438  -4.957  1.00  1.980          O  
ATOM    329  H   GLU A  22      15.372   4.795  -4.822  1.00  1.660          H  
ATOM    330  HA  GLU A  22      18.078   5.423  -4.799  1.00  1.720          H  
ATOM    331 1HB  GLU A  22      16.300   6.952  -5.611  1.00  2.380          H  
ATOM    332 2HB  GLU A  22      15.817   7.272  -3.948  1.00  2.380          H  
ATOM    333 1HG  GLU A  22      17.993   8.288  -3.465  1.00  2.380          H  
ATOM    334 2HG  GLU A  22      18.566   7.897  -5.084  1.00  2.380          H  
ATOM    335  N   ASP A  23      16.868   5.614  -1.701  1.00  1.320          N  
ATOM    336  CA  ASP A  23      17.336   5.771  -0.331  1.00  1.390          C  
ATOM    337  C   ASP A  23      18.010   4.505   0.144  1.00  1.260          C  
ATOM    338  O   ASP A  23      19.021   4.563   0.853  1.00  1.400          O  
ATOM    339  CB  ASP A  23      16.183   6.116   0.603  1.00  1.920          C  
ATOM    340  CG  ASP A  23      15.623   7.501   0.361  1.00  1.920          C  
ATOM    341  OD1 ASP A  23      16.351   8.455   0.511  1.00  1.920          O  
ATOM    342  OD2 ASP A  23      14.475   7.602   0.023  1.00  1.920          O  
ATOM    343  H   ASP A  23      15.886   5.382  -1.875  1.00  1.580          H  
ATOM    344  HA  ASP A  23      18.062   6.583  -0.302  1.00  1.670          H  
ATOM    345 1HB  ASP A  23      15.380   5.386   0.460  1.00  2.300          H  
ATOM    346 2HB  ASP A  23      16.514   6.042   1.635  1.00  2.300          H  
ATOM    347  N   PHE A  24      17.513   3.351  -0.296  1.00  1.130          N  
ATOM    348  CA  PHE A  24      18.164   2.109   0.115  1.00  1.210          C  
ATOM    349  C   PHE A  24      19.550   2.042  -0.488  1.00  1.130          C  
ATOM    350  O   PHE A  24      20.499   1.605   0.151  1.00  1.280          O  
ATOM    351  CB  PHE A  24      17.402   0.881  -0.348  1.00  1.660          C  
ATOM    352  CG  PHE A  24      16.194   0.646   0.382  1.00  1.660          C  
ATOM    353  CD1 PHE A  24      15.030   1.070  -0.132  1.00  1.660          C  
ATOM    354  CD2 PHE A  24      16.198  -0.000   1.600  1.00  1.660          C  
ATOM    355  CE1 PHE A  24      13.909   0.886   0.509  1.00  1.660          C  
ATOM    356  CE2 PHE A  24      15.020  -0.197   2.270  1.00  1.660          C  
ATOM    357  CZ  PHE A  24      13.876   0.259   1.711  1.00  1.660          C  
ATOM    358  H   PHE A  24      16.648   3.363  -0.853  1.00  1.360          H  
ATOM    359  HA  PHE A  24      18.250   2.098   1.201  1.00  1.450          H  
ATOM    360 1HB  PHE A  24      17.146   0.985  -1.398  1.00  1.990          H  
ATOM    361 2HB  PHE A  24      18.032   0.011  -0.242  1.00  1.990          H  
ATOM    362  HD1 PHE A  24      15.012   1.578  -1.080  1.00  1.990          H  
ATOM    363  HD2 PHE A  24      17.141  -0.355   2.026  1.00  1.990          H  
ATOM    364  HE1 PHE A  24      13.027   1.240   0.061  1.00  1.990          H  
ATOM    365  HE2 PHE A  24      15.000  -0.707   3.236  1.00  1.990          H  
ATOM    366  HZ  PHE A  24      12.937   0.124   2.201  1.00  1.990          H  
ATOM    367  N   CYS A  25      19.663   2.474  -1.735  1.00  1.050          N  
ATOM    368  CA  CYS A  25      20.902   2.455  -2.481  1.00  1.150          C  
ATOM    369  C   CYS A  25      21.945   3.304  -1.783  1.00  1.190          C  
ATOM    370  O   CYS A  25      23.084   2.866  -1.606  1.00  1.330          O  
ATOM    371  CB  CYS A  25      20.667   2.978  -3.891  1.00  1.570          C  
ATOM    372  SG  CYS A  25      22.108   2.964  -4.933  1.00  1.570          S  
ATOM    373  H   CYS A  25      18.831   2.834  -2.187  1.00  1.260          H  
ATOM    374  HA  CYS A  25      21.261   1.429  -2.546  1.00  1.380          H  
ATOM    375 1HB  CYS A  25      19.901   2.375  -4.366  1.00  1.880          H  
ATOM    376 2HB  CYS A  25      20.289   3.997  -3.844  1.00  1.880          H  
ATOM    377  HG  CYS A  25      22.438   1.684  -4.725  1.00  1.880          H  
ATOM    378  N   TRP A  26      21.573   4.522  -1.380  1.00  1.200          N  
ATOM    379  CA  TRP A  26      22.516   5.385  -0.693  1.00  1.370          C  
ATOM    380  C   TRP A  26      22.990   4.781   0.625  1.00  1.410          C  
ATOM    381  O   TRP A  26      24.196   4.753   0.897  1.00  1.540          O  
ATOM    382  CB  TRP A  26      21.906   6.762  -0.439  1.00  1.850          C  
ATOM    383  CG  TRP A  26      22.837   7.701   0.279  1.00  1.850          C  
ATOM    384  CD1 TRP A  26      23.791   8.477  -0.298  1.00  1.850          C  
ATOM    385  CD2 TRP A  26      22.898   7.986   1.701  1.00  1.850          C  
ATOM    386  NE1 TRP A  26      24.442   9.211   0.656  1.00  1.850          N  
ATOM    387  CE2 TRP A  26      23.907   8.924   1.884  1.00  1.850          C  
ATOM    388  CE3 TRP A  26      22.189   7.528   2.805  1.00  1.850          C  
ATOM    389  CZ2 TRP A  26      24.226   9.421   3.135  1.00  1.850          C  
ATOM    390  CZ3 TRP A  26      22.501   8.017   4.059  1.00  1.850          C  
ATOM    391  CH2 TRP A  26      23.497   8.941   4.222  1.00  1.850          C  
ATOM    392  H   TRP A  26      20.630   4.866  -1.598  1.00  1.440          H  
ATOM    393  HA  TRP A  26      23.384   5.514  -1.337  1.00  1.640          H  
ATOM    394 1HB  TRP A  26      21.622   7.212  -1.391  1.00  2.220          H  
ATOM    395 2HB  TRP A  26      20.991   6.651   0.149  1.00  2.220          H  
ATOM    396  HD1 TRP A  26      24.007   8.508  -1.364  1.00  2.220          H  
ATOM    397  HE1 TRP A  26      25.194   9.862   0.482  1.00  2.220          H  
ATOM    398  HE3 TRP A  26      21.404   6.811   2.675  1.00  2.220          H  
ATOM    399  HZ2 TRP A  26      25.016  10.158   3.282  1.00  2.220          H  
ATOM    400  HZ3 TRP A  26      21.935   7.650   4.913  1.00  2.220          H  
ATOM    401  HH2 TRP A  26      23.720   9.309   5.223  1.00  2.220          H  
ATOM    402  N   LYS A  27      22.050   4.300   1.456  1.00  1.370          N  
ATOM    403  CA  LYS A  27      22.425   3.743   2.754  1.00  1.530          C  
ATOM    404  C   LYS A  27      23.290   2.500   2.583  1.00  1.500          C  
ATOM    405  O   LYS A  27      24.251   2.266   3.326  1.00  1.710          O  
ATOM    406  CB  LYS A  27      21.167   3.377   3.550  1.00  2.080          C  
ATOM    407  CG  LYS A  27      20.356   4.558   4.043  1.00  2.080          C  
ATOM    408  CD  LYS A  27      19.115   4.116   4.789  1.00  2.080          C  
ATOM    409  CE  LYS A  27      18.301   5.320   5.255  1.00  2.080          C  
ATOM    410  NZ  LYS A  27      17.052   4.915   5.960  1.00  2.080          N  
ATOM    411  H   LYS A  27      21.061   4.340   1.183  1.00  1.640          H  
ATOM    412  HA  LYS A  27      22.998   4.488   3.300  1.00  1.840          H  
ATOM    413 1HB  LYS A  27      20.511   2.770   2.919  1.00  2.490          H  
ATOM    414 2HB  LYS A  27      21.446   2.771   4.412  1.00  2.490          H  
ATOM    415 1HG  LYS A  27      20.969   5.184   4.688  1.00  2.490          H  
ATOM    416 2HG  LYS A  27      20.035   5.142   3.187  1.00  2.490          H  
ATOM    417 1HD  LYS A  27      18.496   3.506   4.125  1.00  2.490          H  
ATOM    418 2HD  LYS A  27      19.396   3.515   5.653  1.00  2.490          H  
ATOM    419 1HE  LYS A  27      18.910   5.919   5.930  1.00  2.490          H  
ATOM    420 2HE  LYS A  27      18.036   5.925   4.386  1.00  2.490          H  
ATOM    421 1HZ  LYS A  27      16.546   5.741   6.249  1.00  2.490          H  
ATOM    422 2HZ  LYS A  27      16.475   4.368   5.335  1.00  2.490          H  
ATOM    423 3HZ  LYS A  27      17.284   4.362   6.773  1.00  2.490          H  
ATOM    424  N   LEU A  28      22.933   1.679   1.619  1.00  1.330          N  
ATOM    425  CA  LEU A  28      23.596   0.436   1.330  1.00  1.380          C  
ATOM    426  C   LEU A  28      25.007   0.640   0.836  1.00  1.330          C  
ATOM    427  O   LEU A  28      25.927  -0.043   1.292  1.00  1.460          O  
ATOM    428  CB  LEU A  28      22.734  -0.275   0.325  1.00  1.910          C  
ATOM    429  CG  LEU A  28      23.084  -1.574  -0.188  1.00  1.910          C  
ATOM    430  CD1 LEU A  28      23.190  -2.602   0.914  1.00  1.910          C  
ATOM    431  CD2 LEU A  28      21.979  -1.891  -1.111  1.00  1.910          C  
ATOM    432  H   LEU A  28      22.116   1.907   1.040  1.00  1.600          H  
ATOM    433  HA  LEU A  28      23.640  -0.142   2.248  1.00  1.660          H  
ATOM    434 1HB  LEU A  28      21.749  -0.382   0.768  1.00  2.290          H  
ATOM    435 2HB  LEU A  28      22.639   0.385  -0.538  1.00  2.290          H  
ATOM    436  HG  LEU A  28      24.030  -1.539  -0.726  1.00  2.290          H  
ATOM    437 1HD1 LEU A  28      23.407  -3.570   0.478  1.00  2.290          H  
ATOM    438 2HD1 LEU A  28      23.987  -2.339   1.605  1.00  2.290          H  
ATOM    439 3HD1 LEU A  28      22.246  -2.647   1.446  1.00  2.290          H  
ATOM    440 1HD2 LEU A  28      22.118  -2.830  -1.555  1.00  2.290          H  
ATOM    441 2HD2 LEU A  28      21.038  -1.902  -0.557  1.00  2.290          H  
ATOM    442 3HD2 LEU A  28      21.944  -1.126  -1.869  1.00  2.290          H  
ATOM    443  N   HIS A  29      25.201   1.596  -0.072  1.00  1.290          N  
ATOM    444  CA  HIS A  29      26.537   1.857  -0.559  1.00  1.410          C  
ATOM    445  C   HIS A  29      27.377   2.501   0.554  1.00  1.470          C  
ATOM    446  O   HIS A  29      28.551   2.170   0.717  1.00  1.570          O  
ATOM    447  CB  HIS A  29      26.496   2.724  -1.813  1.00  1.930          C  
ATOM    448  CG  HIS A  29      25.931   2.000  -3.021  1.00  1.930          C  
ATOM    449  ND1 HIS A  29      25.821   2.601  -4.254  1.00  1.930          N  
ATOM    450  CD2 HIS A  29      25.428   0.744  -3.166  1.00  1.930          C  
ATOM    451  CE1 HIS A  29      25.295   1.746  -5.114  1.00  1.930          C  
ATOM    452  NE2 HIS A  29      25.040   0.613  -4.485  1.00  1.930          N  
ATOM    453  H   HIS A  29      24.411   2.121  -0.462  1.00  1.550          H  
ATOM    454  HA  HIS A  29      27.015   0.917  -0.833  1.00  1.690          H  
ATOM    455 1HB  HIS A  29      25.868   3.601  -1.622  1.00  2.310          H  
ATOM    456 2HB  HIS A  29      27.496   3.076  -2.052  1.00  2.310          H  
ATOM    457  HD1 HIS A  29      25.842   3.588  -4.414  1.00  2.310          H  
ATOM    458  HD2 HIS A  29      25.298  -0.087  -2.470  1.00  2.310          H  
ATOM    459  HE1 HIS A  29      25.127   2.039  -6.150  1.00  2.310          H  
ATOM    460  N   ARG A  30      26.775   3.373   1.380  1.00  1.540          N  
ATOM    461  CA  ARG A  30      27.485   4.015   2.493  1.00  1.770          C  
ATOM    462  C   ARG A  30      28.069   2.958   3.439  1.00  1.850          C  
ATOM    463  O   ARG A  30      29.181   3.102   3.952  1.00  2.080          O  
ATOM    464  CB  ARG A  30      26.563   4.957   3.254  1.00  2.390          C  
ATOM    465  CG  ARG A  30      27.230   5.757   4.364  1.00  2.390          C  
ATOM    466  CD  ARG A  30      26.289   6.729   4.972  1.00  2.390          C  
ATOM    467  NE  ARG A  30      25.188   6.090   5.712  1.00  2.390          N  
ATOM    468  CZ  ARG A  30      25.260   5.640   6.991  1.00  2.390          C  
ATOM    469  NH1 ARG A  30      26.380   5.750   7.681  1.00  2.390          N  
ATOM    470  NH2 ARG A  30      24.197   5.090   7.559  1.00  2.390          N  
ATOM    471  H   ARG A  30      25.804   3.654   1.208  1.00  1.850          H  
ATOM    472  HA  ARG A  30      28.304   4.603   2.083  1.00  2.120          H  
ATOM    473 1HB  ARG A  30      26.103   5.659   2.558  1.00  2.860          H  
ATOM    474 2HB  ARG A  30      25.758   4.379   3.705  1.00  2.860          H  
ATOM    475 1HG  ARG A  30      27.576   5.075   5.139  1.00  2.860          H  
ATOM    476 2HG  ARG A  30      28.080   6.304   3.957  1.00  2.860          H  
ATOM    477 1HD  ARG A  30      26.820   7.401   5.642  1.00  2.860          H  
ATOM    478 2HD  ARG A  30      25.857   7.305   4.167  1.00  2.860          H  
ATOM    479  HE  ARG A  30      24.303   5.977   5.230  1.00  2.860          H  
ATOM    480 1HH1 ARG A  30      27.198   6.167   7.265  1.00  2.860          H  
ATOM    481 2HH1 ARG A  30      26.421   5.414   8.634  1.00  2.860          H  
ATOM    482 1HH2 ARG A  30      23.333   5.004   7.043  1.00  2.860          H  
ATOM    483 2HH2 ARG A  30      24.246   4.758   8.513  1.00  2.860          H  
ATOM    484  N   ARG A  31      27.307   1.880   3.632  1.00  1.720          N  
ATOM    485  CA  ARG A  31      27.651   0.730   4.468  1.00  1.900          C  
ATOM    486  C   ARG A  31      28.563  -0.299   3.768  1.00  1.860          C  
ATOM    487  O   ARG A  31      28.849  -1.353   4.342  1.00  2.070          O  
ATOM    488  CB  ARG A  31      26.389   0.033   4.954  1.00  2.590          C  
ATOM    489  CG  ARG A  31      25.548   0.846   5.936  1.00  2.590          C  
ATOM    490  CD  ARG A  31      24.284   0.150   6.302  1.00  2.590          C  
ATOM    491  NE  ARG A  31      23.339   0.054   5.179  1.00  2.590          N  
ATOM    492  CZ  ARG A  31      22.231  -0.740   5.173  1.00  2.590          C  
ATOM    493  NH1 ARG A  31      21.953  -1.495   6.220  1.00  2.590          N  
ATOM    494  NH2 ARG A  31      21.420  -0.768   4.130  1.00  2.590          N  
ATOM    495  H   ARG A  31      26.374   1.897   3.208  1.00  2.060          H  
ATOM    496  HA  ARG A  31      28.180   1.106   5.341  1.00  2.280          H  
ATOM    497 1HB  ARG A  31      25.761  -0.200   4.094  1.00  3.110          H  
ATOM    498 2HB  ARG A  31      26.649  -0.907   5.436  1.00  3.110          H  
ATOM    499 1HG  ARG A  31      26.123   0.999   6.847  1.00  3.110          H  
ATOM    500 2HG  ARG A  31      25.305   1.812   5.506  1.00  3.110          H  
ATOM    501 1HD  ARG A  31      24.528  -0.856   6.634  1.00  3.110          H  
ATOM    502 2HD  ARG A  31      23.798   0.696   7.109  1.00  3.110          H  
ATOM    503  HE  ARG A  31      23.532   0.635   4.351  1.00  3.110          H  
ATOM    504 1HH1 ARG A  31      22.556  -1.489   7.029  1.00  3.110          H  
ATOM    505 2HH1 ARG A  31      21.129  -2.082   6.216  1.00  3.110          H  
ATOM    506 1HH2 ARG A  31      21.600  -0.206   3.316  1.00  3.110          H  
ATOM    507 2HH2 ARG A  31      20.598  -1.363   4.140  1.00  3.110          H  
ATOM    508  N   GLU A  32      29.009   0.015   2.541  1.00  1.820          N  
ATOM    509  CA  GLU A  32      29.859  -0.797   1.663  1.00  2.040          C  
ATOM    510  C   GLU A  32      29.206  -2.060   1.093  1.00  1.820          C  
ATOM    511  O   GLU A  32      29.875  -3.080   0.898  1.00  2.170          O  
ATOM    512  CB  GLU A  32      31.158  -1.211   2.387  1.00  2.770          C  
ATOM    513  CG  GLU A  32      32.053  -0.055   2.853  1.00  2.770          C  
ATOM    514  CD  GLU A  32      33.338  -0.538   3.509  1.00  2.770          C  
ATOM    515  OE1 GLU A  32      33.390  -1.687   3.872  1.00  2.770          O  
ATOM    516  OE2 GLU A  32      34.256   0.241   3.638  1.00  2.770          O  
ATOM    517  H   GLU A  32      28.724   0.907   2.133  1.00  2.180          H  
ATOM    518  HA  GLU A  32      30.133  -0.166   0.817  1.00  2.450          H  
ATOM    519 1HB  GLU A  32      30.937  -1.841   3.240  1.00  3.320          H  
ATOM    520 2HB  GLU A  32      31.759  -1.811   1.706  1.00  3.320          H  
ATOM    521 1HG  GLU A  32      32.302   0.565   1.995  1.00  3.320          H  
ATOM    522 2HG  GLU A  32      31.495   0.559   3.560  1.00  3.320          H  
ATOM    523  N   GLY A  33      27.916  -1.979   0.769  1.00  1.740          N  
ATOM    524  CA  GLY A  33      27.204  -3.054   0.102  1.00  1.940          C  
ATOM    525  C   GLY A  33      27.060  -2.703  -1.378  1.00  1.820          C  
ATOM    526  O   GLY A  33      27.823  -1.897  -1.914  1.00  2.030          O  
ATOM    527  H   GLY A  33      27.383  -1.134   0.976  1.00  2.090          H  
ATOM    528 1HA  GLY A  33      27.744  -3.992   0.218  1.00  2.330          H  
ATOM    529 2HA  GLY A  33      26.221  -3.176   0.552  1.00  2.330          H  
ATOM    530  N   ALA A  34      26.060  -3.286  -2.026  1.00  1.700          N  
ATOM    531  CA  ALA A  34      25.792  -3.050  -3.442  1.00  1.720          C  
ATOM    532  C   ALA A  34      24.294  -3.079  -3.634  1.00  1.420          C  
ATOM    533  O   ALA A  34      23.630  -3.857  -2.935  1.00  1.210          O  
ATOM    534  CB  ALA A  34      26.468  -4.097  -4.306  1.00  2.400          C  
ATOM    535  H   ALA A  34      25.486  -3.953  -1.533  1.00  2.040          H  
ATOM    536  HA  ALA A  34      26.162  -2.060  -3.716  1.00  2.060          H  
ATOM    537 1HB  ALA A  34      26.251  -3.903  -5.356  1.00  2.880          H  
ATOM    538 2HB  ALA A  34      27.547  -4.055  -4.145  1.00  2.880          H  
ATOM    539 3HB  ALA A  34      26.100  -5.087  -4.039  1.00  2.880          H  
ATOM    540  N   CYS A  35      23.790  -2.342  -4.649  1.00  1.590          N  
ATOM    541  CA  CYS A  35      22.356  -2.153  -4.894  1.00  1.510          C  
ATOM    542  C   CYS A  35      21.647  -3.471  -5.207  1.00  1.410          C  
ATOM    543  O   CYS A  35      20.423  -3.541  -5.250  1.00  1.410          O  
ATOM    544  CB  CYS A  35      22.120  -1.150  -6.028  1.00  2.150          C  
ATOM    545  SG  CYS A  35      20.510  -0.184  -5.960  1.00  2.150          S  
ATOM    546  H   CYS A  35      24.447  -1.792  -5.193  1.00  1.910          H  
ATOM    547  HA  CYS A  35      21.916  -1.732  -3.995  1.00  1.810          H  
ATOM    548 1HB  CYS A  35      22.939  -0.431  -6.043  1.00  2.580          H  
ATOM    549 2HB  CYS A  35      22.145  -1.677  -6.980  1.00  2.580          H  
ATOM    550  N   VAL A  36      22.344  -4.580  -5.348  1.00  1.560          N  
ATOM    551  CA  VAL A  36      21.565  -5.797  -5.500  1.00  1.820          C  
ATOM    552  C   VAL A  36      20.645  -5.911  -4.266  1.00  1.680          C  
ATOM    553  O   VAL A  36      19.507  -6.388  -4.350  1.00  1.980          O  
ATOM    554  CB  VAL A  36      22.477  -7.038  -5.635  1.00  2.440          C  
ATOM    555  CG1 VAL A  36      23.230  -7.346  -4.307  1.00  2.440          C  
ATOM    556  CG2 VAL A  36      21.619  -8.241  -6.047  1.00  2.440          C  
ATOM    557  H   VAL A  36      23.352  -4.568  -5.335  1.00  1.870          H  
ATOM    558  HA  VAL A  36      20.949  -5.715  -6.395  1.00  2.180          H  
ATOM    559  HB  VAL A  36      23.225  -6.833  -6.398  1.00  2.930          H  
ATOM    560 1HG1 VAL A  36      23.875  -8.208  -4.456  1.00  2.930          H  
ATOM    561 2HG1 VAL A  36      23.838  -6.491  -4.014  1.00  2.930          H  
ATOM    562 3HG1 VAL A  36      22.526  -7.580  -3.516  1.00  2.930          H  
ATOM    563 1HG2 VAL A  36      22.255  -9.113  -6.173  1.00  2.930          H  
ATOM    564 2HG2 VAL A  36      20.870  -8.447  -5.277  1.00  2.930          H  
ATOM    565 3HG2 VAL A  36      21.112  -8.020  -6.989  1.00  2.930          H  
ATOM    566  N   ASN A  37      21.124  -5.425  -3.112  1.00  1.430          N  
ATOM    567  CA  ASN A  37      20.341  -5.508  -1.920  1.00  1.560          C  
ATOM    568  C   ASN A  37      19.431  -4.306  -1.723  1.00  1.330          C  
ATOM    569  O   ASN A  37      18.669  -4.283  -0.764  1.00  1.330          O  
ATOM    570  CB  ASN A  37      21.253  -5.686  -0.727  1.00  2.130          C  
ATOM    571  CG  ASN A  37      21.897  -7.026  -0.677  1.00  2.130          C  
ATOM    572  OD1 ASN A  37      21.283  -8.047  -0.967  1.00  2.130          O  
ATOM    573  ND2 ASN A  37      23.154  -7.055  -0.322  1.00  2.130          N  
ATOM    574  H   ASN A  37      22.060  -5.006  -3.068  1.00  1.720          H  
ATOM    575  HA  ASN A  37      19.716  -6.389  -2.002  1.00  1.870          H  
ATOM    576 1HB  ASN A  37      22.034  -4.948  -0.769  1.00  2.560          H  
ATOM    577 2HB  ASN A  37      20.695  -5.525   0.185  1.00  2.560          H  
ATOM    578 1HD2 ASN A  37      23.636  -7.929  -0.278  1.00  2.560          H  
ATOM    579 2HD2 ASN A  37      23.631  -6.210  -0.104  1.00  2.560          H  
ATOM    580  N   CYS A  38      19.436  -3.321  -2.634  1.00  1.200          N  
ATOM    581  CA  CYS A  38      18.547  -2.187  -2.445  1.00  1.060          C  
ATOM    582  C   CYS A  38      17.180  -2.663  -2.859  1.00  1.010          C  
ATOM    583  O   CYS A  38      16.169  -2.327  -2.241  1.00  1.020          O  
ATOM    584  CB  CYS A  38      18.981  -0.966  -3.284  1.00  1.540          C  
ATOM    585  SG  CYS A  38      18.873  -1.201  -5.087  1.00  1.540          S  
ATOM    586  H   CYS A  38      20.005  -3.386  -3.467  1.00  1.440          H  
ATOM    587  HA  CYS A  38      18.533  -1.915  -1.393  1.00  1.270          H  
ATOM    588 1HB  CYS A  38      18.352  -0.121  -3.038  1.00  1.850          H  
ATOM    589 2HB  CYS A  38      19.987  -0.690  -3.037  1.00  1.850          H  
ATOM    590  N   GLU A  39      17.171  -3.584  -3.823  1.00  1.040          N  
ATOM    591  CA  GLU A  39      15.920  -4.168  -4.269  1.00  1.050          C  
ATOM    592  C   GLU A  39      15.427  -5.147  -3.213  1.00  1.010          C  
ATOM    593  O   GLU A  39      14.252  -5.135  -2.832  1.00  1.030          O  
ATOM    594  CB  GLU A  39      16.087  -4.884  -5.610  1.00  1.470          C  
ATOM    595  CG  GLU A  39      16.346  -3.981  -6.825  1.00  1.470          C  
ATOM    596  CD  GLU A  39      16.579  -4.781  -8.101  1.00  1.470          C  
ATOM    597  OE1 GLU A  39      16.867  -5.946  -7.996  1.00  1.470          O  
ATOM    598  OE2 GLU A  39      16.503  -4.218  -9.181  1.00  1.470          O  
ATOM    599  H   GLU A  39      18.063  -3.788  -4.293  1.00  1.250          H  
ATOM    600  HA  GLU A  39      15.184  -3.378  -4.380  1.00  1.260          H  
ATOM    601 1HB  GLU A  39      16.915  -5.593  -5.534  1.00  1.760          H  
ATOM    602 2HB  GLU A  39      15.192  -5.452  -5.815  1.00  1.760          H  
ATOM    603 1HG  GLU A  39      15.493  -3.318  -6.966  1.00  1.760          H  
ATOM    604 2HG  GLU A  39      17.221  -3.364  -6.620  1.00  1.760          H  
ATOM    605  N   MET A  40      16.350  -5.951  -2.680  1.00  1.050          N  
ATOM    606  CA  MET A  40      15.975  -6.973  -1.721  1.00  1.120          C  
ATOM    607  C   MET A  40      15.448  -6.343  -0.405  1.00  1.060          C  
ATOM    608  O   MET A  40      14.548  -6.900   0.261  1.00  1.080          O  
ATOM    609  CB  MET A  40      17.184  -7.853  -1.463  1.00  1.540          C  
ATOM    610  CG  MET A  40      17.666  -8.629  -2.722  1.00  1.540          C  
ATOM    611  SD  MET A  40      19.070  -9.705  -2.446  1.00  1.540          S  
ATOM    612  CE  MET A  40      18.327 -11.042  -1.497  1.00  1.540          C  
ATOM    613  H   MET A  40      17.310  -5.915  -3.038  1.00  1.260          H  
ATOM    614  HA  MET A  40      15.180  -7.579  -2.152  1.00  1.340          H  
ATOM    615 1HB  MET A  40      17.979  -7.294  -1.003  1.00  1.850          H  
ATOM    616 2HB  MET A  40      16.882  -8.602  -0.789  1.00  1.850          H  
ATOM    617 1HG  MET A  40      16.901  -9.184  -3.162  1.00  1.850          H  
ATOM    618 2HG  MET A  40      17.955  -7.909  -3.458  1.00  1.850          H  
ATOM    619 1HE  MET A  40      19.086 -11.782  -1.258  1.00  1.850          H  
ATOM    620 2HE  MET A  40      17.903 -10.659  -0.578  1.00  1.850          H  
ATOM    621 3HE  MET A  40      17.539 -11.514  -2.087  1.00  1.850          H  
ATOM    622  N   HIS A  41      16.056  -5.209   0.001  1.00  1.050          N  
ATOM    623  CA  HIS A  41      15.663  -4.502   1.217  1.00  1.080          C  
ATOM    624  C   HIS A  41      14.334  -3.778   1.030  1.00  1.000          C  
ATOM    625  O   HIS A  41      13.499  -3.749   1.946  1.00  1.040          O  
ATOM    626  CB  HIS A  41      16.727  -3.489   1.647  1.00  1.500          C  
ATOM    627  CG  HIS A  41      18.018  -4.086   2.167  1.00  1.500          C  
ATOM    628  ND1 HIS A  41      19.100  -3.300   2.543  1.00  1.500          N  
ATOM    629  CD2 HIS A  41      18.411  -5.376   2.358  1.00  1.500          C  
ATOM    630  CE1 HIS A  41      20.089  -4.081   2.946  1.00  1.500          C  
ATOM    631  NE2 HIS A  41      19.700  -5.339   2.845  1.00  1.500          N  
ATOM    632  H   HIS A  41      16.846  -4.833  -0.531  1.00  1.260          H  
ATOM    633  HA  HIS A  41      15.533  -5.220   2.026  1.00  1.300          H  
ATOM    634 1HB  HIS A  41      16.970  -2.850   0.793  1.00  1.800          H  
ATOM    635 2HB  HIS A  41      16.319  -2.856   2.422  1.00  1.800          H  
ATOM    636  HD2 HIS A  41      17.820  -6.274   2.160  1.00  1.800          H  
ATOM    637  HE1 HIS A  41      21.063  -3.749   3.299  1.00  1.800          H  
ATOM    638  HE2 HIS A  41      20.271  -6.138   3.085  1.00  1.800          H  
ATOM    639  N   ALA A  42      14.129  -3.167  -0.144  1.00  0.940          N  
ATOM    640  CA  ALA A  42      12.874  -2.494  -0.395  1.00  0.930          C  
ATOM    641  C   ALA A  42      11.733  -3.483  -0.330  1.00  0.870          C  
ATOM    642  O   ALA A  42      10.674  -3.177   0.221  1.00  0.890          O  
ATOM    643  CB  ALA A  42      12.912  -1.810  -1.721  1.00  1.310          C  
ATOM    644  H   ALA A  42      14.857  -3.131  -0.864  1.00  1.130          H  
ATOM    645  HA  ALA A  42      12.717  -1.758   0.382  1.00  1.120          H  
ATOM    646 1HB  ALA A  42      11.989  -1.293  -1.879  1.00  1.570          H  
ATOM    647 2HB  ALA A  42      13.732  -1.105  -1.717  1.00  1.570          H  
ATOM    648 3HB  ALA A  42      13.068  -2.548  -2.507  1.00  1.570          H  
ATOM    649  N   LEU A  43      11.945  -4.711  -0.821  1.00  0.850          N  
ATOM    650  CA  LEU A  43      10.857  -5.667  -0.754  1.00  0.830          C  
ATOM    651  C   LEU A  43      10.431  -5.950   0.678  1.00  0.820          C  
ATOM    652  O   LEU A  43       9.228  -6.045   0.948  1.00  0.830          O  
ATOM    653  CB  LEU A  43      11.205  -6.962  -1.463  1.00  1.170          C  
ATOM    654  CG  LEU A  43      11.282  -6.909  -2.996  1.00  1.170          C  
ATOM    655  CD1 LEU A  43      11.797  -8.178  -3.478  1.00  1.170          C  
ATOM    656  CD2 LEU A  43       9.935  -6.680  -3.586  1.00  1.170          C  
ATOM    657  H   LEU A  43      12.826  -4.933  -1.300  1.00  1.020          H  
ATOM    658  HA  LEU A  43      10.024  -5.229  -1.263  1.00  1.000          H  
ATOM    659 1HB  LEU A  43      12.182  -7.270  -1.103  1.00  1.400          H  
ATOM    660 2HB  LEU A  43      10.476  -7.721  -1.181  1.00  1.400          H  
ATOM    661  HG  LEU A  43      11.963  -6.119  -3.309  1.00  1.400          H  
ATOM    662 1HD1 LEU A  43      11.858  -8.137  -4.563  1.00  1.400          H  
ATOM    663 2HD1 LEU A  43      12.776  -8.315  -3.054  1.00  1.400          H  
ATOM    664 3HD1 LEU A  43      11.142  -8.994  -3.182  1.00  1.400          H  
ATOM    665 1HD2 LEU A  43      10.022  -6.680  -4.674  1.00  1.400          H  
ATOM    666 2HD2 LEU A  43       9.277  -7.478  -3.266  1.00  1.400          H  
ATOM    667 3HD2 LEU A  43       9.534  -5.737  -3.276  1.00  1.400          H  
ATOM    668  N   ASN A  44      11.376  -6.046   1.621  1.00  0.860          N  
ATOM    669  CA  ASN A  44      10.930  -6.246   2.999  1.00  0.930          C  
ATOM    670  C   ASN A  44      10.064  -5.072   3.478  1.00  0.940          C  
ATOM    671  O   ASN A  44       9.027  -5.275   4.128  1.00  0.940          O  
ATOM    672  CB  ASN A  44      12.104  -6.392   3.952  1.00  1.270          C  
ATOM    673  CG  ASN A  44      12.775  -7.704   3.893  1.00  1.270          C  
ATOM    674  OD1 ASN A  44      12.184  -8.679   3.458  1.00  1.270          O  
ATOM    675  ND2 ASN A  44      13.997  -7.746   4.333  1.00  1.270          N  
ATOM    676  H   ASN A  44      12.371  -6.045   1.353  1.00  1.030          H  
ATOM    677  HA  ASN A  44      10.316  -7.147   3.038  1.00  1.120          H  
ATOM    678 1HB  ASN A  44      12.841  -5.619   3.721  1.00  1.530          H  
ATOM    679 2HB  ASN A  44      11.764  -6.217   4.971  1.00  1.530          H  
ATOM    680 1HD2 ASN A  44      14.525  -8.619   4.325  1.00  1.530          H  
ATOM    681 2HD2 ASN A  44      14.432  -6.920   4.684  1.00  1.530          H  
ATOM    682  N   GLU A  45      10.453  -3.846   3.117  1.00  0.990          N  
ATOM    683  CA  GLU A  45       9.674  -2.686   3.547  1.00  1.080          C  
ATOM    684  C   GLU A  45       8.299  -2.568   2.876  1.00  1.020          C  
ATOM    685  O   GLU A  45       7.326  -2.168   3.537  1.00  1.090          O  
ATOM    686  CB  GLU A  45      10.473  -1.408   3.373  1.00  1.480          C  
ATOM    687  CG  GLU A  45      11.661  -1.270   4.335  1.00  1.480          C  
ATOM    688  CD  GLU A  45      11.260  -1.235   5.771  1.00  1.480          C  
ATOM    689  OE1 GLU A  45      10.351  -0.510   6.089  1.00  1.480          O  
ATOM    690  OE2 GLU A  45      11.857  -1.926   6.555  1.00  1.480          O  
ATOM    691  H   GLU A  45      11.341  -3.737   2.608  1.00  1.190          H  
ATOM    692  HA  GLU A  45       9.496  -2.800   4.618  1.00  1.300          H  
ATOM    693 1HB  GLU A  45      10.863  -1.374   2.361  1.00  1.770          H  
ATOM    694 2HB  GLU A  45       9.812  -0.562   3.518  1.00  1.770          H  
ATOM    695 1HG  GLU A  45      12.355  -2.097   4.169  1.00  1.770          H  
ATOM    696 2HG  GLU A  45      12.178  -0.350   4.128  1.00  1.770          H  
ATOM    697  N   ILE A  46       8.172  -2.944   1.588  1.00  0.940          N  
ATOM    698  CA  ILE A  46       6.837  -2.827   1.009  1.00  0.940          C  
ATOM    699  C   ILE A  46       5.952  -3.912   1.631  1.00  0.870          C  
ATOM    700  O   ILE A  46       4.788  -3.655   1.916  1.00  0.920          O  
ATOM    701  CB  ILE A  46       6.773  -2.853  -0.548  1.00  1.320          C  
ATOM    702  CG1 ILE A  46       7.139  -4.234  -1.122  1.00  1.320          C  
ATOM    703  CG2 ILE A  46       7.661  -1.741  -1.104  1.00  1.320          C  
ATOM    704  CD1 ILE A  46       7.000  -4.380  -2.633  1.00  1.320          C  
ATOM    705  H   ILE A  46       9.003  -3.225   1.058  1.00  1.130          H  
ATOM    706  HA  ILE A  46       6.448  -1.864   1.281  1.00  1.130          H  
ATOM    707  HB  ILE A  46       5.745  -2.654  -0.846  1.00  1.580          H  
ATOM    708 1HG1 ILE A  46       8.118  -4.464  -0.820  1.00  1.580          H  
ATOM    709 2HG1 ILE A  46       6.466  -4.970  -0.700  1.00  1.580          H  
ATOM    710 1HG2 ILE A  46       7.581  -1.691  -2.175  1.00  1.580          H  
ATOM    711 2HG2 ILE A  46       7.351  -0.810  -0.698  1.00  1.580          H  
ATOM    712 3HG2 ILE A  46       8.693  -1.925  -0.821  1.00  1.580          H  
ATOM    713 1HD1 ILE A  46       7.250  -5.398  -2.912  1.00  1.580          H  
ATOM    714 2HD1 ILE A  46       5.991  -4.168  -2.926  1.00  1.580          H  
ATOM    715 3HD1 ILE A  46       7.662  -3.709  -3.142  1.00  1.580          H  
ATOM    716  N   GLN A  47       6.527  -5.088   1.944  1.00  0.810          N  
ATOM    717  CA  GLN A  47       5.761  -6.149   2.582  1.00  0.800          C  
ATOM    718  C   GLN A  47       5.185  -5.712   3.922  1.00  0.860          C  
ATOM    719  O   GLN A  47       4.028  -6.043   4.242  1.00  0.890          O  
ATOM    720  CB  GLN A  47       6.612  -7.406   2.760  1.00  1.120          C  
ATOM    721  CG  GLN A  47       5.861  -8.563   3.395  1.00  1.120          C  
ATOM    722  CD  GLN A  47       6.591  -9.856   3.265  1.00  1.120          C  
ATOM    723  OE1 GLN A  47       6.603 -10.404   2.151  1.00  1.120          O  
ATOM    724  NE2 GLN A  47       7.194 -10.347   4.342  1.00  1.120          N  
ATOM    725  H   GLN A  47       7.501  -5.260   1.675  1.00  0.970          H  
ATOM    726  HA  GLN A  47       4.933  -6.402   1.927  1.00  0.960          H  
ATOM    727 1HB  GLN A  47       7.035  -7.710   1.808  1.00  1.350          H  
ATOM    728 2HB  GLN A  47       7.453  -7.173   3.410  1.00  1.350          H  
ATOM    729 1HG  GLN A  47       5.738  -8.355   4.459  1.00  1.350          H  
ATOM    730 2HG  GLN A  47       4.884  -8.663   2.924  1.00  1.350          H  
ATOM    731 1HE2 GLN A  47       7.702 -11.212   4.289  1.00  1.350          H  
ATOM    732 2HE2 GLN A  47       7.148  -9.853   5.214  1.00  1.350          H  
ATOM    733  N   GLU A  48       5.962  -4.950   4.701  1.00  0.960          N  
ATOM    734  CA  GLU A  48       5.460  -4.477   5.983  1.00  1.080          C  
ATOM    735  C   GLU A  48       4.292  -3.511   5.779  1.00  1.090          C  
ATOM    736  O   GLU A  48       3.258  -3.638   6.448  1.00  1.160          O  
ATOM    737  CB  GLU A  48       6.575  -3.773   6.764  1.00  1.460          C  
ATOM    738  CG  GLU A  48       6.197  -3.288   8.183  1.00  1.460          C  
ATOM    739  CD  GLU A  48       5.919  -4.417   9.148  1.00  1.460          C  
ATOM    740  OE1 GLU A  48       6.302  -5.526   8.859  1.00  1.460          O  
ATOM    741  OE2 GLU A  48       5.345  -4.166  10.179  1.00  1.460          O  
ATOM    742  H   GLU A  48       6.937  -4.777   4.422  1.00  1.150          H  
ATOM    743  HA  GLU A  48       5.109  -5.334   6.558  1.00  1.300          H  
ATOM    744 1HB  GLU A  48       7.431  -4.443   6.851  1.00  1.760          H  
ATOM    745 2HB  GLU A  48       6.912  -2.902   6.195  1.00  1.760          H  
ATOM    746 1HG  GLU A  48       7.019  -2.689   8.573  1.00  1.760          H  
ATOM    747 2HG  GLU A  48       5.317  -2.645   8.121  1.00  1.760          H  
ATOM    748  N   VAL A  49       4.406  -2.580   4.825  1.00  1.080          N  
ATOM    749  CA  VAL A  49       3.280  -1.664   4.663  1.00  1.200          C  
ATOM    750  C   VAL A  49       2.085  -2.344   4.008  1.00  1.090          C  
ATOM    751  O   VAL A  49       0.948  -1.959   4.269  1.00  1.250          O  
ATOM    752  CB  VAL A  49       3.656  -0.359   3.954  1.00  1.630          C  
ATOM    753  CG1 VAL A  49       4.752   0.328   4.782  1.00  1.630          C  
ATOM    754  CG2 VAL A  49       4.087  -0.601   2.549  1.00  1.630          C  
ATOM    755  H   VAL A  49       5.284  -2.494   4.294  1.00  1.300          H  
ATOM    756  HA  VAL A  49       2.965  -1.367   5.657  1.00  1.440          H  
ATOM    757  HB  VAL A  49       2.799   0.279   3.952  1.00  1.960          H  
ATOM    758 1HG1 VAL A  49       5.022   1.276   4.347  1.00  1.960          H  
ATOM    759 2HG1 VAL A  49       4.385   0.496   5.792  1.00  1.960          H  
ATOM    760 3HG1 VAL A  49       5.634  -0.313   4.823  1.00  1.960          H  
ATOM    761 1HG2 VAL A  49       4.345   0.326   2.073  1.00  1.960          H  
ATOM    762 2HG2 VAL A  49       4.931  -1.226   2.594  1.00  1.960          H  
ATOM    763 3HG2 VAL A  49       3.301  -1.084   1.980  1.00  1.960          H  
ATOM    764  N   PHE A  50       2.320  -3.360   3.166  1.00  0.890          N  
ATOM    765  CA  PHE A  50       1.204  -4.094   2.602  1.00  0.900          C  
ATOM    766  C   PHE A  50       0.408  -4.689   3.748  1.00  0.950          C  
ATOM    767  O   PHE A  50      -0.804  -4.476   3.867  1.00  1.080          O  
ATOM    768  CB  PHE A  50       1.652  -5.311   1.769  1.00  1.260          C  
ATOM    769  CG  PHE A  50       2.270  -5.122   0.439  1.00  1.260          C  
ATOM    770  CD1 PHE A  50       2.877  -6.200  -0.143  1.00  1.260          C  
ATOM    771  CD2 PHE A  50       2.276  -3.941  -0.238  1.00  1.260          C  
ATOM    772  CE1 PHE A  50       3.457  -6.106  -1.372  1.00  1.260          C  
ATOM    773  CE2 PHE A  50       2.867  -3.872  -1.467  1.00  1.260          C  
ATOM    774  CZ  PHE A  50       3.443  -4.952  -2.023  1.00  1.260          C  
ATOM    775  H   PHE A  50       3.279  -3.600   2.912  1.00  1.070          H  
ATOM    776  HA  PHE A  50       0.565  -3.423   2.032  1.00  1.080          H  
ATOM    777 1HB  PHE A  50       2.363  -5.872   2.362  1.00  1.510          H  
ATOM    778 2HB  PHE A  50       0.817  -5.961   1.638  1.00  1.510          H  
ATOM    779  HD1 PHE A  50       2.880  -7.143   0.390  1.00  1.510          H  
ATOM    780  HD2 PHE A  50       1.817  -3.064   0.196  1.00  1.510          H  
ATOM    781  HE1 PHE A  50       3.925  -6.964  -1.834  1.00  1.510          H  
ATOM    782  HE2 PHE A  50       2.871  -2.966  -1.999  1.00  1.510          H  
ATOM    783  HZ  PHE A  50       3.892  -4.890  -2.997  1.00  1.510          H  
ATOM    784  N   THR A  51       1.122  -5.306   4.697  1.00  0.960          N  
ATOM    785  CA  THR A  51       0.492  -5.972   5.826  1.00  1.130          C  
ATOM    786  C   THR A  51      -0.402  -5.000   6.591  1.00  1.200          C  
ATOM    787  O   THR A  51      -1.565  -5.303   6.889  1.00  1.320          O  
ATOM    788  CB  THR A  51       1.572  -6.548   6.778  1.00  1.510          C  
ATOM    789  OG1 THR A  51       2.392  -7.494   6.060  1.00  1.510          O  
ATOM    790  CG2 THR A  51       0.909  -7.256   7.959  1.00  1.510          C  
ATOM    791  H   THR A  51       2.131  -5.405   4.578  1.00  1.150          H  
ATOM    792  HA  THR A  51      -0.119  -6.790   5.446  1.00  1.360          H  
ATOM    793  HB  THR A  51       2.200  -5.748   7.154  1.00  1.820          H  
ATOM    794  HG1 THR A  51       2.969  -7.003   5.428  1.00  1.820          H  
ATOM    795 1HG2 THR A  51       1.681  -7.659   8.611  1.00  1.820          H  
ATOM    796 2HG2 THR A  51       0.295  -6.555   8.522  1.00  1.820          H  
ATOM    797 3HG2 THR A  51       0.284  -8.068   7.589  1.00  1.820          H  
ATOM    798  N   LEU A  52       0.115  -3.800   6.845  1.00  1.210          N  
ATOM    799  CA  LEU A  52      -0.594  -2.762   7.587  1.00  1.400          C  
ATOM    800  C   LEU A  52      -1.883  -2.292   6.907  1.00  1.420          C  
ATOM    801  O   LEU A  52      -2.746  -1.698   7.555  1.00  1.560          O  
ATOM    802  CB  LEU A  52       0.309  -1.531   7.786  1.00  1.880          C  
ATOM    803  CG  LEU A  52       1.564  -1.693   8.702  1.00  1.880          C  
ATOM    804  CD1 LEU A  52       2.402  -0.407   8.630  1.00  1.880          C  
ATOM    805  CD2 LEU A  52       1.147  -1.981  10.140  1.00  1.880          C  
ATOM    806  H   LEU A  52       1.088  -3.633   6.563  1.00  1.450          H  
ATOM    807  HA  LEU A  52      -0.876  -3.174   8.551  1.00  1.680          H  
ATOM    808 1HB  LEU A  52       0.658  -1.217   6.801  1.00  2.260          H  
ATOM    809 2HB  LEU A  52      -0.299  -0.728   8.197  1.00  2.260          H  
ATOM    810  HG  LEU A  52       2.175  -2.514   8.340  1.00  2.260          H  
ATOM    811 1HD1 LEU A  52       3.291  -0.521   9.251  1.00  2.260          H  
ATOM    812 2HD1 LEU A  52       2.704  -0.221   7.608  1.00  2.260          H  
ATOM    813 3HD1 LEU A  52       1.812   0.433   8.988  1.00  2.260          H  
ATOM    814 1HD2 LEU A  52       2.043  -2.085  10.753  1.00  2.260          H  
ATOM    815 2HD2 LEU A  52       0.541  -1.157  10.518  1.00  2.260          H  
ATOM    816 3HD2 LEU A  52       0.579  -2.901  10.193  1.00  2.260          H  
ATOM    817  N   HIS A  53      -1.985  -2.488   5.591  1.00  1.380          N  
ATOM    818  CA  HIS A  53      -3.130  -2.054   4.812  1.00  1.580          C  
ATOM    819  C   HIS A  53      -4.015  -3.235   4.399  1.00  1.600          C  
ATOM    820  O   HIS A  53      -4.941  -3.070   3.599  1.00  1.850          O  
ATOM    821  CB  HIS A  53      -2.664  -1.324   3.543  1.00  2.130          C  
ATOM    822  CG  HIS A  53      -1.906  -0.024   3.771  1.00  2.130          C  
ATOM    823  ND1 HIS A  53      -1.414   0.741   2.720  1.00  2.130          N  
ATOM    824  CD2 HIS A  53      -1.563   0.644   4.906  1.00  2.130          C  
ATOM    825  CE1 HIS A  53      -0.811   1.815   3.212  1.00  2.130          C  
ATOM    826  NE2 HIS A  53      -0.886   1.773   4.523  1.00  2.130          N  
ATOM    827  H   HIS A  53      -1.264  -3.009   5.092  1.00  1.660          H  
ATOM    828  HA  HIS A  53      -3.738  -1.371   5.401  1.00  1.900          H  
ATOM    829 1HB  HIS A  53      -2.002  -1.996   2.985  1.00  2.560          H  
ATOM    830 2HB  HIS A  53      -3.521  -1.115   2.910  1.00  2.560          H  
ATOM    831  HD2 HIS A  53      -1.778   0.356   5.930  1.00  2.560          H  
ATOM    832  HE1 HIS A  53      -0.333   2.603   2.633  1.00  2.560          H  
ATOM    833  HE2 HIS A  53      -0.511   2.462   5.157  1.00  2.560          H  
ATOM    834  N   GLY A  54      -3.744  -4.429   4.939  1.00  1.510          N  
ATOM    835  CA  GLY A  54      -4.526  -5.618   4.607  1.00  1.730          C  
ATOM    836  C   GLY A  54      -4.139  -6.333   3.300  1.00  1.750          C  
ATOM    837  O   GLY A  54      -4.927  -7.128   2.781  1.00  2.020          O  
ATOM    838  H   GLY A  54      -2.972  -4.532   5.607  1.00  1.810          H  
ATOM    839 1HA  GLY A  54      -4.433  -6.325   5.432  1.00  2.080          H  
ATOM    840 2HA  GLY A  54      -5.577  -5.342   4.561  1.00  2.080          H  
ATOM    841  N   MET A  55      -2.963  -6.039   2.740  1.00  1.520          N  
ATOM    842  CA  MET A  55      -2.518  -6.657   1.498  1.00  1.550          C  
ATOM    843  C   MET A  55      -1.391  -7.631   1.788  1.00  1.420          C  
ATOM    844  O   MET A  55      -0.765  -7.557   2.843  1.00  1.390          O  
ATOM    845  CB  MET A  55      -2.076  -5.602   0.494  1.00  2.160          C  
ATOM    846  CG  MET A  55      -3.143  -4.582   0.121  1.00  2.160          C  
ATOM    847  SD  MET A  55      -4.540  -5.306  -0.785  1.00  2.160          S  
ATOM    848  CE  MET A  55      -3.856  -5.624  -2.421  1.00  2.160          C  
ATOM    849  H   MET A  55      -2.303  -5.405   3.203  1.00  1.820          H  
ATOM    850  HA  MET A  55      -3.343  -7.225   1.070  1.00  1.860          H  
ATOM    851 1HB  MET A  55      -1.236  -5.053   0.894  1.00  2.590          H  
ATOM    852 2HB  MET A  55      -1.754  -6.101  -0.395  1.00  2.590          H  
ATOM    853 1HG  MET A  55      -3.532  -4.119   1.034  1.00  2.590          H  
ATOM    854 2HG  MET A  55      -2.699  -3.803  -0.495  1.00  2.590          H  
ATOM    855 1HE  MET A  55      -4.626  -6.064  -3.054  1.00  2.590          H  
ATOM    856 2HE  MET A  55      -3.522  -4.685  -2.870  1.00  2.590          H  
ATOM    857 3HE  MET A  55      -3.018  -6.313  -2.350  1.00  2.590          H  
ATOM    858  N   LYS A  56      -1.125  -8.550   0.868  1.00  1.600          N  
ATOM    859  CA  LYS A  56      -0.011  -9.472   1.053  1.00  1.720          C  
ATOM    860  C   LYS A  56       0.823  -9.626  -0.210  1.00  1.460          C  
ATOM    861  O   LYS A  56       0.297  -9.618  -1.323  1.00  1.270          O  
ATOM    862  CB  LYS A  56      -0.528 -10.843   1.500  1.00  2.360          C  
ATOM    863  CG  LYS A  56      -1.233 -10.835   2.859  1.00  2.360          C  
ATOM    864  CD  LYS A  56      -1.650 -12.231   3.296  1.00  2.360          C  
ATOM    865  CE  LYS A  56      -2.354 -12.191   4.650  1.00  2.360          C  
ATOM    866  NZ  LYS A  56      -2.778 -13.549   5.103  1.00  2.360          N  
ATOM    867  H   LYS A  56      -1.687  -8.595   0.030  1.00  1.920          H  
ATOM    868  HA  LYS A  56       0.645  -9.075   1.831  1.00  2.060          H  
ATOM    869 1HB  LYS A  56      -1.228 -11.230   0.759  1.00  2.830          H  
ATOM    870 2HB  LYS A  56       0.304 -11.545   1.558  1.00  2.830          H  
ATOM    871 1HG  LYS A  56      -0.569 -10.398   3.608  1.00  2.830          H  
ATOM    872 2HG  LYS A  56      -2.127 -10.218   2.797  1.00  2.830          H  
ATOM    873 1HD  LYS A  56      -2.327 -12.660   2.555  1.00  2.830          H  
ATOM    874 2HD  LYS A  56      -0.770 -12.867   3.372  1.00  2.830          H  
ATOM    875 1HE  LYS A  56      -1.676 -11.767   5.390  1.00  2.830          H  
ATOM    876 2HE  LYS A  56      -3.235 -11.553   4.573  1.00  2.830          H  
ATOM    877 1HZ  LYS A  56      -3.238 -13.477   6.001  1.00  2.830          H  
ATOM    878 2HZ  LYS A  56      -3.417 -13.948   4.430  1.00  2.830          H  
ATOM    879 3HZ  LYS A  56      -1.968 -14.146   5.191  1.00  2.830          H  
ATOM    880  N   CYS A  57       2.113  -9.889  -0.052  1.00  1.690          N  
ATOM    881  CA  CYS A  57       2.969 -10.099  -1.216  1.00  1.690          C  
ATOM    882  C   CYS A  57       2.519 -11.278  -2.065  1.00  1.570          C  
ATOM    883  O   CYS A  57       2.663 -11.240  -3.291  1.00  1.570          O  
ATOM    884  CB  CYS A  57       4.404 -10.310  -0.805  1.00  2.370          C  
ATOM    885  SG  CYS A  57       5.197  -8.850  -0.164  1.00  2.370          S  
ATOM    886  H   CYS A  57       2.506  -9.914   0.881  1.00  2.030          H  
ATOM    887  HA  CYS A  57       2.928  -9.202  -1.831  1.00  2.030          H  
ATOM    888 1HB  CYS A  57       4.459 -11.088  -0.041  1.00  2.840          H  
ATOM    889 2HB  CYS A  57       4.963 -10.654  -1.665  1.00  2.840          H  
ATOM    890  HG  CYS A  57       6.094  -9.500   0.625  1.00  2.840          H  
ATOM    891  N   SER A  58       1.975 -12.321  -1.424  1.00  1.730          N  
ATOM    892  CA  SER A  58       1.489 -13.508  -2.116  1.00  1.880          C  
ATOM    893  C   SER A  58       0.221 -13.226  -2.933  1.00  1.810          C  
ATOM    894  O   SER A  58      -0.151 -14.022  -3.806  1.00  2.100          O  
ATOM    895  CB  SER A  58       1.229 -14.612  -1.111  1.00  2.570          C  
ATOM    896  OG  SER A  58       0.169 -14.276  -0.260  1.00  2.570          O  
ATOM    897  H   SER A  58       1.902 -12.308  -0.415  1.00  2.080          H  
ATOM    898  HA  SER A  58       2.266 -13.842  -2.804  1.00  2.260          H  
ATOM    899 1HB  SER A  58       0.994 -15.535  -1.640  1.00  3.090          H  
ATOM    900 2HB  SER A  58       2.128 -14.789  -0.525  1.00  3.090          H  
ATOM    901  HG  SER A  58       0.058 -15.027   0.334  1.00  3.090          H  
ATOM    902  N   HIS A  59      -0.448 -12.105  -2.635  1.00  1.670          N  
ATOM    903  CA  HIS A  59      -1.635 -11.644  -3.334  1.00  1.950          C  
ATOM    904  C   HIS A  59      -1.160 -10.999  -4.614  1.00  1.930          C  
ATOM    905  O   HIS A  59      -1.615 -11.315  -5.714  1.00  2.380          O  
ATOM    906  CB  HIS A  59      -2.414 -10.602  -2.515  1.00  2.620          C  
ATOM    907  CG  HIS A  59      -3.656 -10.113  -3.153  1.00  2.620          C  
ATOM    908  ND1 HIS A  59      -4.827 -10.836  -3.166  1.00  2.620          N  
ATOM    909  CD2 HIS A  59      -3.907  -8.970  -3.829  1.00  2.620          C  
ATOM    910  CE1 HIS A  59      -5.753 -10.151  -3.814  1.00  2.620          C  
ATOM    911  NE2 HIS A  59      -5.220  -9.015  -4.227  1.00  2.620          N  
ATOM    912  H   HIS A  59      -0.077 -11.491  -1.918  1.00  2.000          H  
ATOM    913  HA  HIS A  59      -2.293 -12.477  -3.579  1.00  2.340          H  
ATOM    914 1HB  HIS A  59      -2.656 -11.012  -1.535  1.00  3.140          H  
ATOM    915 2HB  HIS A  59      -1.805  -9.731  -2.362  1.00  3.140          H  
ATOM    916  HD2 HIS A  59      -3.193  -8.168  -4.022  1.00  3.140          H  
ATOM    917  HE1 HIS A  59      -6.781 -10.471  -3.984  1.00  3.140          H  
ATOM    918  HE2 HIS A  59      -5.695  -8.296  -4.754  1.00  3.140          H  
ATOM    919  N   PHE A  60      -0.206 -10.078  -4.434  1.00  1.680          N  
ATOM    920  CA  PHE A  60       0.333  -9.303  -5.534  1.00  1.960          C  
ATOM    921  C   PHE A  60       1.100 -10.128  -6.560  1.00  2.050          C  
ATOM    922  O   PHE A  60       0.811 -10.028  -7.754  1.00  2.460          O  
ATOM    923  CB  PHE A  60       1.280  -8.228  -4.984  1.00  2.630          C  
ATOM    924  CG  PHE A  60       0.611  -7.015  -4.418  1.00  2.630          C  
ATOM    925  CD1 PHE A  60       0.601  -6.780  -3.066  1.00  2.630          C  
ATOM    926  CD2 PHE A  60      -0.003  -6.098  -5.248  1.00  2.630          C  
ATOM    927  CE1 PHE A  60       0.012  -5.660  -2.556  1.00  2.630          C  
ATOM    928  CE2 PHE A  60      -0.603  -4.985  -4.740  1.00  2.630          C  
ATOM    929  CZ  PHE A  60      -0.591  -4.759  -3.385  1.00  2.630          C  
ATOM    930  H   PHE A  60       0.107  -9.895  -3.480  1.00  2.020          H  
ATOM    931  HA  PHE A  60      -0.501  -8.819  -6.039  1.00  2.350          H  
ATOM    932 1HB  PHE A  60       1.867  -8.675  -4.183  1.00  3.160          H  
ATOM    933 2HB  PHE A  60       1.982  -7.920  -5.737  1.00  3.160          H  
ATOM    934  HD1 PHE A  60       1.083  -7.489  -2.395  1.00  3.160          H  
ATOM    935  HD2 PHE A  60      -0.011  -6.267  -6.314  1.00  3.160          H  
ATOM    936  HE1 PHE A  60       0.036  -5.486  -1.491  1.00  3.160          H  
ATOM    937  HE2 PHE A  60      -1.084  -4.273  -5.415  1.00  3.160          H  
ATOM    938  HZ  PHE A  60      -1.061  -3.868  -2.976  1.00  3.160          H  
ATOM    939  N   LYS A  61       1.996 -11.011  -6.104  1.00  1.990          N  
ATOM    940  CA  LYS A  61       2.818 -11.819  -7.005  1.00  2.270          C  
ATOM    941  C   LYS A  61       3.622 -10.917  -7.954  1.00  2.010          C  
ATOM    942  O   LYS A  61       3.600 -11.082  -9.171  1.00  2.190          O  
ATOM    943  CB  LYS A  61       1.944 -12.803  -7.795  1.00  3.070          C  
ATOM    944  CG  LYS A  61       1.175 -13.797  -6.918  1.00  3.070          C  
ATOM    945  CD  LYS A  61       0.326 -14.721  -7.772  1.00  3.070          C  
ATOM    946  CE  LYS A  61      -0.354 -15.847  -6.969  1.00  3.070          C  
ATOM    947  NZ  LYS A  61      -1.324 -15.343  -5.938  1.00  3.070          N  
ATOM    948  H   LYS A  61       2.165 -11.079  -5.095  1.00  2.390          H  
ATOM    949  HA  LYS A  61       3.529 -12.389  -6.407  1.00  2.720          H  
ATOM    950 1HB  LYS A  61       1.231 -12.280  -8.419  1.00  3.680          H  
ATOM    951 2HB  LYS A  61       2.583 -13.382  -8.461  1.00  3.680          H  
ATOM    952 1HG  LYS A  61       1.868 -14.379  -6.315  1.00  3.680          H  
ATOM    953 2HG  LYS A  61       0.524 -13.233  -6.249  1.00  3.680          H  
ATOM    954 1HD  LYS A  61      -0.449 -14.128  -8.261  1.00  3.680          H  
ATOM    955 2HD  LYS A  61       0.950 -15.169  -8.542  1.00  3.680          H  
ATOM    956 1HE  LYS A  61      -0.896 -16.473  -7.674  1.00  3.680          H  
ATOM    957 2HE  LYS A  61       0.406 -16.452  -6.473  1.00  3.680          H  
ATOM    958 1HZ  LYS A  61      -1.746 -16.126  -5.470  1.00  3.680          H  
ATOM    959 2HZ  LYS A  61      -0.841 -14.771  -5.227  1.00  3.680          H  
ATOM    960 3HZ  LYS A  61      -2.042 -14.788  -6.374  1.00  3.680          H  
ATOM    961  N   LEU A  62       4.333  -9.966  -7.350  1.00  1.820          N  
ATOM    962  CA  LEU A  62       5.138  -8.972  -8.043  1.00  1.880          C  
ATOM    963  C   LEU A  62       6.468  -9.557  -8.554  1.00  2.100          C  
ATOM    964  O   LEU A  62       6.920 -10.601  -8.055  1.00  2.040          O  
ATOM    965  CB  LEU A  62       5.310  -7.764  -7.077  1.00  2.610          C  
ATOM    966  CG  LEU A  62       6.001  -8.016  -5.755  1.00  2.610          C  
ATOM    967  CD1 LEU A  62       7.489  -7.762  -5.892  1.00  2.610          C  
ATOM    968  CD2 LEU A  62       5.372  -7.112  -4.684  1.00  2.610          C  
ATOM    969  H   LEU A  62       4.278  -9.932  -6.347  1.00  2.180          H  
ATOM    970  HA  LEU A  62       4.565  -8.662  -8.897  1.00  2.260          H  
ATOM    971 1HB  LEU A  62       5.830  -6.972  -7.557  1.00  3.130          H  
ATOM    972 2HB  LEU A  62       4.328  -7.392  -6.822  1.00  3.130          H  
ATOM    973  HG  LEU A  62       5.869  -9.051  -5.468  1.00  3.130          H  
ATOM    974 1HD1 LEU A  62       7.938  -7.964  -4.953  1.00  3.130          H  
ATOM    975 2HD1 LEU A  62       7.936  -8.405  -6.631  1.00  3.130          H  
ATOM    976 3HD1 LEU A  62       7.667  -6.736  -6.172  1.00  3.130          H  
ATOM    977 1HD2 LEU A  62       5.858  -7.298  -3.724  1.00  3.130          H  
ATOM    978 2HD2 LEU A  62       5.506  -6.065  -4.965  1.00  3.130          H  
ATOM    979 3HD2 LEU A  62       4.308  -7.325  -4.591  1.00  3.130          H  
ATOM    980  N   PRO A  63       7.113  -8.918  -9.567  1.00  2.680          N  
ATOM    981  CA  PRO A  63       8.333  -9.377 -10.206  1.00  3.210          C  
ATOM    982  C   PRO A  63       9.436  -9.713  -9.238  1.00  3.060          C  
ATOM    983  O   PRO A  63       9.717  -8.966  -8.303  1.00  3.660          O  
ATOM    984  CB  PRO A  63       8.731  -8.164 -11.058  1.00  4.810          C  
ATOM    985  CG  PRO A  63       7.427  -7.497 -11.392  1.00  4.810          C  
ATOM    986  CD  PRO A  63       6.603  -7.633 -10.140  1.00  4.810          C  
ATOM    987  HA  PRO A  63       8.101 -10.245 -10.842  1.00  3.850          H  
ATOM    988 1HB  PRO A  63       9.414  -7.515 -10.484  1.00  5.780          H  
ATOM    989 2HB  PRO A  63       9.287  -8.499 -11.947  1.00  5.780          H  
ATOM    990 1HG  PRO A  63       7.601  -6.445 -11.669  1.00  5.780          H  
ATOM    991 2HG  PRO A  63       6.963  -7.982 -12.264  1.00  5.780          H  
ATOM    992 1HD  PRO A  63       6.822  -6.802  -9.485  1.00  5.780          H  
ATOM    993 2HD  PRO A  63       5.557  -7.674 -10.446  1.00  5.780          H  
ATOM    994  N   ASP A  64      10.030 -10.866  -9.492  1.00  2.670          N  
ATOM    995  CA  ASP A  64      11.094 -11.505  -8.750  1.00  2.690          C  
ATOM    996  C   ASP A  64      10.931 -11.444  -7.230  1.00  2.250          C  
ATOM    997  O   ASP A  64      11.901 -11.619  -6.487  1.00  2.410          O  
ATOM    998  CB  ASP A  64      12.406 -10.861  -9.184  1.00  3.760          C  
ATOM    999  CG  ASP A  64      12.641 -11.054 -10.681  1.00  3.760          C  
ATOM   1000  OD1 ASP A  64      12.066 -11.971 -11.243  1.00  3.760          O  
ATOM   1001  OD2 ASP A  64      13.387 -10.295 -11.253  1.00  3.760          O  
ATOM   1002  H   ASP A  64       9.725 -11.373 -10.315  1.00  3.200          H  
ATOM   1003  HA  ASP A  64      11.115 -12.557  -9.038  1.00  3.230          H  
ATOM   1004 1HB  ASP A  64      12.377  -9.794  -8.967  1.00  4.510          H  
ATOM   1005 2HB  ASP A  64      13.235 -11.284  -8.638  1.00  4.510          H  
ATOM   1006  N   TYR A  65       9.696 -11.449  -6.728  1.00  2.060          N  
ATOM   1007  CA  TYR A  65       9.527 -11.418  -5.287  1.00  2.160          C  
ATOM   1008  C   TYR A  65      10.240 -12.528  -4.505  1.00  2.150          C  
ATOM   1009  O   TYR A  65      10.998 -12.211  -3.582  1.00  2.690          O  
ATOM   1010  CB  TYR A  65       8.047 -11.377  -4.923  1.00  2.980          C  
ATOM   1011  CG  TYR A  65       7.791 -11.595  -3.466  1.00  2.980          C  
ATOM   1012  CD1 TYR A  65       8.024 -10.604  -2.541  1.00  2.980          C  
ATOM   1013  CD2 TYR A  65       7.303 -12.826  -3.058  1.00  2.980          C  
ATOM   1014  CE1 TYR A  65       7.771 -10.856  -1.217  1.00  2.980          C  
ATOM   1015  CE2 TYR A  65       7.052 -13.072  -1.753  1.00  2.980          C  
ATOM   1016  CZ  TYR A  65       7.273 -12.114  -0.825  1.00  2.980          C  
ATOM   1017  OH  TYR A  65       6.984 -12.408   0.495  1.00  2.980          O  
ATOM   1018  H   TYR A  65       8.880 -11.323  -7.344  1.00  2.470          H  
ATOM   1019  HA  TYR A  65       9.954 -10.475  -4.945  1.00  2.590          H  
ATOM   1020 1HB  TYR A  65       7.670 -10.419  -5.176  1.00  3.580          H  
ATOM   1021 2HB  TYR A  65       7.477 -12.086  -5.499  1.00  3.580          H  
ATOM   1022  HD1 TYR A  65       8.402  -9.635  -2.853  1.00  3.580          H  
ATOM   1023  HD2 TYR A  65       7.114 -13.604  -3.787  1.00  3.580          H  
ATOM   1024  HE1 TYR A  65       7.946 -10.082  -0.483  1.00  3.580          H  
ATOM   1025  HE2 TYR A  65       6.666 -14.045  -1.448  1.00  3.580          H  
ATOM   1026  HH  TYR A  65       7.075 -11.617   1.060  1.00  3.580          H  
ATOM   1027  N   PRO A  66      10.063 -13.838  -4.816  1.00  2.210          N  
ATOM   1028  CA  PRO A  66      10.705 -14.919  -4.093  1.00  2.570          C  
ATOM   1029  C   PRO A  66      12.219 -14.977  -4.296  1.00  2.530          C  
ATOM   1030  O   PRO A  66      12.911 -15.693  -3.571  1.00  2.710          O  
ATOM   1031  CB  PRO A  66      10.021 -16.169  -4.666  1.00  3.850          C  
ATOM   1032  CG  PRO A  66       9.566 -15.770  -6.051  1.00  3.850          C  
ATOM   1033  CD  PRO A  66       9.193 -14.313  -5.948  1.00  3.850          C  
ATOM   1034  HA  PRO A  66      10.472 -14.808  -3.025  1.00  3.080          H  
ATOM   1035 1HB  PRO A  66      10.738 -17.005  -4.685  1.00  4.630          H  
ATOM   1036 2HB  PRO A  66       9.191 -16.473  -4.013  1.00  4.630          H  
ATOM   1037 1HG  PRO A  66      10.371 -15.955  -6.780  1.00  4.630          H  
ATOM   1038 2HG  PRO A  66       8.716 -16.399  -6.359  1.00  4.630          H  
ATOM   1039 1HD  PRO A  66       9.448 -13.887  -6.904  1.00  4.630          H  
ATOM   1040 2HD  PRO A  66       8.133 -14.224  -5.721  1.00  4.630          H  
ATOM   1041  N   LEU A  67      12.715 -14.334  -5.355  1.00  2.970          N  
ATOM   1042  CA  LEU A  67      14.133 -14.349  -5.658  1.00  3.530          C  
ATOM   1043  C   LEU A  67      14.867 -13.311  -4.829  1.00  3.340          C  
ATOM   1044  O   LEU A  67      15.956 -13.551  -4.303  1.00  3.770          O  
ATOM   1045  CB  LEU A  67      14.342 -14.068  -7.148  1.00  4.720          C  
ATOM   1046  CG  LEU A  67      13.753 -15.115  -8.141  1.00  4.720          C  
ATOM   1047  CD1 LEU A  67      13.913 -14.587  -9.552  1.00  4.720          C  
ATOM   1048  CD2 LEU A  67      14.459 -16.464  -7.992  1.00  4.720          C  
ATOM   1049  H   LEU A  67      12.123 -13.725  -5.912  1.00  3.560          H  
ATOM   1050  HA  LEU A  67      14.536 -15.322  -5.397  1.00  4.240          H  
ATOM   1051 1HB  LEU A  67      13.890 -13.112  -7.373  1.00  5.660          H  
ATOM   1052 2HB  LEU A  67      15.413 -13.989  -7.334  1.00  5.660          H  
ATOM   1053  HG  LEU A  67      12.689 -15.242  -7.946  1.00  5.660          H  
ATOM   1054 1HD1 LEU A  67      13.489 -15.297 -10.260  1.00  5.660          H  
ATOM   1055 2HD1 LEU A  67      13.396 -13.642  -9.650  1.00  5.660          H  
ATOM   1056 3HD1 LEU A  67      14.968 -14.443  -9.777  1.00  5.660          H  
ATOM   1057 1HD2 LEU A  67      14.032 -17.172  -8.704  1.00  5.660          H  
ATOM   1058 2HD2 LEU A  67      15.523 -16.344  -8.197  1.00  5.660          H  
ATOM   1059 3HD2 LEU A  67      14.326 -16.854  -6.989  1.00  5.660          H  
ATOM   1060  N   LEU A  68      14.260 -12.128  -4.771  1.00  3.120          N  
ATOM   1061  CA  LEU A  68      14.822 -10.964  -4.124  1.00  3.420          C  
ATOM   1062  C   LEU A  68      14.462 -10.689  -2.669  1.00  3.100          C  
ATOM   1063  O   LEU A  68      15.315 -10.244  -1.915  1.00  3.340          O  
ATOM   1064  CB  LEU A  68      14.397  -9.729  -4.916  1.00  4.670          C  
ATOM   1065  CG  LEU A  68      14.903  -9.531  -6.322  1.00  4.670          C  
ATOM   1066  CD1 LEU A  68      14.135  -8.348  -6.933  1.00  4.670          C  
ATOM   1067  CD2 LEU A  68      16.402  -9.205  -6.289  1.00  4.670          C  
ATOM   1068  H   LEU A  68      13.364 -12.026  -5.253  1.00  3.740          H  
ATOM   1069  HA  LEU A  68      15.899 -11.075  -4.165  1.00  4.100          H  
ATOM   1070 1HB  LEU A  68      13.328  -9.801  -5.019  1.00  5.600          H  
ATOM   1071 2HB  LEU A  68      14.644  -8.838  -4.345  1.00  5.600          H  
ATOM   1072  HG  LEU A  68      14.721 -10.423  -6.917  1.00  5.600          H  
ATOM   1073 1HD1 LEU A  68      14.483  -8.170  -7.953  1.00  5.600          H  
ATOM   1074 2HD1 LEU A  68      13.065  -8.572  -6.948  1.00  5.600          H  
ATOM   1075 3HD1 LEU A  68      14.303  -7.461  -6.341  1.00  5.600          H  
ATOM   1076 1HD2 LEU A  68      16.758  -9.031  -7.307  1.00  5.600          H  
ATOM   1077 2HD2 LEU A  68      16.566  -8.300  -5.697  1.00  5.600          H  
ATOM   1078 3HD2 LEU A  68      16.965 -10.025  -5.853  1.00  5.600          H  
ATOM   1079  N   MET A  69      13.244 -10.913  -2.212  1.00  3.050          N  
ATOM   1080  CA  MET A  69      13.019 -10.417  -0.860  1.00  3.210          C  
ATOM   1081  C   MET A  69      13.999 -10.984   0.152  1.00  3.090          C  
ATOM   1082  O   MET A  69      14.100 -12.199   0.336  1.00  3.450          O  
ATOM   1083  CB  MET A  69      11.604 -10.695  -0.390  1.00  4.430          C  
ATOM   1084  CG  MET A  69      11.367 -10.121   0.990  1.00  4.430          C  
ATOM   1085  SD  MET A  69       9.765 -10.334   1.639  1.00  4.430          S  
ATOM   1086  CE  MET A  69       9.724 -12.105   1.930  1.00  4.430          C  
ATOM   1087  H   MET A  69      12.496 -11.336  -2.772  1.00  3.660          H  
ATOM   1088  HA  MET A  69      13.171  -9.341  -0.868  1.00  3.850          H  
ATOM   1089 1HB  MET A  69      10.888 -10.261  -1.081  1.00  5.320          H  
ATOM   1090 2HB  MET A  69      11.441 -11.767  -0.378  1.00  5.320          H  
ATOM   1091 1HG  MET A  69      12.052 -10.581   1.693  1.00  5.320          H  
ATOM   1092 2HG  MET A  69      11.581  -9.055   0.965  1.00  5.320          H  
ATOM   1093 1HE  MET A  69       8.771 -12.379   2.372  1.00  5.320          H  
ATOM   1094 2HE  MET A  69       9.847 -12.641   0.995  1.00  5.320          H  
ATOM   1095 3HE  MET A  69      10.519 -12.389   2.606  1.00  5.320          H  
ATOM   1096  N   ASN A  70      14.668 -10.093   0.895  1.00  3.290          N  
ATOM   1097  CA  ASN A  70      15.640 -10.544   1.890  1.00  3.880          C  
ATOM   1098  C   ASN A  70      14.984 -10.943   3.210  1.00  4.030          C  
ATOM   1099  O   ASN A  70      15.238 -10.318   4.247  1.00  4.490          O  
ATOM   1100  CB  ASN A  70      16.687  -9.478   2.159  1.00  5.200          C  
ATOM   1101  CG  ASN A  70      17.836  -9.999   2.941  1.00  5.200          C  
ATOM   1102  OD1 ASN A  70      18.048 -11.218   2.991  1.00  5.200          O  
ATOM   1103  ND2 ASN A  70      18.588  -9.119   3.551  1.00  5.200          N  
ATOM   1104  H   ASN A  70      14.544  -9.093   0.708  1.00  3.950          H  
ATOM   1105  HA  ASN A  70      16.138 -11.431   1.495  1.00  4.660          H  
ATOM   1106 1HB  ASN A  70      17.067  -9.094   1.251  1.00  6.240          H  
ATOM   1107 2HB  ASN A  70      16.236  -8.646   2.694  1.00  6.240          H  
ATOM   1108 1HD2 ASN A  70      19.375  -9.420   4.093  1.00  6.240          H  
ATOM   1109 2HD2 ASN A  70      18.369  -8.147   3.482  1.00  6.240          H  
ATOM   1110  N   ALA A  71      14.186 -12.003   3.164  1.00  4.240          N  
ATOM   1111  CA  ALA A  71      13.448 -12.517   4.317  1.00  4.990          C  
ATOM   1112  C   ALA A  71      12.681 -13.777   3.941  1.00  5.790          C  
ATOM   1113  O   ALA A  71      13.184 -14.623   3.201  1.00  6.560          O  
ATOM   1114  OXT ALA A  71      11.557 -13.964   4.408  1.00  7.490          O  
ATOM   1115  CB  ALA A  71      12.477 -11.475   4.866  1.00  6.290          C  
ATOM   1116  H   ALA A  71      14.086 -12.443   2.244  1.00  5.090          H  
ATOM   1117  HA  ALA A  71      14.167 -12.775   5.093  1.00  5.990          H  
ATOM   1118 1HB  ALA A  71      11.959 -11.887   5.728  1.00  7.540          H  
ATOM   1119 2HB  ALA A  71      13.008 -10.583   5.173  1.00  7.540          H  
ATOM   1120 3HB  ALA A  71      11.756 -11.209   4.113  1.00  7.540          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 -408.998 50.6686 291.26 -25.191 6.53916 17.9507 148.034 -160.156 -0.71193 -4.93314 -113.106 -17.859 -49.5141 -5.30207 -6.21683 -2.98888 0.23823 2.16345 6.48061 39.2226 76.3335 -10.2359 4.11509 0.75494 9.81647 86.2826 -65.3542
CYS:NtermProteinFull_1 -6.92987 0.60627 3.24989 -0.07566 0.00126 0.05117 2.34943 -1.90118 -0 -0 -1.23368 0.29244 0 0 -1.18415 0 0 -0.04216 0.00243 0.42768 0 0 0 3.6196 0 0.12022 -0.64633
VAL_2 -4.32674 0.45896 0.73091 -0.32 0.27612 0.07387 0.79408 -1.06117 -0 -0 0.30197 -0.19223 0 0 0 0 0 0.0575 2e-05 0.35689 0 -0.00054 0 1.9342 -0.10764 0.198 -0.82581
PHE_3 -7.19924 0.86659 -0.37131 -0.74468 0.08835 0.49535 0.57354 -1.11411 -0.03322 -0.29115 0.10958 0.08228 0 0 0 0 0 -0.04607 0.71007 0 2.06185 -0.24738 0 1.0402 -0.24834 0.58463 -3.68307
GLY_4 -3.28235 0.28748 2.72721 -0.00103 0 0 1.699 -1.40228 -0 -0 -1.13549 -0.30689 0 0 0 0 0 -0.12687 0 0 0 -1.42146 0 0.83697 0.12256 0.75126 -1.25189
CYS_5 -4.5668 0.65871 4.53523 -0.12314 0.03849 0.0793 2.30822 -1.99356 -0.02784 -0.13963 -1.81079 -0.98631 0 0 -0.81224 0 0 0.01211 0.03386 0.27649 0 0.12776 0 3.6196 0.30531 1.52488 3.05964
PRO_6 -3.69541 0.74655 1.69654 -0.09646 0.00309 0.0606 1.00551 -0.93536 -0 -0 0.15463 0.67725 0 0 0 0 0 -0.09386 0.02889 0.50958 0 -0.39736 0 -2.4119 -0.11502 1.51827 -1.34444
SER_7 -2.12828 0.25422 1.7977 -0.02909 0 0.04696 0.89758 -0.85095 -0 -0 0.13753 -1.07326 0 0 0 0 0 -0.07448 0.02519 0.25435 0 0.04138 0.60085 -0.77834 -0.42584 0.36782 -0.93666
ALA_8 -4.16361 0.42879 3.82637 -0.02393 0.00024 0 2.28347 -2.20017 -0.00708 -0.06594 -1.01248 -0.41746 0 0 0 0 0 0.03195 0 0 0 -0.40045 0 1.8394 -0.1417 0.32188 0.29926
ALA_9 -4.73504 1.57799 2.60226 -0.02234 0 0 1.66934 -1.9392 -0.02818 -0.16044 -1.10926 -0.33877 0 0 0 0 0 -0.0249 0 0 0 -0.3214 0 1.8394 -0.18722 10.3082 9.1304
ASP_10 -3.24338 0.8418 5.09852 -0.25811 0.10698 0.84959 1.38221 -2.17153 -0 -0 -3.03835 -3.00482 0 0 0 -0.252 0 -0.04695 0.0527 0 2.43432 -0.4967 0 -2.3716 -0.58298 17.0238 12.3235
LYS_11 -4.96796 0.66586 7.19932 -0.66639 0.20857 0.7718 2.58576 -3.01838 -0.02076 -0.07369 -3.34118 -0.13998 0 0 0 -0.252 0 -0.0495 0.27699 1.99371 0 0.03713 0 -1.5107 -0.30004 7.18072 6.57929
LEU_12 -8.91233 1.04107 4.16961 -0.64116 0.38509 0.24097 2.47209 -2.88002 -0.02565 -0.19509 -1.47664 -0.05956 0 0 0 0 0 0.01582 0.07494 2.19344 0 -0.15478 0 0.18072 0.35309 0.91112 -2.30726
TRP_13 -8.725 1.29869 5.19315 -0.79114 0.0191 -0.00781 2.54324 -2.85596 -0.00413 -0.06068 -0.60453 -0.31634 0 0 0 0 0 0.10341 0.2827 0 2.39919 0.56155 0 1.6906 0.85521 1.66382 3.24506
ASP_14 -4.11432 0.52129 4.35807 -0.2028 0.01988 0.67062 1.89014 -2.08845 -0 -0 -0.78426 -0.14947 0 0 0 0 0 0.89952 0.22577 0 3.15965 0.21506 0 -2.3716 1.76211 1.4994 5.5106
GLU_15 -5.80004 0.72069 7.83597 -0.19405 0.01715 0.24528 4.06215 -3.46492 -0.02288 -0.16886 -3.68585 -0.59329 0 0 -0.81224 0 0 0.35786 0.04067 0 3.38878 -0.23794 0 -2.7348 1.19909 1.38671 1.53949
ASN_16 -8.10261 0.91072 6.4195 -0.3082 0.1147 0.56886 3.56642 -3.60147 -0.02286 -0.15043 -2.23517 -0.33025 0 0 0 0 0 0.00374 0.01292 0 3.66879 0.51328 0 -0.93687 0.4091 1.28462 1.78479
LYS_17 -5.32871 0.48218 5.55165 -0.49791 0.07451 0.32749 2.3073 -2.47728 -0 -0 -1.50648 0.13325 0 0 0 -0.67797 0 0.0375 0.16624 2.61243 0 -0.00033 0 -1.5107 0.30442 0.61519 0.61278
SER_18 -3.18528 0.12495 3.69554 -0.02436 2e-05 0.02392 1.11469 -1.74114 -0.00152 -0.0292 -0.70347 -0.18781 0 0 0 0 0 0.07173 0.02303 0.44477 0 0.32716 0.60374 -0.77834 -0.1214 0.57144 0.22848
HIS_D_19 -3.12037 0.11695 3.26091 -0.42864 0.01923 0.58138 1.28183 -1.5946 -0.01202 -0.12796 -1.26321 -0.2569 0 0 0 0 0 -0.06794 0.0378 0 1.53119 -0.41628 0 -0.45461 0.17427 0.89051 0.15157
PHE_20 -8.80166 1.31146 2.09464 -0.6646 0.12406 0.20854 2.62833 -2.27424 -0.00613 -0.05724 -2.58752 -0.04944 0 0 0 0 0 0.07796 0.03678 0 4.41502 -0.03252 0 1.0402 0.39207 1.40473 -0.73957
ILE_21 -9.21623 1.56378 4.41045 -0.67553 0.62606 0.17659 2.85887 -3.01262 -0.0337 -0.19407 -2.33802 -0.05762 0 0 0 0 0 -0.08047 0.37905 3.76959 0 -0.03235 0 0.73287 0.22991 1.22207 0.32863
GLU_22 -3.14455 0.29493 3.7317 -0.35006 0.0947 0.42857 1.13827 -1.77498 -0.00152 -0.0292 -1.12617 -0.64081 0 0 0 0 0 -0.07785 0.00059 0 3.07136 -0.17 0 -2.7348 -0.06834 0.57091 -0.78724
ASP_23 -3.92175 0.32396 4.95827 -0.11006 0.00262 0.33593 2.12166 -2.26648 -0.01202 -0.12796 -1.67744 -0.48858 0 0 0 0 0 0.13172 0.01653 0 2.41382 -0.22099 0 -2.3716 -0.14412 0.32855 -0.70796
PHE_24 -9.64904 1.52356 4.29219 -0.66822 0.04192 0.30465 2.72764 -3.07796 -0.00793 -0.05986 -2.17039 0.0069 0 0 0 0 0 -0.04347 0.0005 0 2.55437 0.05859 0 1.0402 -0.22946 0.57261 -2.7832
CYS_25 -7.15149 0.43015 5.62271 -0.07213 0.00021 0.06071 2.47942 -2.81759 -0 -0 -3.05043 -0.4639 0 0 0 0 0 0.02249 0.00145 0.74702 0 0.2703 0 3.6196 0.25434 0.53773 0.49058
TRP_26 -5.6948 0.39259 5.02596 -1.27926 0.06446 0.50255 2.2731 -2.47051 -0.01697 -0.10087 -2.01209 -0.31821 0 0 0 0 0 -0.01631 2e-05 0 1.69607 -0.30211 0 1.6906 0.37822 0.18919 0.00163
LYS_27 -6.232 0.32793 6.10807 -0.30787 0.02962 0.13882 2.69599 -2.83707 -0 -0 -2.19447 0.00431 0 0 0 0 0 -0.04804 0.00316 1.7458 0 -0.00668 0 -1.5107 -0.18156 0.19272 -2.07197
LEU_28 -10.3358 1.11725 6.82586 -0.70816 0.24309 0.2335 3.16762 -4.19585 -0 -0 -2.60206 0.19627 0 0 0 0 0 0.06116 0.00293 0.86959 0 -0.23373 0 0.18072 -0.28182 0.95365 -4.50578
HIS_D_29 -6.76277 0.42238 6.4223 -0.39646 0.09214 0.4016 2.72308 -3.30284 -0.01094 -0.12113 -2.79292 -0.53866 0 0 0 0 0 0.0805 0.00303 0 2.79584 0.02103 0 -0.45461 -0.15877 1.04044 -0.53677
ARG_30 -4.37914 0.3069 4.20452 -0.94153 0.15781 0.6228 1.81395 -1.91457 -0 -0 -0.94596 0.06178 0 0 0 0 0 0.00078 0.10303 2.74022 0 -0.17838 0 -1.2888 -0.32575 0.42847 0.46612
ARG_31 -5.38304 0.37074 5.72142 -0.65914 0.11033 0.46878 2.21811 -2.59398 -0.02306 -0.18131 -1.51429 0.3925 0 0 0 0 0 -0.07029 0.02504 1.8071 0 0.00417 0 -1.2888 -0.33733 0.51245 -0.4206
GLU_32 -2.06688 0.24489 2.78701 -0.24311 0.066 0.42653 1.15781 -1.29938 -0.01513 -0.12145 -1.27343 -0.50319 0 0 0 0 0 0.0617 0.00558 0 2.72373 0.24381 0 -2.7348 0.14795 0.55768 0.16531
GLY_33 -2.36821 0.05886 2.22416 -0.0004 0 0 0.81995 -1.21993 -0.01094 -0.12113 -0.8886 -0.16699 0 0 0 0 0 -0.05296 0 0 0 -1.12498 0 0.83697 0.3984 0.36411 -1.25168
ALA_34 -3.40304 0.64756 2.79015 -0.02365 0 0 1.60556 -1.69757 -0.00855 -0.07033 -1.27111 -0.43961 0 0 0 0 0 0.59354 0 0 0 -0.40427 0 1.8394 0.19716 0.4934 0.84863
CYS:disulfide_35 -5.18867 1.55874 3.50888 -0.06937 0.00084 0.06271 2.21181 -1.99006 -0 -0 -1.22443 -0.3503 0 0 0 0 0.11912 0.19513 1.78439 3.24904 0 0.23923 0 3.6196 0.13093 1.023 8.88059
VAL_36 -4.20434 0.90128 3.21355 -0.34845 0.15778 0.08274 1.7846 -1.89284 -0.01966 -0.14939 -0.50368 -0.06828 0 0 0 0 0 -0.11781 0.00202 0.73229 0 0.24014 0 1.9342 -0.02077 0.78508 2.50847
ASN_37 -7.29 1.2841 5.43399 -0.19831 0.03458 0.31326 2.72518 -3.05514 -0.00855 -0.07033 -1.58582 -0.43873 0 0 0 0 0 -0.032 0.00254 0 1.91553 -0.24528 0 -0.93687 -0.46482 0.61114 -2.00552
CYS:disulfide_38 -8.26448 1.37347 5.06103 -0.05608 0 0.03473 2.93321 -2.88074 -0 -0 -1.26762 -0.54612 0 0 0 0 0.11912 0.21353 0.00905 0.80719 0 0.40339 0 3.6196 -0.3382 0.79595 2.01703
GLU_39 -6.7033 0.40874 6.36632 -0.20064 0.02558 0.27398 3.23188 -3.02276 -0.02379 -0.21007 -3.12582 -0.56566 0 0 0 -0.67797 0 -0.03287 0.00575 0 3.20485 -0.1929 0 -2.7348 -0.03687 0.58079 -3.42955
MET_40 -9.57515 1.19519 6.61885 -0.32195 0.12965 0.0363 3.26832 -3.3935 -0 -0 -1.97806 0.04937 0 0 0 0 0 -0.00247 0.41879 1.19772 0 -0.05229 0 0.60916 -0.14298 0.64569 -1.29737
HIS_41 -7.32617 0.48056 6.3751 -0.4092 0.0651 0.38368 2.99293 -3.31969 -0 -0 -2.17126 -0.49995 0 0 0 0 0 0.10432 0.00041 0 2.83319 -0.04823 0 -0.45461 -0.11119 0.58943 -0.51559
ALA_42 -6.93151 0.7352 3.75982 -0.02237 0 0 3.16707 -3.00567 -0.0037 -0.02793 -2.43928 -0.3759 0 0 0 0 0 -0.01435 0 0 0 -0.31256 0 1.8394 -0.3243 0.40592 -3.55014
LEU_43 -9.39358 1.39502 4.69787 -0.52033 0.3581 0.12881 2.66634 -3.13984 -0 -0 -1.97944 0.2611 0 0 0 0 0 0.16948 0.02878 0.32595 0 -0.27198 0 0.18072 -0.46224 0.72569 -4.82956
ASN_44 -6.48795 0.45001 6.89166 -0.17505 0.03235 0.26018 3.0882 -3.30796 -0.00037 -0.00405 -2.32663 -0.34209 0 0 -0.59249 0 0 -0.02959 0.04588 0 1.43141 0.48231 0 -0.93687 -0.09544 0.72941 -0.88707
GLU_45 -5.79628 0.54754 5.01833 -0.46993 0.08055 0.93931 2.54555 -2.52615 -0 -0 -1.89277 -0.42268 0 0 0 0 0 0.04027 0.00565 0 3.17447 -0.33167 0 -2.7348 -0.14211 0.65294 -1.31176
ILE_46 -9.90946 1.32762 3.71973 -0.4868 0.28211 0.08812 3.15218 -3.14746 -0 -0 -2.24348 0.32603 0 0 0 0 0 0.02696 0.15629 1.14612 0 -0.05465 0 0.73287 -0.25674 1.12445 -4.01611
GLN_47 -7.57753 0.68334 6.45906 -0.40979 0.04417 0.23472 3.2784 -3.08262 -0.0037 -0.02793 -4.41926 -0.48866 0 0 0 -0.56447 0 0.02441 0.34788 0 4.19298 -0.12885 0 -0.18838 -0.1776 0.93458 -0.86925
GLU_48 -4.70719 0.31491 5.3789 -0.58016 0.0967 1.04174 2.3711 -2.52451 -0 -0 -1.9802 -0.69354 0 0 0 0 0 -0.01656 0.02075 0 3.44615 -0.15264 0 -2.7348 -0.28871 0.45366 -0.55443
VAL_49 -8.48226 1.03441 3.84252 -0.27917 0.14649 0.04772 3.17655 -2.99509 -0 -0 -0.83766 0.20548 0 0 0 0 0 0.20204 0.01399 0.57139 0 0.16082 0 1.9342 -0.20087 0.76901 -0.69045
PHE_50 -12.5326 1.58538 4.7656 -0.51459 0.13432 0.19374 3.32487 -3.70904 -0 -0 -3.18841 -0.16356 0 0 0 0 0 -0.01847 0.00477 0 3.72498 -0.31429 0 1.0402 -0.09579 1.46941 -4.29343
THR_51 -4.27946 0.37718 5.60921 -0.19755 0.09836 0.06905 2.64074 -2.57828 -0.01556 -0.14992 -2.81779 0.03341 0 0 0 0 0 -0.02724 0.02471 0.07554 0 0.04185 2.28018 -1.0874 0.0136 1.08588 1.19649
LEU_52 -4.10446 0.32949 3.40846 -0.50167 0.21035 0.13618 1.36474 -1.76015 -0 -0 -0.78307 0.2175 0 0 0 0 0 -0.08824 0.00926 0.29224 0 -0.15587 0 0.18072 -0.0963 0.35142 -0.98941
HIS_53 -4.98321 0.31716 5.26444 -0.42122 0.10079 0.44615 2.89511 -2.57178 -0.02975 -0.12075 -2.00427 -0.36207 0 0 -1.18415 0 0 -0.05366 0.00041 0 3.16421 -0.34605 0 -0.45461 -0.44812 0.31518 -0.4762
GLY_54 -1.81201 0.05878 2.33755 -5e-05 0 0 0.88751 -1.09265 -0 -0 -1.00809 -0.36804 0 0 0 0 0 -0.17242 0 0 0 -1.41342 0 0.83697 -0.74727 0.3494 -2.14372
MET_55 -5.82131 0.56016 3.5334 -0.42211 0.13228 0.06192 1.37516 -1.88992 -0.04531 -0.27068 -0.8742 -0.05533 0 0 0 0 0 -0.00494 0.03993 1.37314 0 -0.00376 0 0.60916 -0.36406 0.3542 -1.71227
LYS_56 -4.21511 0.45373 3.92157 -0.29103 0.03296 0.14232 1.87856 -1.85563 -0 -0 -1.71703 -0.24651 0 0 0 0 0 0.00346 0.00723 2.18701 0 0.00111 0 -1.5107 0.02537 0.23427 -0.94843
CYS_57 -6.34964 1.03718 2.89895 -0.04468 0.00022 0.01957 1.56473 -1.65193 -0.0346 -0.20363 -2.04266 -0.26971 0 0 0 0 0 -0.01927 0.00707 0.35909 0 0.30146 0 3.6196 -0.07971 0.28636 -0.6016
SER_58 -2.57196 0.16087 3.50026 -0.02966 0.00021 0.04858 1.21633 -1.55575 -0 -0 -1.32849 -1.04584 0 0 -0.51953 0 0 0.08181 0.00813 0.17973 0 -0.27487 0.60045 -0.77834 -0.35198 0.27389 -2.38618
HIS_59 -4.03716 0.40967 3.95986 -0.645 0.01255 0.63503 1.61473 -1.92641 -0.01781 -0.04615 -0.08973 -0.32374 0 0 0 0 0 -0.03278 0.00127 0 1.87932 -0.18831 0 -0.45461 -0.15194 0.37102 0.96981
PHE_60 -9.4095 1.26366 1.74399 -0.57519 0.03188 0.23666 1.41677 -2.25629 -0.02818 -0.16044 0.18504 0.02015 0 0 0 0 0 -0.02489 0.08431 0 3.12301 -0.20182 0 1.0402 0.16516 0.52523 -2.82024
LYS_61 -3.42305 0.20581 4.43987 -0.38095 0.06111 0.30079 1.9423 -1.95607 -0.01781 -0.04615 -2.84483 -0.12086 0 0 -0.51953 0 0 -0.0325 0.05871 1.73361 0 -0.20292 0 -1.5107 -0.00676 0.46304 -1.8569
LEU_62 -6.859 1.39932 1.13239 -0.7353 0.36374 0.27046 1.05656 -1.45423 -0.03033 -0.15888 -0.61906 0.20524 0 0 0 0 0 0.28052 0.18813 1.34682 0 -0.07502 0 0.18072 -0.18449 1.14339 -2.54902
PRO_63 -3.48809 0.7743 2.12322 -0.11734 0.0062 0.08448 0.69125 -0.96477 -0 -0 -0.07612 0.26877 0 0 0 0 0 -0.10561 0.0052 0.10042 0 -0.88724 0 -2.4119 -0.40397 1.34586 -3.05535
ASP_64 -4.49854 0.31197 3.57377 -0.13107 0.02788 0.42456 1.75689 -1.70832 -0.02441 -0.12364 -2.55932 -1.29665 0 0 0 0 0 0.03955 0.06563 0 2.33453 -0.49451 0 -2.3716 0.16719 1.10652 -3.39957
TYR_65 -8.56384 1.68898 3.96739 -1.01841 0.06813 0.36255 2.76918 -2.34972 -0.00857 -0.10025 -2.87421 -0.31102 0 0 0 -0.56447 0 0.00228 0.25719 0 1.7671 -0.49281 0.02987 1.2797 6.12435 1.98377 4.01719
PRO_66 -2.96463 0.63498 1.40369 -0.09438 0.00166 0.05914 0.12604 -0.64983 -0 -0 0.24704 0.66962 0 0 0 0 0 -0.07977 0.0111 0.42621 0 -0.18124 0 -2.4119 5.622 1.67287 4.49261
LEU_67 -3.55223 0.25477 2.7691 -0.47802 0.21251 0.10652 1.00298 -1.31952 -0 -0 -0.11235 0.18389 0 0 0 0 0 -0.02524 0.04606 0.45865 0 -0.20866 0 0.18072 -0.05694 0.53626 -0.00148
LEU_68 -7.38535 1.28641 3.85715 -0.50852 0.18156 0.13325 2.29749 -2.32686 -0 -0 -1.43421 0.2169 0 0 0 0 0 0.13937 0.21275 0.37308 0 -0.28096 0 0.18072 0.1378 1.2629 -1.65654
MET_69 -8.78145 1.15343 4.76725 -0.56454 0.24476 0.1203 2.12875 -2.4643 -0.03757 -0.2952 -2.22312 0.17701 0 0 0 0 0 -0.09916 0.02567 1.53867 0 0.32878 0 0.60916 -0.01002 1.4688 -1.91279
ASN_70 -4.0436 0.37447 3.42243 -0.39107 0.1251 0.78251 1.41259 -1.69689 -0.00743 -0.11262 -0.94831 -0.7918 0 0 -0.59249 0 0 0.01133 0.00901 0 1.82778 -0.54276 0 -0.93687 -0.05449 0.50878 -1.64434
ALA:CtermProteinFull_71 -2.44662 0.39414 1.71802 -0.0318 0.01282 0 0.86183 -1.08657 -0.0018 -0.00749 -1.33546 -0.37307 0 0 0 0 0 0 0 0 0 0 0 1.8394 0.01886 0.25628 -0.18146
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 114277 DOMAINID 110982 MODEL 2 2021-08-21_00000149_1_11
MODEL     2
REMARK    Rerank model03.pdb to model02.pdb score: 45.149
REMARK    CLUSTER 0003 t000_.out.valid.rescored.best_scoring.binary cluster_size: 8 cluster_threshold: 2.900464
REMARK    SCORE     hbond_sr_bb:         -45.077
REMARK    SCORE     rama_prepro:           0.423
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE          fa_sol:         235.153
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE         fa_elec:        -116.508
REMARK    SCORE          fa_atr:        -393.849
REMARK    SCORE        hbond_sc:          -4.931
REMARK    SCORE          fa_rep:          43.740
REMARK    SCORE     hbond_bb_sc:          -6.736
REMARK    SCORE    fa_intra_rep:           0.658
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE          fa_dun:          98.881
REMARK    SCORE     hbond_lr_bb:          -3.497
REMARK    SCORE atom_pair_constraint:        -203.509
REMARK    SCORE     description: cluster0003_0001
REMARK    SCORE     total_score:        -336.040
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE           omega:           0.690
REMARK    SCORE     lk_ball_wtd:         -13.263
REMARK    SCORE fa_intra_sol_xover4:          13.738
REMARK    SCORE           score:        -336.040
REMARK    SCORE         p_aa_pp:         -11.006
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE            time:           0.000
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE     cart_bonded:          41.827
REMARK    SCORE             ref:          27.225
ATOM      1  N   CYS A   1       0.103  -1.049  -0.795  1.00  4.520          N  
ATOM      2  CA  CYS A   1       1.548  -0.922  -0.638  1.00  3.550          C  
ATOM      3  C   CYS A   1       2.119  -2.321  -0.439  1.00  3.270          C  
ATOM      4  O   CYS A   1       1.355  -3.236  -0.130  1.00  3.540          O  
ATOM      5  CB  CYS A   1       1.842  -0.050   0.588  1.00  5.360          C  
ATOM      6  SG  CYS A   1       1.153   1.646   0.457  1.00  5.360          S  
ATOM      7 1H   CYS A   1      -0.340  -0.165  -0.595  1.00  5.420          H  
ATOM      8 2H   CYS A   1      -0.131  -1.325  -1.742  1.00  5.420          H  
ATOM      9 3H   CYS A   1      -0.241  -1.750  -0.152  1.00  5.420          H  
ATOM     10  HA  CYS A   1       1.971  -0.475  -1.537  1.00  4.260          H  
ATOM     11 1HB  CYS A   1       1.433  -0.521   1.491  1.00  6.430          H  
ATOM     12 2HB  CYS A   1       2.921   0.026   0.731  1.00  6.430          H  
ATOM     13  HG  CYS A   1       1.744   2.147   1.551  1.00  6.430          H  
ATOM     14  N   VAL A   2       3.426  -2.519  -0.623  1.00  3.140          N  
ATOM     15  CA  VAL A   2       3.958  -3.860  -0.367  1.00  3.270          C  
ATOM     16  C   VAL A   2       4.153  -4.099   1.140  1.00  3.150          C  
ATOM     17  O   VAL A   2       3.800  -5.169   1.632  1.00  3.450          O  
ATOM     18  CB  VAL A   2       5.194  -4.195  -1.252  1.00  4.530          C  
ATOM     19  CG1 VAL A   2       6.372  -3.355  -0.950  1.00  4.530          C  
ATOM     20  CG2 VAL A   2       5.562  -5.660  -1.022  1.00  4.530          C  
ATOM     21  H   VAL A   2       4.031  -1.758  -0.902  1.00  3.770          H  
ATOM     22  HA  VAL A   2       3.200  -4.575  -0.695  1.00  3.920          H  
ATOM     23  HB  VAL A   2       4.940  -4.041  -2.291  1.00  5.430          H  
ATOM     24 1HG1 VAL A   2       7.199  -3.641  -1.598  1.00  5.430          H  
ATOM     25 2HG1 VAL A   2       6.140  -2.318  -1.114  1.00  5.430          H  
ATOM     26 3HG1 VAL A   2       6.648  -3.498   0.044  1.00  5.430          H  
ATOM     27 1HG2 VAL A   2       6.407  -5.927  -1.650  1.00  5.430          H  
ATOM     28 2HG2 VAL A   2       5.828  -5.816   0.026  1.00  5.430          H  
ATOM     29 3HG2 VAL A   2       4.709  -6.292  -1.273  1.00  5.430          H  
ATOM     30  N   PHE A   3       4.653  -3.102   1.888  1.00  3.010          N  
ATOM     31  CA  PHE A   3       4.742  -3.274   3.333  1.00  3.170          C  
ATOM     32  C   PHE A   3       4.074  -2.101   4.048  1.00  2.910          C  
ATOM     33  O   PHE A   3       4.149  -0.954   3.600  1.00  3.310          O  
ATOM     34  CB  PHE A   3       6.198  -3.385   3.825  1.00  4.370          C  
ATOM     35  CG  PHE A   3       6.942  -4.553   3.265  1.00  4.370          C  
ATOM     36  CD1 PHE A   3       7.800  -4.382   2.222  1.00  4.370          C  
ATOM     37  CD2 PHE A   3       6.755  -5.826   3.758  1.00  4.370          C  
ATOM     38  CE1 PHE A   3       8.465  -5.440   1.660  1.00  4.370          C  
ATOM     39  CE2 PHE A   3       7.419  -6.895   3.207  1.00  4.370          C  
ATOM     40  CZ  PHE A   3       8.276  -6.700   2.152  1.00  4.370          C  
ATOM     41  H   PHE A   3       5.004  -2.246   1.467  1.00  3.610          H  
ATOM     42  HA  PHE A   3       4.213  -4.184   3.612  1.00  3.800          H  
ATOM     43 1HB  PHE A   3       6.741  -2.483   3.568  1.00  5.250          H  
ATOM     44 2HB  PHE A   3       6.212  -3.466   4.912  1.00  5.250          H  
ATOM     45  HD1 PHE A   3       7.948  -3.385   1.828  1.00  5.250          H  
ATOM     46  HD2 PHE A   3       6.069  -5.987   4.589  1.00  5.250          H  
ATOM     47  HE1 PHE A   3       9.141  -5.274   0.822  1.00  5.250          H  
ATOM     48  HE2 PHE A   3       7.263  -7.896   3.606  1.00  5.250          H  
ATOM     49  HZ  PHE A   3       8.802  -7.543   1.713  1.00  5.250          H  
ATOM     50  N   GLY A   4       3.471  -2.386   5.204  1.00  2.720          N  
ATOM     51  CA  GLY A   4       2.921  -1.349   6.074  1.00  2.790          C  
ATOM     52  C   GLY A   4       1.518  -0.845   5.713  1.00  2.730          C  
ATOM     53  O   GLY A   4       0.932  -1.205   4.692  1.00  2.780          O  
ATOM     54  H   GLY A   4       3.407  -3.352   5.495  1.00  3.260          H  
ATOM     55 1HA  GLY A   4       2.906  -1.727   7.097  1.00  3.350          H  
ATOM     56 2HA  GLY A   4       3.611  -0.507   6.081  1.00  3.350          H  
ATOM     57  N   CYS A   5       0.985  -0.011   6.605  1.00  2.970          N  
ATOM     58  CA  CYS A   5      -0.318   0.629   6.484  1.00  3.090          C  
ATOM     59  C   CYS A   5      -0.280   1.797   5.488  1.00  3.000          C  
ATOM     60  O   CYS A   5       0.504   2.716   5.688  1.00  3.150          O  
ATOM     61  CB  CYS A   5      -0.756   1.170   7.844  1.00  4.280          C  
ATOM     62  SG  CYS A   5      -2.337   2.031   7.828  1.00  4.280          S  
ATOM     63  H   CYS A   5       1.542   0.203   7.419  1.00  3.560          H  
ATOM     64  HA  CYS A   5      -1.014  -0.141   6.171  1.00  3.710          H  
ATOM     65 1HB  CYS A   5      -0.827   0.349   8.558  1.00  5.130          H  
ATOM     66 2HB  CYS A   5      -0.004   1.862   8.216  1.00  5.130          H  
ATOM     67  HG  CYS A   5      -2.307   2.404   9.101  1.00  5.130          H  
ATOM     68  N   PRO A   6      -1.157   1.867   4.473  1.00  3.090          N  
ATOM     69  CA  PRO A   6      -1.155   2.901   3.447  1.00  3.370          C  
ATOM     70  C   PRO A   6      -1.343   4.338   3.958  1.00  3.210          C  
ATOM     71  O   PRO A   6      -0.990   5.282   3.267  1.00  3.020          O  
ATOM     72  CB  PRO A   6      -2.323   2.477   2.546  1.00  5.050          C  
ATOM     73  CG  PRO A   6      -3.202   1.603   3.407  1.00  5.050          C  
ATOM     74  CD  PRO A   6      -2.248   0.877   4.329  1.00  5.050          C  
ATOM     75  HA  PRO A   6      -0.212   2.824   2.895  1.00  4.040          H  
ATOM     76 1HB  PRO A   6      -2.852   3.368   2.178  1.00  6.070          H  
ATOM     77 2HB  PRO A   6      -1.937   1.953   1.659  1.00  6.070          H  
ATOM     78 1HG  PRO A   6      -3.934   2.224   3.952  1.00  6.070          H  
ATOM     79 2HG  PRO A   6      -3.785   0.918   2.772  1.00  6.070          H  
ATOM     80 1HD  PRO A   6      -2.779   0.695   5.266  1.00  6.070          H  
ATOM     81 2HD  PRO A   6      -1.867  -0.053   3.868  1.00  6.070          H  
ATOM     82  N   SER A   7      -1.899   4.549   5.144  1.00  3.450          N  
ATOM     83  CA  SER A   7      -2.052   5.920   5.620  1.00  3.460          C  
ATOM     84  C   SER A   7      -0.814   6.395   6.391  1.00  2.940          C  
ATOM     85  O   SER A   7      -0.697   7.568   6.774  1.00  2.950          O  
ATOM     86  CB  SER A   7      -3.283   6.035   6.497  1.00  4.840          C  
ATOM     87  OG  SER A   7      -3.133   5.317   7.692  1.00  4.840          O  
ATOM     88  H   SER A   7      -2.242   3.809   5.744  1.00  4.140          H  
ATOM     89  HA  SER A   7      -2.183   6.573   4.757  1.00  4.150          H  
ATOM     90 1HB  SER A   7      -3.472   7.086   6.723  1.00  5.810          H  
ATOM     91 2HB  SER A   7      -4.147   5.659   5.953  1.00  5.810          H  
ATOM     92  HG  SER A   7      -3.957   5.432   8.177  1.00  5.810          H  
ATOM     93  N   ALA A   8       0.124   5.485   6.647  1.00  2.680          N  
ATOM     94  CA  ALA A   8       1.275   5.802   7.471  1.00  2.520          C  
ATOM     95  C   ALA A   8       2.423   6.448   6.681  1.00  1.950          C  
ATOM     96  O   ALA A   8       3.428   5.808   6.343  1.00  1.510          O  
ATOM     97  CB  ALA A   8       1.723   4.565   8.227  1.00  3.590          C  
ATOM     98  H   ALA A   8       0.047   4.544   6.253  1.00  3.220          H  
ATOM     99  HA  ALA A   8       0.956   6.533   8.214  1.00  3.020          H  
ATOM    100 1HB  ALA A   8       2.535   4.830   8.885  1.00  4.310          H  
ATOM    101 2HB  ALA A   8       0.888   4.193   8.814  1.00  4.310          H  
ATOM    102 3HB  ALA A   8       2.026   3.817   7.572  1.00  4.310          H  
ATOM    103  N   ALA A   9       2.245   7.734   6.394  1.00  2.150          N  
ATOM    104  CA  ALA A   9       3.245   8.537   5.681  1.00  1.910          C  
ATOM    105  C   ALA A   9       4.503   8.518   6.517  1.00  1.530          C  
ATOM    106  O   ALA A   9       4.423   8.223   7.717  1.00  1.230          O  
ATOM    107  CB  ALA A   9       2.777   9.960   5.446  1.00  2.770          C  
ATOM    108  H   ALA A   9       1.339   8.128   6.671  1.00  2.580          H  
ATOM    109  HA  ALA A   9       3.465   8.068   4.737  1.00  2.290          H  
ATOM    110 1HB  ALA A   9       3.558  10.517   4.928  1.00  3.320          H  
ATOM    111 2HB  ALA A   9       1.871   9.951   4.835  1.00  3.320          H  
ATOM    112 3HB  ALA A   9       2.569  10.436   6.402  1.00  3.320          H  
ATOM    113  N   ASP A  10       5.677   8.813   5.924  1.00  1.760          N  
ATOM    114  CA  ASP A  10       6.913   8.739   6.710  1.00  1.610          C  
ATOM    115  C   ASP A  10       7.245   7.262   6.951  1.00  1.160          C  
ATOM    116  O   ASP A  10       8.117   6.708   6.267  1.00  1.030          O  
ATOM    117  CB  ASP A  10       6.888   9.553   8.038  1.00  2.310          C  
ATOM    118  CG  ASP A  10       6.879  11.095   7.849  1.00  2.310          C  
ATOM    119  OD1 ASP A  10       7.813  11.618   7.284  1.00  2.310          O  
ATOM    120  OD2 ASP A  10       5.913  11.733   8.261  1.00  2.310          O  
ATOM    121  H   ASP A  10       5.730   9.054   4.928  1.00  2.110          H  
ATOM    122  HA  ASP A  10       7.720   9.163   6.108  1.00  1.930          H  
ATOM    123 1HB  ASP A  10       6.103   9.290   8.710  1.00  2.780          H  
ATOM    124 2HB  ASP A  10       7.809   9.317   8.573  1.00  2.780          H  
ATOM    125  N   LYS A  11       6.628   6.666   7.967  1.00  1.170          N  
ATOM    126  CA  LYS A  11       6.863   5.271   8.338  1.00  1.130          C  
ATOM    127  C   LYS A  11       6.978   4.315   7.145  1.00  0.930          C  
ATOM    128  O   LYS A  11       7.876   3.469   7.148  1.00  1.230          O  
ATOM    129  CB  LYS A  11       5.748   4.779   9.257  1.00  1.600          C  
ATOM    130  CG  LYS A  11       5.906   3.332   9.736  1.00  1.600          C  
ATOM    131  CD  LYS A  11       4.804   2.939  10.718  1.00  1.600          C  
ATOM    132  CE  LYS A  11       4.960   1.488  11.167  1.00  1.600          C  
ATOM    133  NZ  LYS A  11       3.920   1.098  12.173  1.00  1.600          N  
ATOM    134  H   LYS A  11       5.899   7.212   8.429  1.00  1.400          H  
ATOM    135  HA  LYS A  11       7.806   5.227   8.884  1.00  1.360          H  
ATOM    136 1HB  LYS A  11       5.682   5.427  10.127  1.00  1.920          H  
ATOM    137 2HB  LYS A  11       4.809   4.855   8.720  1.00  1.920          H  
ATOM    138 1HG  LYS A  11       5.848   2.661   8.878  1.00  1.920          H  
ATOM    139 2HG  LYS A  11       6.881   3.201  10.207  1.00  1.920          H  
ATOM    140 1HD  LYS A  11       4.837   3.591  11.592  1.00  1.920          H  
ATOM    141 2HD  LYS A  11       3.835   3.054  10.235  1.00  1.920          H  
ATOM    142 1HE  LYS A  11       4.872   0.837  10.297  1.00  1.920          H  
ATOM    143 2HE  LYS A  11       5.949   1.354  11.607  1.00  1.920          H  
ATOM    144 1HZ  LYS A  11       4.059   0.133  12.441  1.00  1.920          H  
ATOM    145 2HZ  LYS A  11       4.001   1.688  12.991  1.00  1.920          H  
ATOM    146 3HZ  LYS A  11       2.999   1.205  11.777  1.00  1.920          H  
ATOM    147  N   LEU A  12       6.120   4.416   6.112  1.00  0.840          N  
ATOM    148  CA  LEU A  12       6.287   3.464   5.012  1.00  1.140          C  
ATOM    149  C   LEU A  12       7.540   3.668   4.172  1.00  1.250          C  
ATOM    150  O   LEU A  12       7.962   2.730   3.493  1.00  1.690          O  
ATOM    151  CB  LEU A  12       5.066   3.358   4.098  1.00  1.480          C  
ATOM    152  CG  LEU A  12       4.098   2.225   4.501  1.00  1.480          C  
ATOM    153  CD1 LEU A  12       3.527   2.523   5.807  1.00  1.480          C  
ATOM    154  CD2 LEU A  12       3.020   2.034   3.459  1.00  1.480          C  
ATOM    155  H   LEU A  12       5.336   5.078   6.126  1.00  1.010          H  
ATOM    156  HA  LEU A  12       6.385   2.484   5.465  1.00  1.370          H  
ATOM    157 1HB  LEU A  12       4.519   4.294   4.156  1.00  1.770          H  
ATOM    158 2HB  LEU A  12       5.387   3.201   3.070  1.00  1.770          H  
ATOM    159  HG  LEU A  12       4.661   1.300   4.591  1.00  1.770          H  
ATOM    160 1HD1 LEU A  12       2.870   1.748   6.096  1.00  1.770          H  
ATOM    161 2HD1 LEU A  12       4.284   2.630   6.566  1.00  1.770          H  
ATOM    162 3HD1 LEU A  12       2.978   3.441   5.695  1.00  1.770          H  
ATOM    163 1HD2 LEU A  12       2.364   1.213   3.758  1.00  1.770          H  
ATOM    164 2HD2 LEU A  12       2.449   2.911   3.370  1.00  1.770          H  
ATOM    165 3HD2 LEU A  12       3.489   1.796   2.511  1.00  1.770          H  
ATOM    166  N   TRP A  13       8.165   4.851   4.196  1.00  1.020          N  
ATOM    167  CA  TRP A  13       9.417   5.006   3.472  1.00  1.180          C  
ATOM    168  C   TRP A  13      10.400   4.073   4.133  1.00  1.350          C  
ATOM    169  O   TRP A  13      11.058   3.272   3.466  1.00  1.780          O  
ATOM    170  CB  TRP A  13       9.883   6.470   3.484  1.00  1.590          C  
ATOM    171  CG  TRP A  13      11.309   6.769   3.002  1.00  1.590          C  
ATOM    172  CD1 TRP A  13      12.158   7.592   3.675  1.00  1.590          C  
ATOM    173  CD2 TRP A  13      12.087   6.246   1.879  1.00  1.590          C  
ATOM    174  NE1 TRP A  13      13.367   7.661   3.039  1.00  1.590          N  
ATOM    175  CE2 TRP A  13      13.349   6.847   1.949  1.00  1.590          C  
ATOM    176  CE3 TRP A  13      11.837   5.338   0.860  1.00  1.590          C  
ATOM    177  CZ2 TRP A  13      14.350   6.574   1.026  1.00  1.590          C  
ATOM    178  CZ3 TRP A  13      12.852   5.058  -0.045  1.00  1.590          C  
ATOM    179  CH2 TRP A  13      14.061   5.661   0.038  1.00  1.590          C  
ATOM    180  H   TRP A  13       7.827   5.632   4.762  1.00  1.220          H  
ATOM    181  HA  TRP A  13       9.272   4.691   2.441  1.00  1.420          H  
ATOM    182 1HB  TRP A  13       9.191   7.077   2.929  1.00  1.910          H  
ATOM    183 2HB  TRP A  13       9.839   6.823   4.511  1.00  1.910          H  
ATOM    184  HD1 TRP A  13      11.904   8.129   4.591  1.00  1.910          H  
ATOM    185  HE1 TRP A  13      14.162   8.213   3.342  1.00  1.910          H  
ATOM    186  HE3 TRP A  13      10.883   4.850   0.780  1.00  1.910          H  
ATOM    187  HZ2 TRP A  13      15.341   7.039   1.079  1.00  1.910          H  
ATOM    188  HZ3 TRP A  13      12.666   4.348  -0.832  1.00  1.910          H  
ATOM    189  HH2 TRP A  13      14.822   5.410  -0.690  1.00  1.910          H  
ATOM    190  N   ASP A  14      10.382   4.061   5.467  1.00  1.250          N  
ATOM    191  CA  ASP A  14      11.326   3.217   6.180  1.00  1.700          C  
ATOM    192  C   ASP A  14      10.938   1.740   6.172  1.00  2.140          C  
ATOM    193  O   ASP A  14      11.811   0.882   6.006  1.00  2.470          O  
ATOM    194  CB  ASP A  14      11.451   3.681   7.626  1.00  2.200          C  
ATOM    195  CG  ASP A  14      12.171   5.005   7.752  1.00  2.200          C  
ATOM    196  OD1 ASP A  14      13.345   5.065   7.433  1.00  2.200          O  
ATOM    197  OD2 ASP A  14      11.555   5.948   8.168  1.00  2.200          O  
ATOM    198  H   ASP A  14       9.774   4.741   5.946  1.00  1.500          H  
ATOM    199  HA  ASP A  14      12.292   3.328   5.716  1.00  2.040          H  
ATOM    200 1HB  ASP A  14      10.449   3.782   8.056  1.00  2.640          H  
ATOM    201 2HB  ASP A  14      11.981   2.926   8.208  1.00  2.640          H  
ATOM    202  N   GLU A  15       9.651   1.409   6.272  1.00  2.240          N  
ATOM    203  CA  GLU A  15       9.308  -0.013   6.267  1.00  2.810          C  
ATOM    204  C   GLU A  15       9.606  -0.671   4.918  1.00  3.000          C  
ATOM    205  O   GLU A  15      10.147  -1.792   4.871  1.00  3.430          O  
ATOM    206  CB  GLU A  15       7.820  -0.222   6.598  1.00  3.710          C  
ATOM    207  CG  GLU A  15       7.424   0.073   8.047  1.00  3.710          C  
ATOM    208  CD  GLU A  15       8.033  -0.895   9.025  1.00  3.710          C  
ATOM    209  OE1 GLU A  15       7.913  -2.077   8.803  1.00  3.710          O  
ATOM    210  OE2 GLU A  15       8.617  -0.463   9.988  1.00  3.710          O  
ATOM    211  H   GLU A  15       8.944   2.131   6.423  1.00  2.690          H  
ATOM    212  HA  GLU A  15       9.905  -0.512   7.031  1.00  3.370          H  
ATOM    213 1HB  GLU A  15       7.217   0.405   5.949  1.00  4.450          H  
ATOM    214 2HB  GLU A  15       7.549  -1.255   6.383  1.00  4.450          H  
ATOM    215 1HG  GLU A  15       7.758   1.078   8.301  1.00  4.450          H  
ATOM    216 2HG  GLU A  15       6.339   0.047   8.130  1.00  4.450          H  
ATOM    217  N   ASN A  16       9.318   0.038   3.821  1.00  2.800          N  
ATOM    218  CA  ASN A  16       9.509  -0.531   2.506  1.00  3.100          C  
ATOM    219  C   ASN A  16      10.958  -0.496   2.060  1.00  2.660          C  
ATOM    220  O   ASN A  16      11.410  -1.433   1.386  1.00  2.530          O  
ATOM    221  CB  ASN A  16       8.604   0.149   1.504  1.00  4.220          C  
ATOM    222  CG  ASN A  16       7.145  -0.245   1.677  1.00  4.220          C  
ATOM    223  OD1 ASN A  16       6.664  -1.219   1.089  1.00  4.220          O  
ATOM    224  ND2 ASN A  16       6.454   0.462   2.487  1.00  4.220          N  
ATOM    225  H   ASN A  16       8.901   0.972   3.895  1.00  3.360          H  
ATOM    226  HA  ASN A  16       9.222  -1.580   2.553  1.00  3.720          H  
ATOM    227 1HB  ASN A  16       8.709   1.231   1.570  1.00  5.060          H  
ATOM    228 2HB  ASN A  16       8.923  -0.165   0.529  1.00  5.060          H  
ATOM    229 1HD2 ASN A  16       5.491   0.200   2.688  1.00  5.060          H  
ATOM    230 2HD2 ASN A  16       6.883   1.253   2.960  1.00  5.060          H  
ATOM    231  N   LYS A  17      11.726   0.543   2.435  1.00  2.480          N  
ATOM    232  CA  LYS A  17      13.095   0.537   1.974  1.00  2.180          C  
ATOM    233  C   LYS A  17      13.880  -0.440   2.820  1.00  1.880          C  
ATOM    234  O   LYS A  17      14.776  -1.101   2.321  1.00  1.810          O  
ATOM    235  CB  LYS A  17      13.752   1.919   2.009  1.00  3.170          C  
ATOM    236  CG  LYS A  17      14.185   2.445   3.379  1.00  3.170          C  
ATOM    237  CD  LYS A  17      14.831   3.803   3.214  1.00  3.170          C  
ATOM    238  CE  LYS A  17      15.007   4.614   4.513  1.00  3.170          C  
ATOM    239  NZ  LYS A  17      15.887   3.959   5.530  1.00  3.170          N  
ATOM    240  H   LYS A  17      11.369   1.344   2.968  1.00  2.980          H  
ATOM    241  HA  LYS A  17      13.115   0.189   0.947  1.00  2.620          H  
ATOM    242 1HB  LYS A  17      14.595   1.942   1.339  1.00  3.810          H  
ATOM    243 2HB  LYS A  17      13.031   2.637   1.633  1.00  3.810          H  
ATOM    244 1HG  LYS A  17      13.337   2.507   4.010  1.00  3.810          H  
ATOM    245 2HG  LYS A  17      14.905   1.778   3.831  1.00  3.810          H  
ATOM    246 1HD  LYS A  17      15.792   3.705   2.718  1.00  3.810          H  
ATOM    247 2HD  LYS A  17      14.187   4.341   2.589  1.00  3.810          H  
ATOM    248 1HE  LYS A  17      15.445   5.576   4.244  1.00  3.810          H  
ATOM    249 2HE  LYS A  17      14.025   4.792   4.947  1.00  3.810          H  
ATOM    250 1HZ  LYS A  17      15.957   4.568   6.345  1.00  3.810          H  
ATOM    251 2HZ  LYS A  17      15.487   3.082   5.807  1.00  3.810          H  
ATOM    252 3HZ  LYS A  17      16.809   3.807   5.147  1.00  3.810          H  
ATOM    253  N   SER A  18      13.524  -0.629   4.093  1.00  1.940          N  
ATOM    254  CA  SER A  18      14.295  -1.561   4.894  1.00  1.870          C  
ATOM    255  C   SER A  18      14.271  -2.948   4.263  1.00  1.780          C  
ATOM    256  O   SER A  18      15.325  -3.573   4.067  1.00  1.720          O  
ATOM    257  CB  SER A  18      13.740  -1.621   6.302  1.00  2.650          C  
ATOM    258  OG  SER A  18      14.464  -2.523   7.094  1.00  2.650          O  
ATOM    259  H   SER A  18      12.776  -0.095   4.543  1.00  2.330          H  
ATOM    260  HA  SER A  18      15.328  -1.214   4.933  1.00  2.240          H  
ATOM    261 1HB  SER A  18      13.782  -0.628   6.746  1.00  3.180          H  
ATOM    262 2HB  SER A  18      12.688  -1.917   6.267  1.00  3.180          H  
ATOM    263  HG  SER A  18      14.057  -2.490   7.961  1.00  3.180          H  
ATOM    264  N   HIS A  19      13.079  -3.409   3.858  1.00  1.930          N  
ATOM    265  CA  HIS A  19      12.991  -4.734   3.269  1.00  1.990          C  
ATOM    266  C   HIS A  19      13.654  -4.782   1.886  1.00  1.750          C  
ATOM    267  O   HIS A  19      14.389  -5.734   1.574  1.00  1.750          O  
ATOM    268  CB  HIS A  19      11.527  -5.148   3.133  1.00  2.760          C  
ATOM    269  CG  HIS A  19      10.828  -5.468   4.429  1.00  2.760          C  
ATOM    270  ND1 HIS A  19      10.273  -4.498   5.237  1.00  2.760          N  
ATOM    271  CD2 HIS A  19      10.586  -6.652   5.038  1.00  2.760          C  
ATOM    272  CE1 HIS A  19       9.718  -5.071   6.288  1.00  2.760          C  
ATOM    273  NE2 HIS A  19       9.895  -6.383   6.196  1.00  2.760          N  
ATOM    274  H   HIS A  19      12.236  -2.851   4.025  1.00  2.320          H  
ATOM    275  HA  HIS A  19      13.496  -5.453   3.912  1.00  2.390          H  
ATOM    276 1HB  HIS A  19      10.981  -4.329   2.662  1.00  3.310          H  
ATOM    277 2HB  HIS A  19      11.451  -6.013   2.479  1.00  3.310          H  
ATOM    278  HD1 HIS A  19      10.178  -3.503   5.027  1.00  3.310          H  
ATOM    279  HD2 HIS A  19      10.828  -7.680   4.773  1.00  3.310          H  
ATOM    280  HE1 HIS A  19       9.221  -4.459   7.047  1.00  3.310          H  
ATOM    281  N   PHE A  20      13.406  -3.751   1.063  1.00  1.650          N  
ATOM    282  CA  PHE A  20      13.973  -3.691  -0.274  1.00  1.540          C  
ATOM    283  C   PHE A  20      15.476  -3.705  -0.258  1.00  1.290          C  
ATOM    284  O   PHE A  20      16.109  -4.480  -0.979  1.00  1.230          O  
ATOM    285  CB  PHE A  20      13.582  -2.412  -1.001  1.00  2.200          C  
ATOM    286  CG  PHE A  20      14.237  -2.313  -2.339  1.00  2.200          C  
ATOM    287  CD1 PHE A  20      13.684  -2.943  -3.416  1.00  2.200          C  
ATOM    288  CD2 PHE A  20      15.433  -1.620  -2.517  1.00  2.200          C  
ATOM    289  CE1 PHE A  20      14.277  -2.882  -4.640  1.00  2.200          C  
ATOM    290  CE2 PHE A  20      16.022  -1.562  -3.726  1.00  2.200          C  
ATOM    291  CZ  PHE A  20      15.441  -2.196  -4.798  1.00  2.200          C  
ATOM    292  H   PHE A  20      12.785  -2.990   1.354  1.00  1.980          H  
ATOM    293  HA  PHE A  20      13.622  -4.555  -0.837  1.00  1.850          H  
ATOM    294 1HB  PHE A  20      12.501  -2.363  -1.129  1.00  2.640          H  
ATOM    295 2HB  PHE A  20      13.882  -1.555  -0.411  1.00  2.640          H  
ATOM    296  HD1 PHE A  20      12.760  -3.498  -3.288  1.00  2.640          H  
ATOM    297  HD2 PHE A  20      15.902  -1.122  -1.682  1.00  2.640          H  
ATOM    298  HE1 PHE A  20      13.815  -3.390  -5.492  1.00  2.640          H  
ATOM    299  HE2 PHE A  20      16.957  -1.016  -3.839  1.00  2.640          H  
ATOM    300  HZ  PHE A  20      15.907  -2.159  -5.773  1.00  2.640          H  
ATOM    301  N   ILE A  21      16.040  -2.808   0.548  1.00  1.260          N  
ATOM    302  CA  ILE A  21      17.455  -2.585   0.607  1.00  1.150          C  
ATOM    303  C   ILE A  21      18.187  -3.806   1.069  1.00  1.080          C  
ATOM    304  O   ILE A  21      19.221  -4.121   0.486  1.00  1.020          O  
ATOM    305  CB  ILE A  21      17.801  -1.358   1.469  1.00  1.650          C  
ATOM    306  CG1 ILE A  21      17.287  -0.081   0.712  1.00  1.650          C  
ATOM    307  CG2 ILE A  21      19.290  -1.301   1.744  1.00  1.650          C  
ATOM    308  CD1 ILE A  21      17.318   1.193   1.494  1.00  1.650          C  
ATOM    309  H   ILE A  21      15.446  -2.236   1.138  1.00  1.510          H  
ATOM    310  HA  ILE A  21      17.794  -2.353  -0.395  1.00  1.380          H  
ATOM    311  HB  ILE A  21      17.265  -1.417   2.416  1.00  1.980          H  
ATOM    312 1HG1 ILE A  21      17.850   0.055  -0.181  1.00  1.980          H  
ATOM    313 2HG1 ILE A  21      16.255  -0.252   0.435  1.00  1.980          H  
ATOM    314 1HG2 ILE A  21      19.528  -0.433   2.347  1.00  1.980          H  
ATOM    315 2HG2 ILE A  21      19.616  -2.188   2.282  1.00  1.980          H  
ATOM    316 3HG2 ILE A  21      19.805  -1.239   0.809  1.00  1.980          H  
ATOM    317 1HD1 ILE A  21      16.919   1.988   0.879  1.00  1.980          H  
ATOM    318 2HD1 ILE A  21      16.715   1.078   2.385  1.00  1.980          H  
ATOM    319 3HD1 ILE A  21      18.331   1.446   1.779  1.00  1.980          H  
ATOM    320  N   GLU A  22      17.733  -4.498   2.114  1.00  1.190          N  
ATOM    321  CA  GLU A  22      18.489  -5.685   2.469  1.00  1.230          C  
ATOM    322  C   GLU A  22      18.540  -6.693   1.315  1.00  1.150          C  
ATOM    323  O   GLU A  22      19.611  -7.222   1.000  1.00  1.200          O  
ATOM    324  CB  GLU A  22      17.941  -6.378   3.713  1.00  1.710          C  
ATOM    325  CG  GLU A  22      18.766  -7.615   4.066  1.00  1.710          C  
ATOM    326  CD  GLU A  22      18.388  -8.333   5.299  1.00  1.710          C  
ATOM    327  OE1 GLU A  22      17.478  -7.926   5.978  1.00  1.710          O  
ATOM    328  OE2 GLU A  22      19.034  -9.329   5.562  1.00  1.710          O  
ATOM    329  H   GLU A  22      16.897  -4.204   2.638  1.00  1.430          H  
ATOM    330  HA  GLU A  22      19.512  -5.380   2.687  1.00  1.480          H  
ATOM    331 1HB  GLU A  22      17.955  -5.690   4.557  1.00  2.050          H  
ATOM    332 2HB  GLU A  22      16.905  -6.678   3.541  1.00  2.050          H  
ATOM    333 1HG  GLU A  22      18.654  -8.320   3.256  1.00  2.050          H  
ATOM    334 2HG  GLU A  22      19.819  -7.335   4.119  1.00  2.050          H  
ATOM    335  N   ASP A  23      17.400  -6.954   0.652  1.00  1.200          N  
ATOM    336  CA  ASP A  23      17.403  -7.953  -0.421  1.00  1.320          C  
ATOM    337  C   ASP A  23      18.281  -7.503  -1.590  1.00  1.270          C  
ATOM    338  O   ASP A  23      19.082  -8.280  -2.141  1.00  1.420          O  
ATOM    339  CB  ASP A  23      15.976  -8.195  -0.922  1.00  1.800          C  
ATOM    340  CG  ASP A  23      15.875  -9.375  -1.884  1.00  1.800          C  
ATOM    341  OD1 ASP A  23      16.022 -10.492  -1.433  1.00  1.800          O  
ATOM    342  OD2 ASP A  23      15.691  -9.162  -3.072  1.00  1.800          O  
ATOM    343  H   ASP A  23      16.520  -6.491   0.921  1.00  1.440          H  
ATOM    344  HA  ASP A  23      17.802  -8.885  -0.023  1.00  1.580          H  
ATOM    345 1HB  ASP A  23      15.321  -8.375  -0.067  1.00  2.160          H  
ATOM    346 2HB  ASP A  23      15.611  -7.291  -1.419  1.00  2.160          H  
ATOM    347  N   PHE A  24      18.126  -6.232  -1.947  1.00  1.140          N  
ATOM    348  CA  PHE A  24      18.843  -5.578  -3.012  1.00  1.200          C  
ATOM    349  C   PHE A  24      20.333  -5.658  -2.781  1.00  1.070          C  
ATOM    350  O   PHE A  24      21.078  -6.107  -3.653  1.00  1.240          O  
ATOM    351  CB  PHE A  24      18.382  -4.134  -3.076  1.00  1.660          C  
ATOM    352  CG  PHE A  24      19.067  -3.258  -4.025  1.00  1.660          C  
ATOM    353  CD1 PHE A  24      18.721  -3.256  -5.354  1.00  1.660          C  
ATOM    354  CD2 PHE A  24      20.058  -2.411  -3.587  1.00  1.660          C  
ATOM    355  CE1 PHE A  24      19.349  -2.420  -6.228  1.00  1.660          C  
ATOM    356  CE2 PHE A  24      20.687  -1.580  -4.462  1.00  1.660          C  
ATOM    357  CZ  PHE A  24      20.334  -1.580  -5.779  1.00  1.660          C  
ATOM    358  H   PHE A  24      17.433  -5.666  -1.449  1.00  1.370          H  
ATOM    359  HA  PHE A  24      18.605  -6.083  -3.951  1.00  1.440          H  
ATOM    360 1HB  PHE A  24      17.317  -4.126  -3.306  1.00  1.990          H  
ATOM    361 2HB  PHE A  24      18.485  -3.702  -2.098  1.00  1.990          H  
ATOM    362  HD1 PHE A  24      17.933  -3.926  -5.700  1.00  1.990          H  
ATOM    363  HD2 PHE A  24      20.335  -2.412  -2.533  1.00  1.990          H  
ATOM    364  HE1 PHE A  24      19.074  -2.420  -7.282  1.00  1.990          H  
ATOM    365  HE2 PHE A  24      21.480  -0.910  -4.118  1.00  1.990          H  
ATOM    366  HZ  PHE A  24      20.841  -0.916  -6.478  1.00  1.990          H  
ATOM    367  N   CYS A  25      20.761  -5.258  -1.580  1.00  0.930          N  
ATOM    368  CA  CYS A  25      22.163  -5.244  -1.253  1.00  1.040          C  
ATOM    369  C   CYS A  25      22.748  -6.636  -1.294  1.00  1.180          C  
ATOM    370  O   CYS A  25      23.836  -6.815  -1.828  1.00  1.300          O  
ATOM    371  CB  CYS A  25      22.381  -4.638   0.119  1.00  1.410          C  
ATOM    372  SG  CYS A  25      22.033  -2.896   0.158  1.00  1.410          S  
ATOM    373  H   CYS A  25      20.094  -4.929  -0.887  1.00  1.120          H  
ATOM    374  HA  CYS A  25      22.672  -4.622  -1.981  1.00  1.250          H  
ATOM    375 1HB  CYS A  25      21.737  -5.137   0.851  1.00  1.690          H  
ATOM    376 2HB  CYS A  25      23.413  -4.787   0.424  1.00  1.690          H  
ATOM    377  HG  CYS A  25      20.689  -3.077   0.253  1.00  1.690          H  
ATOM    378  N   TRP A  26      22.040  -7.670  -0.825  1.00  1.270          N  
ATOM    379  CA  TRP A  26      22.673  -8.982  -0.910  1.00  1.500          C  
ATOM    380  C   TRP A  26      22.995  -9.334  -2.362  1.00  1.580          C  
ATOM    381  O   TRP A  26      24.102  -9.812  -2.662  1.00  1.790          O  
ATOM    382  CB  TRP A  26      21.800 -10.086  -0.305  1.00  2.010          C  
ATOM    383  CG  TRP A  26      21.793 -10.117   1.198  1.00  2.010          C  
ATOM    384  CD1 TRP A  26      20.727  -9.910   2.019  1.00  2.010          C  
ATOM    385  CD2 TRP A  26      22.927 -10.355   2.066  1.00  2.010          C  
ATOM    386  NE1 TRP A  26      21.114 -10.012   3.338  1.00  2.010          N  
ATOM    387  CE2 TRP A  26      22.455 -10.280   3.383  1.00  2.010          C  
ATOM    388  CE3 TRP A  26      24.287 -10.624   1.837  1.00  2.010          C  
ATOM    389  CZ2 TRP A  26      23.291 -10.458   4.466  1.00  2.010          C  
ATOM    390  CZ3 TRP A  26      25.121 -10.800   2.926  1.00  2.010          C  
ATOM    391  CH2 TRP A  26      24.637 -10.720   4.207  1.00  2.010          C  
ATOM    392  H   TRP A  26      21.136  -7.534  -0.352  1.00  1.520          H  
ATOM    393  HA  TRP A  26      23.605  -8.941  -0.358  1.00  1.800          H  
ATOM    394 1HB  TRP A  26      20.767  -9.939  -0.639  1.00  2.410          H  
ATOM    395 2HB  TRP A  26      22.128 -11.055  -0.672  1.00  2.410          H  
ATOM    396  HD1 TRP A  26      19.715  -9.696   1.681  1.00  2.410          H  
ATOM    397  HE1 TRP A  26      20.476  -9.890   4.166  1.00  2.410          H  
ATOM    398  HE3 TRP A  26      24.681 -10.692   0.825  1.00  2.410          H  
ATOM    399  HZ2 TRP A  26      22.926 -10.399   5.492  1.00  2.410          H  
ATOM    400  HZ3 TRP A  26      26.175 -11.007   2.741  1.00  2.410          H  
ATOM    401  HH2 TRP A  26      25.322 -10.866   5.041  1.00  2.410          H  
ATOM    402  N   LYS A  27      22.056  -9.051  -3.272  1.00  1.490          N  
ATOM    403  CA  LYS A  27      22.280  -9.333  -4.684  1.00  1.690          C  
ATOM    404  C   LYS A  27      23.446  -8.497  -5.234  1.00  1.570          C  
ATOM    405  O   LYS A  27      24.305  -9.019  -5.970  1.00  1.820          O  
ATOM    406  CB  LYS A  27      20.991  -9.069  -5.466  1.00  2.290          C  
ATOM    407  CG  LYS A  27      19.891 -10.103  -5.190  1.00  2.290          C  
ATOM    408  CD  LYS A  27      18.611  -9.816  -5.986  1.00  2.290          C  
ATOM    409  CE  LYS A  27      17.595 -10.957  -5.847  1.00  2.290          C  
ATOM    410  NZ  LYS A  27      17.037 -11.073  -4.463  1.00  2.290          N  
ATOM    411  H   LYS A  27      21.153  -8.675  -2.950  1.00  1.790          H  
ATOM    412  HA  LYS A  27      22.542 -10.382  -4.786  1.00  2.030          H  
ATOM    413 1HB  LYS A  27      20.600  -8.088  -5.198  1.00  2.740          H  
ATOM    414 2HB  LYS A  27      21.204  -9.061  -6.533  1.00  2.740          H  
ATOM    415 1HG  LYS A  27      20.259 -11.096  -5.442  1.00  2.740          H  
ATOM    416 2HG  LYS A  27      19.657 -10.082  -4.124  1.00  2.740          H  
ATOM    417 1HD  LYS A  27      18.154  -8.899  -5.601  1.00  2.740          H  
ATOM    418 2HD  LYS A  27      18.851  -9.672  -7.037  1.00  2.740          H  
ATOM    419 1HE  LYS A  27      16.774 -10.793  -6.544  1.00  2.740          H  
ATOM    420 2HE  LYS A  27      18.090 -11.892  -6.101  1.00  2.740          H  
ATOM    421 1HZ  LYS A  27      16.388 -11.833  -4.412  1.00  2.740          H  
ATOM    422 2HZ  LYS A  27      17.772 -11.232  -3.792  1.00  2.740          H  
ATOM    423 3HZ  LYS A  27      16.538 -10.229  -4.172  1.00  2.740          H  
ATOM    424  N   LEU A  28      23.518  -7.219  -4.854  1.00  1.230          N  
ATOM    425  CA  LEU A  28      24.615  -6.381  -5.307  1.00  1.210          C  
ATOM    426  C   LEU A  28      25.946  -6.829  -4.766  1.00  1.330          C  
ATOM    427  O   LEU A  28      26.905  -6.915  -5.509  1.00  1.450          O  
ATOM    428  CB  LEU A  28      24.439  -4.933  -4.892  1.00  1.700          C  
ATOM    429  CG  LEU A  28      23.761  -3.993  -5.858  1.00  1.700          C  
ATOM    430  CD1 LEU A  28      22.362  -4.435  -6.177  1.00  1.700          C  
ATOM    431  CD2 LEU A  28      23.784  -2.654  -5.218  1.00  1.700          C  
ATOM    432  H   LEU A  28      22.763  -6.823  -4.276  1.00  1.480          H  
ATOM    433  HA  LEU A  28      24.659  -6.436  -6.393  1.00  1.450          H  
ATOM    434 1HB  LEU A  28      23.860  -4.927  -3.976  1.00  2.040          H  
ATOM    435 2HB  LEU A  28      25.429  -4.526  -4.665  1.00  2.040          H  
ATOM    436  HG  LEU A  28      24.311  -3.971  -6.786  1.00  2.040          H  
ATOM    437 1HD1 LEU A  28      21.913  -3.734  -6.872  1.00  2.040          H  
ATOM    438 2HD1 LEU A  28      22.370  -5.422  -6.631  1.00  2.040          H  
ATOM    439 3HD1 LEU A  28      21.776  -4.462  -5.271  1.00  2.040          H  
ATOM    440 1HD2 LEU A  28      23.336  -1.909  -5.872  1.00  2.040          H  
ATOM    441 2HD2 LEU A  28      23.236  -2.703  -4.282  1.00  2.040          H  
ATOM    442 3HD2 LEU A  28      24.801  -2.400  -5.016  1.00  2.040          H  
ATOM    443  N   HIS A  29      26.008  -7.232  -3.503  1.00  1.410          N  
ATOM    444  CA  HIS A  29      27.282  -7.634  -2.933  1.00  1.690          C  
ATOM    445  C   HIS A  29      27.840  -8.811  -3.724  1.00  1.840          C  
ATOM    446  O   HIS A  29      29.015  -8.819  -4.087  1.00  1.930          O  
ATOM    447  CB  HIS A  29      27.139  -8.012  -1.447  1.00  2.250          C  
ATOM    448  CG  HIS A  29      26.891  -6.836  -0.507  1.00  2.250          C  
ATOM    449  ND1 HIS A  29      27.760  -5.770  -0.405  1.00  2.250          N  
ATOM    450  CD2 HIS A  29      25.893  -6.591   0.377  1.00  2.250          C  
ATOM    451  CE1 HIS A  29      27.299  -4.913   0.491  1.00  2.250          C  
ATOM    452  NE2 HIS A  29      26.169  -5.385   0.979  1.00  2.250          N  
ATOM    453  H   HIS A  29      25.183  -7.168  -2.917  1.00  1.690          H  
ATOM    454  HA  HIS A  29      27.989  -6.809  -3.009  1.00  2.030          H  
ATOM    455 1HB  HIS A  29      26.298  -8.704  -1.337  1.00  2.700          H  
ATOM    456 2HB  HIS A  29      28.034  -8.533  -1.115  1.00  2.700          H  
ATOM    457  HD1 HIS A  29      28.466  -5.531  -1.073  1.00  2.700          H  
ATOM    458  HD2 HIS A  29      24.997  -7.145   0.653  1.00  2.700          H  
ATOM    459  HE1 HIS A  29      27.846  -3.997   0.713  1.00  2.700          H  
ATOM    460  N   ARG A  30      26.978  -9.753  -4.101  1.00  1.910          N  
ATOM    461  CA  ARG A  30      27.414 -10.899  -4.898  1.00  2.140          C  
ATOM    462  C   ARG A  30      28.021 -10.448  -6.239  1.00  2.010          C  
ATOM    463  O   ARG A  30      28.975 -11.053  -6.739  1.00  2.190          O  
ATOM    464  CB  ARG A  30      26.244 -11.838  -5.141  1.00  2.900          C  
ATOM    465  CG  ARG A  30      25.784 -12.594  -3.901  1.00  2.900          C  
ATOM    466  CD  ARG A  30      24.567 -13.394  -4.156  1.00  2.900          C  
ATOM    467  NE  ARG A  30      24.130 -14.104  -2.960  1.00  2.900          N  
ATOM    468  CZ  ARG A  30      22.963 -14.772  -2.835  1.00  2.900          C  
ATOM    469  NH1 ARG A  30      22.108 -14.821  -3.839  1.00  2.900          N  
ATOM    470  NH2 ARG A  30      22.677 -15.384  -1.695  1.00  2.900          N  
ATOM    471  H   ARG A  30      26.015  -9.694  -3.754  1.00  2.290          H  
ATOM    472  HA  ARG A  30      28.177 -11.435  -4.337  1.00  2.570          H  
ATOM    473 1HB  ARG A  30      25.397 -11.268  -5.511  1.00  3.480          H  
ATOM    474 2HB  ARG A  30      26.511 -12.565  -5.905  1.00  3.480          H  
ATOM    475 1HG  ARG A  30      26.574 -13.268  -3.575  1.00  3.480          H  
ATOM    476 2HG  ARG A  30      25.564 -11.886  -3.105  1.00  3.480          H  
ATOM    477 1HD  ARG A  30      23.768 -12.721  -4.468  1.00  3.480          H  
ATOM    478 2HD  ARG A  30      24.765 -14.124  -4.940  1.00  3.480          H  
ATOM    479  HE  ARG A  30      24.753 -14.097  -2.162  1.00  3.480          H  
ATOM    480 1HH1 ARG A  30      22.320 -14.361  -4.709  1.00  3.480          H  
ATOM    481 2HH1 ARG A  30      21.239 -15.327  -3.738  1.00  3.480          H  
ATOM    482 1HH2 ARG A  30      23.330 -15.351  -0.924  1.00  3.480          H  
ATOM    483 2HH2 ARG A  30      21.807 -15.888  -1.593  1.00  3.480          H  
ATOM    484  N   ARG A  31      27.467  -9.372  -6.808  1.00  1.710          N  
ATOM    485  CA  ARG A  31      27.899  -8.779  -8.072  1.00  1.580          C  
ATOM    486  C   ARG A  31      28.704  -7.475  -7.877  1.00  1.470          C  
ATOM    487  O   ARG A  31      28.868  -6.691  -8.820  1.00  1.360          O  
ATOM    488  CB  ARG A  31      26.680  -8.446  -8.917  1.00  2.260          C  
ATOM    489  CG  ARG A  31      25.872  -9.636  -9.396  1.00  2.260          C  
ATOM    490  CD  ARG A  31      24.571  -9.192  -9.977  1.00  2.260          C  
ATOM    491  NE  ARG A  31      23.784 -10.302 -10.529  1.00  2.260          N  
ATOM    492  CZ  ARG A  31      23.018 -11.163  -9.814  1.00  2.260          C  
ATOM    493  NH1 ARG A  31      22.924 -11.057  -8.503  1.00  2.260          N  
ATOM    494  NH2 ARG A  31      22.357 -12.121 -10.445  1.00  2.260          N  
ATOM    495  H   ARG A  31      26.648  -8.952  -6.346  1.00  2.050          H  
ATOM    496  HA  ARG A  31      28.522  -9.500  -8.597  1.00  1.900          H  
ATOM    497 1HB  ARG A  31      26.012  -7.814  -8.329  1.00  2.720          H  
ATOM    498 2HB  ARG A  31      26.984  -7.880  -9.794  1.00  2.720          H  
ATOM    499 1HG  ARG A  31      26.428 -10.175 -10.159  1.00  2.720          H  
ATOM    500 2HG  ARG A  31      25.679 -10.296  -8.550  1.00  2.720          H  
ATOM    501 1HD  ARG A  31      23.978  -8.694  -9.207  1.00  2.720          H  
ATOM    502 2HD  ARG A  31      24.768  -8.487 -10.784  1.00  2.720          H  
ATOM    503  HE  ARG A  31      23.817 -10.433 -11.533  1.00  2.720          H  
ATOM    504 1HH1 ARG A  31      23.435 -10.327  -8.015  1.00  2.720          H  
ATOM    505 2HH1 ARG A  31      22.349 -11.704  -7.984  1.00  2.720          H  
ATOM    506 1HH2 ARG A  31      22.427 -12.204 -11.451  1.00  2.720          H  
ATOM    507 2HH2 ARG A  31      21.783 -12.769  -9.927  1.00  2.720          H  
ATOM    508  N   GLU A  32      29.142  -7.212  -6.641  1.00  1.630          N  
ATOM    509  CA  GLU A  32      29.856  -6.011  -6.183  1.00  1.680          C  
ATOM    510  C   GLU A  32      28.935  -4.774  -6.189  1.00  1.450          C  
ATOM    511  O   GLU A  32      28.649  -4.194  -5.141  1.00  1.900          O  
ATOM    512  CB  GLU A  32      31.117  -5.723  -7.023  1.00  2.330          C  
ATOM    513  CG  GLU A  32      32.244  -6.751  -6.891  1.00  2.330          C  
ATOM    514  CD  GLU A  32      33.438  -6.416  -7.762  1.00  2.330          C  
ATOM    515  OE1 GLU A  32      33.312  -5.529  -8.571  1.00  2.330          O  
ATOM    516  OE2 GLU A  32      34.463  -7.041  -7.615  1.00  2.330          O  
ATOM    517  H   GLU A  32      28.953  -7.904  -5.915  1.00  1.960          H  
ATOM    518  HA  GLU A  32      30.166  -6.187  -5.151  1.00  2.020          H  
ATOM    519 1HB  GLU A  32      30.874  -5.627  -8.071  1.00  2.800          H  
ATOM    520 2HB  GLU A  32      31.527  -4.763  -6.712  1.00  2.800          H  
ATOM    521 1HG  GLU A  32      32.563  -6.796  -5.850  1.00  2.800          H  
ATOM    522 2HG  GLU A  32      31.856  -7.731  -7.167  1.00  2.800          H  
ATOM    523  N   GLY A  33      28.465  -4.399  -7.381  1.00  1.260          N  
ATOM    524  CA  GLY A  33      27.517  -3.305  -7.579  1.00  1.500          C  
ATOM    525  C   GLY A  33      27.941  -2.024  -6.876  1.00  1.280          C  
ATOM    526  O   GLY A  33      29.120  -1.665  -6.834  1.00  1.310          O  
ATOM    527  H   GLY A  33      28.761  -4.969  -8.174  1.00  1.510          H  
ATOM    528 1HA  GLY A  33      27.408  -3.119  -8.646  1.00  1.800          H  
ATOM    529 2HA  GLY A  33      26.544  -3.614  -7.211  1.00  1.800          H  
ATOM    530  N   ALA A  34      26.944  -1.320  -6.338  1.00  1.310          N  
ATOM    531  CA  ALA A  34      27.132  -0.113  -5.549  1.00  1.320          C  
ATOM    532  C   ALA A  34      25.906   0.081  -4.658  1.00  1.210          C  
ATOM    533  O   ALA A  34      24.887   0.617  -5.102  1.00  1.010          O  
ATOM    534  CB  ALA A  34      27.333   1.089  -6.460  1.00  1.840          C  
ATOM    535  H   ALA A  34      26.004  -1.663  -6.464  1.00  1.570          H  
ATOM    536  HA  ALA A  34      28.008  -0.246  -4.914  1.00  1.580          H  
ATOM    537 1HB  ALA A  34      27.481   1.981  -5.868  1.00  2.210          H  
ATOM    538 2HB  ALA A  34      28.213   0.926  -7.087  1.00  2.210          H  
ATOM    539 3HB  ALA A  34      26.456   1.219  -7.091  1.00  2.210          H  
ATOM    540  N   CYS A  35      26.020  -0.297  -3.381  1.00  1.660          N  
ATOM    541  CA  CYS A  35      24.867  -0.306  -2.471  1.00  1.830          C  
ATOM    542  C   CYS A  35      24.495   1.086  -2.004  1.00  1.840          C  
ATOM    543  O   CYS A  35      23.408   1.331  -1.488  1.00  1.930          O  
ATOM    544  CB  CYS A  35      25.135  -1.238  -1.294  1.00  2.490          C  
ATOM    545  SG  CYS A  35      25.258  -3.003  -1.798  1.00  2.490          S  
ATOM    546  H   CYS A  35      26.905  -0.681  -3.068  1.00  1.990          H  
ATOM    547  HA  CYS A  35      24.014  -0.713  -3.011  1.00  2.200          H  
ATOM    548 1HB  CYS A  35      26.063  -0.958  -0.798  1.00  2.990          H  
ATOM    549 2HB  CYS A  35      24.334  -1.143  -0.567  1.00  2.990          H  
ATOM    550  HG  CYS A  35      25.226  -3.531  -0.565  1.00  2.990          H  
ATOM    551  N   VAL A  36      25.369   2.028  -2.276  1.00  1.960          N  
ATOM    552  CA  VAL A  36      25.158   3.426  -1.955  1.00  2.390          C  
ATOM    553  C   VAL A  36      23.912   3.967  -2.669  1.00  2.240          C  
ATOM    554  O   VAL A  36      23.323   4.959  -2.243  1.00  2.780          O  
ATOM    555  CB  VAL A  36      26.421   4.239  -2.327  1.00  3.170          C  
ATOM    556  CG1 VAL A  36      26.564   4.347  -3.847  1.00  3.170          C  
ATOM    557  CG2 VAL A  36      26.354   5.626  -1.696  1.00  3.170          C  
ATOM    558  H   VAL A  36      26.238   1.737  -2.696  1.00  2.350          H  
ATOM    559  HA  VAL A  36      25.004   3.511  -0.877  1.00  2.870          H  
ATOM    560  HB  VAL A  36      27.294   3.708  -1.953  1.00  3.810          H  
ATOM    561 1HG1 VAL A  36      27.474   4.895  -4.087  1.00  3.810          H  
ATOM    562 2HG1 VAL A  36      26.614   3.360  -4.278  1.00  3.810          H  
ATOM    563 3HG1 VAL A  36      25.723   4.879  -4.259  1.00  3.810          H  
ATOM    564 1HG2 VAL A  36      27.257   6.179  -1.945  1.00  3.810          H  
ATOM    565 2HG2 VAL A  36      25.488   6.169  -2.072  1.00  3.810          H  
ATOM    566 3HG2 VAL A  36      26.275   5.530  -0.613  1.00  3.810          H  
ATOM    567  N   ASN A  37      23.526   3.324  -3.776  1.00  1.710          N  
ATOM    568  CA  ASN A  37      22.387   3.746  -4.565  1.00  1.920          C  
ATOM    569  C   ASN A  37      21.113   2.965  -4.223  1.00  1.670          C  
ATOM    570  O   ASN A  37      20.096   3.077  -4.930  1.00  1.790          O  
ATOM    571  CB  ASN A  37      22.730   3.578  -6.026  1.00  2.600          C  
ATOM    572  CG  ASN A  37      23.840   4.497  -6.466  1.00  2.600          C  
ATOM    573  OD1 ASN A  37      24.006   5.625  -5.980  1.00  2.600          O  
ATOM    574  ND2 ASN A  37      24.633   4.017  -7.387  1.00  2.600          N  
ATOM    575  H   ASN A  37      24.045   2.493  -4.078  1.00  2.050          H  
ATOM    576  HA  ASN A  37      22.198   4.799  -4.358  1.00  2.300          H  
ATOM    577 1HB  ASN A  37      23.040   2.544  -6.203  1.00  3.120          H  
ATOM    578 2HB  ASN A  37      21.848   3.763  -6.631  1.00  3.120          H  
ATOM    579 1HD2 ASN A  37      25.398   4.565  -7.723  1.00  3.120          H  
ATOM    580 2HD2 ASN A  37      24.480   3.099  -7.752  1.00  3.120          H  
ATOM    581  N   CYS A  38      21.145   2.194  -3.132  1.00  1.390          N  
ATOM    582  CA  CYS A  38      20.009   1.370  -2.744  1.00  1.150          C  
ATOM    583  C   CYS A  38      18.758   2.140  -2.353  1.00  1.220          C  
ATOM    584  O   CYS A  38      17.656   1.617  -2.522  1.00  1.160          O  
ATOM    585  CB  CYS A  38      20.407   0.478  -1.579  1.00  1.710          C  
ATOM    586  SG  CYS A  38      20.764   1.390  -0.071  1.00  1.710          S  
ATOM    587  H   CYS A  38      22.006   2.133  -2.583  1.00  1.670          H  
ATOM    588  HA  CYS A  38      19.745   0.747  -3.588  1.00  1.380          H  
ATOM    589 1HB  CYS A  38      19.632  -0.240  -1.389  1.00  2.050          H  
ATOM    590 2HB  CYS A  38      21.303  -0.084  -1.836  1.00  2.050          H  
ATOM    591  HG  CYS A  38      22.049   1.655  -0.406  1.00  2.050          H  
ATOM    592  N   GLU A  39      18.889   3.372  -1.860  1.00  1.410          N  
ATOM    593  CA  GLU A  39      17.688   4.130  -1.540  1.00  1.520          C  
ATOM    594  C   GLU A  39      16.990   4.583  -2.811  1.00  1.610          C  
ATOM    595  O   GLU A  39      15.762   4.628  -2.856  1.00  1.660          O  
ATOM    596  CB  GLU A  39      17.962   5.316  -0.622  1.00  2.080          C  
ATOM    597  CG  GLU A  39      18.323   4.919   0.796  1.00  2.080          C  
ATOM    598  CD  GLU A  39      18.441   6.088   1.725  1.00  2.080          C  
ATOM    599  OE1 GLU A  39      18.353   7.200   1.264  1.00  2.080          O  
ATOM    600  OE2 GLU A  39      18.599   5.868   2.904  1.00  2.080          O  
ATOM    601  H   GLU A  39      19.812   3.750  -1.679  1.00  1.690          H  
ATOM    602  HA  GLU A  39      17.005   3.473  -1.008  1.00  1.820          H  
ATOM    603 1HB  GLU A  39      18.789   5.900  -1.025  1.00  2.500          H  
ATOM    604 2HB  GLU A  39      17.094   5.965  -0.588  1.00  2.500          H  
ATOM    605 1HG  GLU A  39      17.550   4.262   1.170  1.00  2.500          H  
ATOM    606 2HG  GLU A  39      19.259   4.365   0.781  1.00  2.500          H  
ATOM    607  N   MET A  40      17.763   4.921  -3.852  1.00  1.690          N  
ATOM    608  CA  MET A  40      17.144   5.361  -5.097  1.00  1.840          C  
ATOM    609  C   MET A  40      16.403   4.186  -5.720  1.00  1.750          C  
ATOM    610  O   MET A  40      15.303   4.335  -6.270  1.00  1.800          O  
ATOM    611  CB  MET A  40      18.182   5.914  -6.063  1.00  2.520          C  
ATOM    612  CG  MET A  40      18.785   7.248  -5.640  1.00  2.520          C  
ATOM    613  SD  MET A  40      19.810   8.002  -6.929  1.00  2.520          S  
ATOM    614  CE  MET A  40      21.265   6.969  -6.906  1.00  2.520          C  
ATOM    615  H   MET A  40      18.771   4.847  -3.771  1.00  2.030          H  
ATOM    616  HA  MET A  40      16.418   6.139  -4.876  1.00  2.210          H  
ATOM    617 1HB  MET A  40      18.984   5.188  -6.167  1.00  3.020          H  
ATOM    618 2HB  MET A  40      17.728   6.044  -7.045  1.00  3.020          H  
ATOM    619 1HG  MET A  40      17.980   7.943  -5.384  1.00  3.020          H  
ATOM    620 2HG  MET A  40      19.400   7.099  -4.754  1.00  3.020          H  
ATOM    621 1HE  MET A  40      21.981   7.331  -7.644  1.00  3.020          H  
ATOM    622 2HE  MET A  40      21.720   7.005  -5.914  1.00  3.020          H  
ATOM    623 3HE  MET A  40      20.995   5.949  -7.145  1.00  3.020          H  
ATOM    624  N   HIS A  41      16.989   2.997  -5.589  1.00  1.640          N  
ATOM    625  CA  HIS A  41      16.360   1.815  -6.133  1.00  1.620          C  
ATOM    626  C   HIS A  41      15.112   1.479  -5.315  1.00  1.450          C  
ATOM    627  O   HIS A  41      14.094   1.070  -5.891  1.00  1.480          O  
ATOM    628  CB  HIS A  41      17.348   0.658  -6.202  1.00  2.280          C  
ATOM    629  CG  HIS A  41      18.367   0.794  -7.286  1.00  2.280          C  
ATOM    630  ND1 HIS A  41      19.517   1.541  -7.154  1.00  2.280          N  
ATOM    631  CD2 HIS A  41      18.406   0.258  -8.527  1.00  2.280          C  
ATOM    632  CE1 HIS A  41      20.220   1.458  -8.267  1.00  2.280          C  
ATOM    633  NE2 HIS A  41      19.568   0.683  -9.118  1.00  2.280          N  
ATOM    634  H   HIS A  41      17.912   2.938  -5.154  1.00  1.970          H  
ATOM    635  HA  HIS A  41      16.036   2.015  -7.153  1.00  1.940          H  
ATOM    636 1HB  HIS A  41      17.870   0.569  -5.253  1.00  2.730          H  
ATOM    637 2HB  HIS A  41      16.818  -0.253  -6.377  1.00  2.730          H  
ATOM    638  HD1 HIS A  41      19.742   2.191  -6.404  1.00  2.730          H  
ATOM    639  HD2 HIS A  41      17.726  -0.398  -9.070  1.00  2.730          H  
ATOM    640  HE1 HIS A  41      21.169   1.982  -8.360  1.00  2.730          H  
ATOM    641  N   ALA A  42      15.166   1.673  -3.982  1.00  1.310          N  
ATOM    642  CA  ALA A  42      13.986   1.436  -3.172  1.00  1.210          C  
ATOM    643  C   ALA A  42      12.882   2.363  -3.626  1.00  1.250          C  
ATOM    644  O   ALA A  42      11.755   1.922  -3.840  1.00  1.240          O  
ATOM    645  CB  ALA A  42      14.270   1.672  -1.694  1.00  1.730          C  
ATOM    646  H   ALA A  42      16.046   1.933  -3.533  1.00  1.570          H  
ATOM    647  HA  ALA A  42      13.658   0.412  -3.328  1.00  1.450          H  
ATOM    648 1HB  ALA A  42      13.367   1.483  -1.125  1.00  2.080          H  
ATOM    649 2HB  ALA A  42      15.056   1.015  -1.359  1.00  2.080          H  
ATOM    650 3HB  ALA A  42      14.583   2.701  -1.546  1.00  2.080          H  
ATOM    651  N   LEU A  43      13.201   3.626  -3.917  1.00  1.360          N  
ATOM    652  CA  LEU A  43      12.152   4.535  -4.343  1.00  1.440          C  
ATOM    653  C   LEU A  43      11.490   4.066  -5.617  1.00  1.450          C  
ATOM    654  O   LEU A  43      10.267   4.145  -5.726  1.00  1.420          O  
ATOM    655  CB  LEU A  43      12.710   5.945  -4.559  1.00  1.980          C  
ATOM    656  CG  LEU A  43      13.135   6.691  -3.302  1.00  1.980          C  
ATOM    657  CD1 LEU A  43      13.864   7.929  -3.662  1.00  1.980          C  
ATOM    658  CD2 LEU A  43      11.937   7.077  -2.507  1.00  1.980          C  
ATOM    659  H   LEU A  43      14.152   3.968  -3.741  1.00  1.630          H  
ATOM    660  HA  LEU A  43      11.392   4.552  -3.573  1.00  1.730          H  
ATOM    661 1HB  LEU A  43      13.581   5.873  -5.206  1.00  2.380          H  
ATOM    662 2HB  LEU A  43      11.957   6.541  -5.072  1.00  2.380          H  
ATOM    663  HG  LEU A  43      13.785   6.066  -2.727  1.00  2.380          H  
ATOM    664 1HD1 LEU A  43      14.167   8.454  -2.760  1.00  2.380          H  
ATOM    665 2HD1 LEU A  43      14.746   7.694  -4.249  1.00  2.380          H  
ATOM    666 3HD1 LEU A  43      13.209   8.559  -4.244  1.00  2.380          H  
ATOM    667 1HD2 LEU A  43      12.279   7.599  -1.643  1.00  2.380          H  
ATOM    668 2HD2 LEU A  43      11.313   7.722  -3.118  1.00  2.380          H  
ATOM    669 3HD2 LEU A  43      11.372   6.215  -2.196  1.00  2.380          H  
ATOM    670  N   ASN A  44      12.256   3.538  -6.571  1.00  1.550          N  
ATOM    671  CA  ASN A  44      11.621   3.057  -7.794  1.00  1.650          C  
ATOM    672  C   ASN A  44      10.677   1.867  -7.530  1.00  1.530          C  
ATOM    673  O   ASN A  44       9.617   1.758  -8.165  1.00  1.550          O  
ATOM    674  CB  ASN A  44      12.666   2.688  -8.824  1.00  2.270          C  
ATOM    675  CG  ASN A  44      13.331   3.898  -9.435  1.00  2.270          C  
ATOM    676  OD1 ASN A  44      12.816   5.022  -9.381  1.00  2.270          O  
ATOM    677  ND2 ASN A  44      14.478   3.686 -10.031  1.00  2.270          N  
ATOM    678  H   ASN A  44      13.278   3.555  -6.461  1.00  1.860          H  
ATOM    679  HA  ASN A  44      11.011   3.866  -8.198  1.00  1.980          H  
ATOM    680 1HB  ASN A  44      13.432   2.072  -8.348  1.00  2.720          H  
ATOM    681 2HB  ASN A  44      12.207   2.093  -9.612  1.00  2.720          H  
ATOM    682 1HD2 ASN A  44      14.967   4.448 -10.457  1.00  2.720          H  
ATOM    683 2HD2 ASN A  44      14.867   2.766 -10.061  1.00  2.720          H  
ATOM    684  N   GLU A  45      11.052   0.980  -6.592  1.00  1.430          N  
ATOM    685  CA  GLU A  45      10.222  -0.186  -6.262  1.00  1.370          C  
ATOM    686  C   GLU A  45       8.956   0.242  -5.516  1.00  1.250          C  
ATOM    687  O   GLU A  45       7.857  -0.283  -5.748  1.00  1.270          O  
ATOM    688  CB  GLU A  45      11.003  -1.175  -5.390  1.00  1.940          C  
ATOM    689  CG  GLU A  45      10.264  -2.492  -5.067  1.00  1.940          C  
ATOM    690  CD  GLU A  45      10.028  -3.357  -6.273  1.00  1.940          C  
ATOM    691  OE1 GLU A  45      10.717  -3.182  -7.251  1.00  1.940          O  
ATOM    692  OE2 GLU A  45       9.166  -4.199  -6.214  1.00  1.940          O  
ATOM    693  H   GLU A  45      11.974   1.099  -6.145  1.00  1.720          H  
ATOM    694  HA  GLU A  45       9.930  -0.679  -7.190  1.00  1.640          H  
ATOM    695 1HB  GLU A  45      11.940  -1.423  -5.886  1.00  2.330          H  
ATOM    696 2HB  GLU A  45      11.261  -0.696  -4.444  1.00  2.330          H  
ATOM    697 1HG  GLU A  45      10.836  -3.053  -4.346  1.00  2.330          H  
ATOM    698 2HG  GLU A  45       9.304  -2.256  -4.608  1.00  2.330          H  
ATOM    699  N   ILE A  46       9.127   1.191  -4.603  1.00  1.170          N  
ATOM    700  CA  ILE A  46       8.049   1.710  -3.788  1.00  1.060          C  
ATOM    701  C   ILE A  46       7.068   2.450  -4.684  1.00  1.020          C  
ATOM    702  O   ILE A  46       5.856   2.254  -4.594  1.00  0.980          O  
ATOM    703  CB  ILE A  46       8.608   2.601  -2.676  1.00  1.530          C  
ATOM    704  CG1 ILE A  46       9.408   1.738  -1.714  1.00  1.530          C  
ATOM    705  CG2 ILE A  46       7.491   3.230  -1.966  1.00  1.530          C  
ATOM    706  CD1 ILE A  46      10.270   2.497  -0.750  1.00  1.530          C  
ATOM    707  H   ILE A  46      10.075   1.548  -4.458  1.00  1.400          H  
ATOM    708  HA  ILE A  46       7.538   0.876  -3.320  1.00  1.270          H  
ATOM    709  HB  ILE A  46       9.268   3.357  -3.099  1.00  1.830          H  
ATOM    710 1HG1 ILE A  46       8.709   1.138  -1.175  1.00  1.830          H  
ATOM    711 2HG1 ILE A  46      10.047   1.074  -2.286  1.00  1.830          H  
ATOM    712 1HG2 ILE A  46       7.847   3.864  -1.170  1.00  1.830          H  
ATOM    713 2HG2 ILE A  46       6.931   3.826  -2.664  1.00  1.830          H  
ATOM    714 3HG2 ILE A  46       6.849   2.454  -1.553  1.00  1.830          H  
ATOM    715 1HD1 ILE A  46      10.802   1.797  -0.113  1.00  1.830          H  
ATOM    716 2HD1 ILE A  46      10.977   3.079  -1.319  1.00  1.830          H  
ATOM    717 3HD1 ILE A  46       9.673   3.149  -0.130  1.00  1.830          H  
ATOM    718  N   GLN A  47       7.600   3.289  -5.559  1.00  1.030          N  
ATOM    719  CA  GLN A  47       6.820   4.031  -6.515  1.00  0.990          C  
ATOM    720  C   GLN A  47       5.964   3.123  -7.369  1.00  0.990          C  
ATOM    721  O   GLN A  47       4.771   3.402  -7.549  1.00  0.940          O  
ATOM    722  CB  GLN A  47       7.763   4.836  -7.396  1.00  1.400          C  
ATOM    723  CG  GLN A  47       7.130   5.606  -8.513  1.00  1.400          C  
ATOM    724  CD  GLN A  47       8.147   6.436  -9.198  1.00  1.400          C  
ATOM    725  OE1 GLN A  47       9.209   6.735  -8.628  1.00  1.400          O  
ATOM    726  NE2 GLN A  47       7.860   6.824 -10.428  1.00  1.400          N  
ATOM    727  H   GLN A  47       8.605   3.437  -5.549  1.00  1.240          H  
ATOM    728  HA  GLN A  47       6.163   4.705  -5.970  1.00  1.190          H  
ATOM    729 1HB  GLN A  47       8.323   5.530  -6.772  1.00  1.680          H  
ATOM    730 2HB  GLN A  47       8.488   4.160  -7.841  1.00  1.680          H  
ATOM    731 1HG  GLN A  47       6.736   4.900  -9.244  1.00  1.680          H  
ATOM    732 2HG  GLN A  47       6.332   6.238  -8.154  1.00  1.680          H  
ATOM    733 1HE2 GLN A  47       8.512   7.387 -10.943  1.00  1.680          H  
ATOM    734 2HE2 GLN A  47       6.990   6.558 -10.851  1.00  1.680          H  
ATOM    735  N   GLU A  48       6.532   2.018  -7.874  1.00  1.110          N  
ATOM    736  CA  GLU A  48       5.739   1.126  -8.699  1.00  1.190          C  
ATOM    737  C   GLU A  48       4.625   0.463  -7.893  1.00  1.190          C  
ATOM    738  O   GLU A  48       3.488   0.409  -8.368  1.00  1.200          O  
ATOM    739  CB  GLU A  48       6.634   0.057  -9.336  1.00  1.630          C  
ATOM    740  CG  GLU A  48       5.936  -0.931 -10.316  1.00  1.630          C  
ATOM    741  CD  GLU A  48       5.410  -0.278 -11.581  1.00  1.630          C  
ATOM    742  OE1 GLU A  48       5.714   0.869 -11.802  1.00  1.630          O  
ATOM    743  OE2 GLU A  48       4.758  -0.944 -12.353  1.00  1.630          O  
ATOM    744  H   GLU A  48       7.534   1.835  -7.746  1.00  1.330          H  
ATOM    745  HA  GLU A  48       5.284   1.713  -9.495  1.00  1.430          H  
ATOM    746 1HB  GLU A  48       7.442   0.549  -9.877  1.00  1.960          H  
ATOM    747 2HB  GLU A  48       7.100  -0.534  -8.540  1.00  1.960          H  
ATOM    748 1HG  GLU A  48       6.647  -1.707 -10.591  1.00  1.960          H  
ATOM    749 2HG  GLU A  48       5.112  -1.408  -9.794  1.00  1.960          H  
ATOM    750  N   VAL A  49       4.893   0.007  -6.657  1.00  1.220          N  
ATOM    751  CA  VAL A  49       3.787  -0.639  -5.953  1.00  1.330          C  
ATOM    752  C   VAL A  49       2.704   0.363  -5.586  1.00  1.190          C  
ATOM    753  O   VAL A  49       1.521   0.037  -5.657  1.00  1.330          O  
ATOM    754  CB  VAL A  49       4.233  -1.454  -4.705  1.00  1.820          C  
ATOM    755  CG1 VAL A  49       4.677  -0.573  -3.542  1.00  1.820          C  
ATOM    756  CG2 VAL A  49       3.053  -2.331  -4.266  1.00  1.820          C  
ATOM    757  H   VAL A  49       5.847   0.049  -6.274  1.00  1.460          H  
ATOM    758  HA  VAL A  49       3.345  -1.360  -6.636  1.00  1.600          H  
ATOM    759  HB  VAL A  49       5.083  -2.079  -4.985  1.00  2.180          H  
ATOM    760 1HG1 VAL A  49       4.984  -1.197  -2.730  1.00  2.180          H  
ATOM    761 2HG1 VAL A  49       5.500   0.016  -3.860  1.00  2.180          H  
ATOM    762 3HG1 VAL A  49       3.875   0.068  -3.208  1.00  2.180          H  
ATOM    763 1HG2 VAL A  49       3.331  -2.937  -3.430  1.00  2.180          H  
ATOM    764 2HG2 VAL A  49       2.213  -1.703  -3.984  1.00  2.180          H  
ATOM    765 3HG2 VAL A  49       2.755  -2.976  -5.092  1.00  2.180          H  
ATOM    766  N   PHE A  50       3.078   1.594  -5.225  1.00  0.990          N  
ATOM    767  CA  PHE A  50       2.052   2.563  -4.906  1.00  0.970          C  
ATOM    768  C   PHE A  50       1.214   2.844  -6.148  1.00  0.990          C  
ATOM    769  O   PHE A  50      -0.020   2.754  -6.118  1.00  1.160          O  
ATOM    770  CB  PHE A  50       2.665   3.900  -4.466  1.00  1.370          C  
ATOM    771  CG  PHE A  50       3.376   3.957  -3.132  1.00  1.370          C  
ATOM    772  CD1 PHE A  50       3.281   2.969  -2.149  1.00  1.370          C  
ATOM    773  CD2 PHE A  50       4.142   5.059  -2.869  1.00  1.370          C  
ATOM    774  CE1 PHE A  50       3.961   3.111  -0.946  1.00  1.370          C  
ATOM    775  CE2 PHE A  50       4.801   5.202  -1.677  1.00  1.370          C  
ATOM    776  CZ  PHE A  50       4.709   4.223  -0.711  1.00  1.370          C  
ATOM    777  H   PHE A  50       4.071   1.838  -5.140  1.00  1.190          H  
ATOM    778  HA  PHE A  50       1.400   2.161  -4.133  1.00  1.160          H  
ATOM    779 1HB  PHE A  50       3.388   4.204  -5.226  1.00  1.640          H  
ATOM    780 2HB  PHE A  50       1.893   4.659  -4.462  1.00  1.640          H  
ATOM    781  HD1 PHE A  50       2.682   2.084  -2.322  1.00  1.640          H  
ATOM    782  HD2 PHE A  50       4.212   5.825  -3.631  1.00  1.640          H  
ATOM    783  HE1 PHE A  50       3.897   2.346  -0.186  1.00  1.640          H  
ATOM    784  HE2 PHE A  50       5.395   6.090  -1.484  1.00  1.640          H  
ATOM    785  HZ  PHE A  50       5.235   4.338   0.236  1.00  1.640          H  
ATOM    786  N   THR A  51       1.876   3.030  -7.293  1.00  0.910          N  
ATOM    787  CA  THR A  51       1.189   3.367  -8.532  1.00  0.970          C  
ATOM    788  C   THR A  51       0.152   2.308  -8.890  1.00  1.210          C  
ATOM    789  O   THR A  51      -1.001   2.623  -9.208  1.00  1.340          O  
ATOM    790  CB  THR A  51       2.207   3.509  -9.692  1.00  1.330          C  
ATOM    791  OG1 THR A  51       3.144   4.565  -9.385  1.00  1.330          O  
ATOM    792  CG2 THR A  51       1.486   3.839 -10.995  1.00  1.330          C  
ATOM    793  H   THR A  51       2.897   3.028  -7.298  1.00  1.090          H  
ATOM    794  HA  THR A  51       0.680   4.321  -8.391  1.00  1.160          H  
ATOM    795  HB  THR A  51       2.758   2.572  -9.810  1.00  1.600          H  
ATOM    796  HG1 THR A  51       3.728   4.261  -8.658  1.00  1.600          H  
ATOM    797 1HG2 THR A  51       2.222   3.938 -11.792  1.00  1.600          H  
ATOM    798 2HG2 THR A  51       0.787   3.045 -11.253  1.00  1.600          H  
ATOM    799 3HG2 THR A  51       0.945   4.775 -10.879  1.00  1.600          H  
ATOM    800  N   LEU A  52       0.543   1.042  -8.783  1.00  1.350          N  
ATOM    801  CA  LEU A  52      -0.304  -0.096  -9.114  1.00  1.640          C  
ATOM    802  C   LEU A  52      -1.545  -0.213  -8.241  1.00  1.770          C  
ATOM    803  O   LEU A  52      -2.493  -0.919  -8.598  1.00  2.030          O  
ATOM    804  CB  LEU A  52       0.500  -1.395  -8.983  1.00  2.180          C  
ATOM    805  CG  LEU A  52       1.645  -1.632 -10.009  1.00  2.180          C  
ATOM    806  CD1 LEU A  52       2.436  -2.852  -9.567  1.00  2.180          C  
ATOM    807  CD2 LEU A  52       1.087  -1.838 -11.411  1.00  2.180          C  
ATOM    808  H   LEU A  52       1.516   0.858  -8.509  1.00  1.620          H  
ATOM    809  HA  LEU A  52      -0.641   0.027 -10.138  1.00  1.970          H  
ATOM    810 1HB  LEU A  52       0.949  -1.401  -7.983  1.00  2.620          H  
ATOM    811 2HB  LEU A  52      -0.190  -2.233  -9.046  1.00  2.620          H  
ATOM    812  HG  LEU A  52       2.307  -0.781 -10.029  1.00  2.620          H  
ATOM    813 1HD1 LEU A  52       3.253  -3.021 -10.272  1.00  2.620          H  
ATOM    814 2HD1 LEU A  52       2.846  -2.678  -8.576  1.00  2.620          H  
ATOM    815 3HD1 LEU A  52       1.787  -3.723  -9.546  1.00  2.620          H  
ATOM    816 1HD2 LEU A  52       1.922  -2.008 -12.097  1.00  2.620          H  
ATOM    817 2HD2 LEU A  52       0.425  -2.702 -11.421  1.00  2.620          H  
ATOM    818 3HD2 LEU A  52       0.540  -0.962 -11.736  1.00  2.620          H  
ATOM    819  N   HIS A  53      -1.523   0.409  -7.064  1.00  1.650          N  
ATOM    820  CA  HIS A  53      -2.613   0.342  -6.117  1.00  1.840          C  
ATOM    821  C   HIS A  53      -3.366   1.673  -6.055  1.00  1.860          C  
ATOM    822  O   HIS A  53      -4.214   1.874  -5.180  1.00  2.070          O  
ATOM    823  CB  HIS A  53      -2.071  -0.021  -4.729  1.00  2.500          C  
ATOM    824  CG  HIS A  53      -1.423  -1.405  -4.638  1.00  2.500          C  
ATOM    825  ND1 HIS A  53      -0.793  -1.854  -3.489  1.00  2.500          N  
ATOM    826  CD2 HIS A  53      -1.319  -2.423  -5.539  1.00  2.500          C  
ATOM    827  CE1 HIS A  53      -0.328  -3.081  -3.697  1.00  2.500          C  
ATOM    828  NE2 HIS A  53      -0.635  -3.440  -4.925  1.00  2.500          N  
ATOM    829  H   HIS A  53      -0.740   1.017  -6.818  1.00  1.980          H  
ATOM    830  HA  HIS A  53      -3.321  -0.426  -6.421  1.00  2.210          H  
ATOM    831 1HB  HIS A  53      -1.315   0.720  -4.447  1.00  3.000          H  
ATOM    832 2HB  HIS A  53      -2.873   0.035  -3.999  1.00  3.000          H  
ATOM    833  HD2 HIS A  53      -1.699  -2.445  -6.554  1.00  3.000          H  
ATOM    834  HE1 HIS A  53       0.216  -3.690  -2.971  1.00  3.000          H  
ATOM    835  HE2 HIS A  53      -0.407  -4.323  -5.355  1.00  3.000          H  
ATOM    836  N   GLY A  54      -3.072   2.585  -6.992  1.00  1.710          N  
ATOM    837  CA  GLY A  54      -3.733   3.884  -7.045  1.00  1.780          C  
ATOM    838  C   GLY A  54      -3.203   4.958  -6.084  1.00  1.670          C  
ATOM    839  O   GLY A  54      -3.915   5.926  -5.804  1.00  1.830          O  
ATOM    840  H   GLY A  54      -2.363   2.384  -7.704  1.00  2.050          H  
ATOM    841 1HA  GLY A  54      -3.652   4.260  -8.065  1.00  2.140          H  
ATOM    842 2HA  GLY A  54      -4.797   3.740  -6.860  1.00  2.140          H  
ATOM    843  N   MET A  55      -1.988   4.800  -5.548  1.00  1.480          N  
ATOM    844  CA  MET A  55      -1.448   5.782  -4.617  1.00  1.480          C  
ATOM    845  C   MET A  55      -0.278   6.527  -5.229  1.00  1.290          C  
ATOM    846  O   MET A  55       0.291   6.089  -6.228  1.00  1.120          O  
ATOM    847  CB  MET A  55      -1.060   5.138  -3.301  1.00  2.070          C  
ATOM    848  CG  MET A  55      -2.241   4.493  -2.602  1.00  2.070          C  
ATOM    849  SD  MET A  55      -1.861   3.900  -0.970  1.00  2.070          S  
ATOM    850  CE  MET A  55      -1.987   5.464  -0.083  1.00  2.070          C  
ATOM    851  H   MET A  55      -1.389   4.009  -5.805  1.00  1.780          H  
ATOM    852  HA  MET A  55      -2.217   6.522  -4.405  1.00  1.780          H  
ATOM    853 1HB  MET A  55      -0.322   4.360  -3.482  1.00  2.490          H  
ATOM    854 2HB  MET A  55      -0.604   5.882  -2.654  1.00  2.490          H  
ATOM    855 1HG  MET A  55      -3.054   5.215  -2.535  1.00  2.490          H  
ATOM    856 2HG  MET A  55      -2.596   3.649  -3.203  1.00  2.490          H  
ATOM    857 1HE  MET A  55      -1.794   5.303   0.964  1.00  2.490          H  
ATOM    858 2HE  MET A  55      -1.269   6.182  -0.471  1.00  2.490          H  
ATOM    859 3HE  MET A  55      -2.992   5.867  -0.200  1.00  2.490          H  
ATOM    860  N   LYS A  56       0.074   7.664  -4.643  1.00  1.600          N  
ATOM    861  CA  LYS A  56       1.202   8.438  -5.136  1.00  1.770          C  
ATOM    862  C   LYS A  56       2.335   8.475  -4.131  1.00  1.620          C  
ATOM    863  O   LYS A  56       2.135   8.358  -2.930  1.00  1.460          O  
ATOM    864  CB  LYS A  56       0.763   9.862  -5.484  1.00  2.410          C  
ATOM    865  CG  LYS A  56      -0.375   9.956  -6.520  1.00  2.410          C  
ATOM    866  CD  LYS A  56       0.042   9.449  -7.907  1.00  2.410          C  
ATOM    867  CE  LYS A  56      -1.065   9.657  -8.931  1.00  2.410          C  
ATOM    868  NZ  LYS A  56      -0.688   9.132 -10.278  1.00  2.410          N  
ATOM    869  H   LYS A  56      -0.445   7.996  -3.823  1.00  1.920          H  
ATOM    870  HA  LYS A  56       1.594   7.959  -6.031  1.00  2.120          H  
ATOM    871 1HB  LYS A  56       0.440  10.372  -4.580  1.00  2.890          H  
ATOM    872 2HB  LYS A  56       1.612  10.416  -5.875  1.00  2.890          H  
ATOM    873 1HG  LYS A  56      -1.220   9.362  -6.174  1.00  2.890          H  
ATOM    874 2HG  LYS A  56      -0.698  10.993  -6.600  1.00  2.890          H  
ATOM    875 1HD  LYS A  56       0.942   9.968  -8.240  1.00  2.890          H  
ATOM    876 2HD  LYS A  56       0.255   8.380  -7.863  1.00  2.890          H  
ATOM    877 1HE  LYS A  56      -1.963   9.141  -8.589  1.00  2.890          H  
ATOM    878 2HE  LYS A  56      -1.280  10.723  -9.015  1.00  2.890          H  
ATOM    879 1HZ  LYS A  56      -1.449   9.286 -10.927  1.00  2.890          H  
ATOM    880 2HZ  LYS A  56       0.138   9.611 -10.611  1.00  2.890          H  
ATOM    881 3HZ  LYS A  56      -0.498   8.140 -10.212  1.00  2.890          H  
ATOM    882  N   CYS A  57       3.539   8.705  -4.623  1.00  1.890          N  
ATOM    883  CA  CYS A  57       4.727   8.814  -3.785  1.00  1.950          C  
ATOM    884  C   CYS A  57       4.631   9.956  -2.789  1.00  1.960          C  
ATOM    885  O   CYS A  57       5.017   9.850  -1.614  1.00  1.890          O  
ATOM    886  CB  CYS A  57       5.906   9.063  -4.678  1.00  2.710          C  
ATOM    887  SG  CYS A  57       6.330   7.681  -5.702  1.00  2.710          S  
ATOM    888  H   CYS A  57       3.639   8.791  -5.626  1.00  2.270          H  
ATOM    889  HA  CYS A  57       4.865   7.888  -3.234  1.00  2.340          H  
ATOM    890 1HB  CYS A  57       5.693   9.909  -5.327  1.00  3.250          H  
ATOM    891 2HB  CYS A  57       6.749   9.323  -4.074  1.00  3.250          H  
ATOM    892  HG  CYS A  57       7.375   8.259  -6.308  1.00  3.250          H  
ATOM    893  N   SER A  58       4.028  11.051  -3.244  1.00  2.210          N  
ATOM    894  CA  SER A  58       3.869  12.239  -2.431  1.00  2.460          C  
ATOM    895  C   SER A  58       2.978  11.991  -1.217  1.00  2.230          C  
ATOM    896  O   SER A  58       3.109  12.675  -0.206  1.00  2.440          O  
ATOM    897  CB  SER A  58       3.291  13.357  -3.275  1.00  3.340          C  
ATOM    898  OG  SER A  58       1.972  13.069  -3.666  1.00  3.340          O  
ATOM    899  H   SER A  58       3.698  11.078  -4.196  1.00  2.650          H  
ATOM    900  HA  SER A  58       4.852  12.546  -2.077  1.00  2.950          H  
ATOM    901 1HB  SER A  58       3.314  14.281  -2.709  1.00  4.010          H  
ATOM    902 2HB  SER A  58       3.915  13.501  -4.156  1.00  4.010          H  
ATOM    903  HG  SER A  58       1.684  13.820  -4.198  1.00  4.010          H  
ATOM    904  N   HIS A  59       2.152  10.938  -1.251  1.00  1.940          N  
ATOM    905  CA  HIS A  59       1.232  10.625  -0.171  1.00  2.040          C  
ATOM    906  C   HIS A  59       1.986  10.169   1.054  1.00  1.890          C  
ATOM    907  O   HIS A  59       1.458  10.201   2.168  1.00  2.160          O  
ATOM    908  CB  HIS A  59       0.260   9.510  -0.584  1.00  2.820          C  
ATOM    909  CG  HIS A  59      -0.738   9.891  -1.653  1.00  2.820          C  
ATOM    910  ND1 HIS A  59      -1.443   8.944  -2.389  1.00  2.820          N  
ATOM    911  CD2 HIS A  59      -1.159  11.099  -2.105  1.00  2.820          C  
ATOM    912  CE1 HIS A  59      -2.260   9.563  -3.230  1.00  2.820          C  
ATOM    913  NE2 HIS A  59      -2.104  10.863  -3.080  1.00  2.820          N  
ATOM    914  H   HIS A  59       2.135  10.321  -2.064  1.00  2.330          H  
ATOM    915  HA  HIS A  59       0.661  11.511   0.098  1.00  2.450          H  
ATOM    916 1HB  HIS A  59       0.817   8.651  -0.925  1.00  3.380          H  
ATOM    917 2HB  HIS A  59      -0.300   9.187   0.295  1.00  3.380          H  
ATOM    918  HD2 HIS A  59      -0.820  12.077  -1.761  1.00  3.380          H  
ATOM    919  HE1 HIS A  59      -2.942   9.077  -3.933  1.00  3.380          H  
ATOM    920  HE2 HIS A  59      -2.598  11.580  -3.596  1.00  3.380          H  
ATOM    921  N   PHE A  60       3.208   9.688   0.843  1.00  1.730          N  
ATOM    922  CA  PHE A  60       4.025   9.171   1.909  1.00  1.850          C  
ATOM    923  C   PHE A  60       5.225  10.044   2.187  1.00  1.900          C  
ATOM    924  O   PHE A  60       6.059   9.686   3.028  1.00  2.170          O  
ATOM    925  CB  PHE A  60       4.478   7.772   1.546  1.00  2.540          C  
ATOM    926  CG  PHE A  60       3.342   6.856   1.450  1.00  2.540          C  
ATOM    927  CD1 PHE A  60       2.698   6.648   0.241  1.00  2.540          C  
ATOM    928  CD2 PHE A  60       2.898   6.188   2.559  1.00  2.540          C  
ATOM    929  CE1 PHE A  60       1.655   5.786   0.160  1.00  2.540          C  
ATOM    930  CE2 PHE A  60       1.861   5.355   2.476  1.00  2.540          C  
ATOM    931  CZ  PHE A  60       1.240   5.142   1.275  1.00  2.540          C  
ATOM    932  H   PHE A  60       3.620   9.714  -0.093  1.00  2.080          H  
ATOM    933  HA  PHE A  60       3.413   9.125   2.796  1.00  2.220          H  
ATOM    934 1HB  PHE A  60       4.988   7.794   0.581  1.00  3.050          H  
ATOM    935 2HB  PHE A  60       5.173   7.391   2.290  1.00  3.050          H  
ATOM    936  HD1 PHE A  60       3.034   7.176  -0.659  1.00  3.050          H  
ATOM    937  HD2 PHE A  60       3.382   6.329   3.512  1.00  3.050          H  
ATOM    938  HE1 PHE A  60       1.156   5.615  -0.792  1.00  3.050          H  
ATOM    939  HE2 PHE A  60       1.511   4.847   3.373  1.00  3.050          H  
ATOM    940  HZ  PHE A  60       0.401   4.458   1.219  1.00  3.050          H  
ATOM    941  N   LYS A  61       5.287  11.202   1.509  1.00  1.870          N  
ATOM    942  CA  LYS A  61       6.404  12.131   1.584  1.00  1.950          C  
ATOM    943  C   LYS A  61       7.731  11.487   1.151  1.00  1.890          C  
ATOM    944  O   LYS A  61       8.757  11.732   1.788  1.00  2.100          O  
ATOM    945  CB  LYS A  61       6.580  12.622   3.022  1.00  2.700          C  
ATOM    946  CG  LYS A  61       5.362  13.245   3.658  1.00  2.700          C  
ATOM    947  CD  LYS A  61       5.700  13.587   5.079  1.00  2.700          C  
ATOM    948  CE  LYS A  61       4.530  14.065   5.893  1.00  2.700          C  
ATOM    949  NZ  LYS A  61       4.942  14.277   7.319  1.00  2.700          N  
ATOM    950  H   LYS A  61       4.509  11.473   0.901  1.00  2.240          H  
ATOM    951  HA  LYS A  61       6.198  12.974   0.918  1.00  2.340          H  
ATOM    952 1HB  LYS A  61       6.939  11.823   3.667  1.00  3.240          H  
ATOM    953 2HB  LYS A  61       7.351  13.391   3.029  1.00  3.240          H  
ATOM    954 1HG  LYS A  61       5.089  14.142   3.115  1.00  3.240          H  
ATOM    955 2HG  LYS A  61       4.524  12.552   3.636  1.00  3.240          H  
ATOM    956 1HD  LYS A  61       6.112  12.702   5.564  1.00  3.240          H  
ATOM    957 2HD  LYS A  61       6.464  14.361   5.091  1.00  3.240          H  
ATOM    958 1HE  LYS A  61       4.149  15.000   5.486  1.00  3.240          H  
ATOM    959 2HE  LYS A  61       3.741  13.314   5.862  1.00  3.240          H  
ATOM    960 1HZ  LYS A  61       4.159  14.580   7.869  1.00  3.240          H  
ATOM    961 2HZ  LYS A  61       5.306  13.370   7.700  1.00  3.240          H  
ATOM    962 3HZ  LYS A  61       5.673  14.967   7.366  1.00  3.240          H  
ATOM    963  N   LEU A  62       7.751  10.683   0.078  1.00  1.790          N  
ATOM    964  CA  LEU A  62       9.031  10.087  -0.303  1.00  1.860          C  
ATOM    965  C   LEU A  62      10.015  11.201  -0.720  1.00  1.900          C  
ATOM    966  O   LEU A  62       9.593  12.158  -1.355  1.00  1.770          O  
ATOM    967  CB  LEU A  62       8.891   9.073  -1.458  1.00  2.580          C  
ATOM    968  CG  LEU A  62       8.073   7.748  -1.215  1.00  2.580          C  
ATOM    969  CD1 LEU A  62       8.100   6.918  -2.499  1.00  2.580          C  
ATOM    970  CD2 LEU A  62       8.637   6.950  -0.059  1.00  2.580          C  
ATOM    971  H   LEU A  62       6.889  10.486  -0.443  1.00  2.150          H  
ATOM    972  HA  LEU A  62       9.402   9.569   0.567  1.00  2.230          H  
ATOM    973 1HB  LEU A  62       8.399   9.587  -2.273  1.00  3.090          H  
ATOM    974 2HB  LEU A  62       9.863   8.804  -1.785  1.00  3.090          H  
ATOM    975  HG  LEU A  62       7.032   8.007  -1.006  1.00  3.090          H  
ATOM    976 1HD1 LEU A  62       7.521   6.030  -2.374  1.00  3.090          H  
ATOM    977 2HD1 LEU A  62       7.703   7.477  -3.282  1.00  3.090          H  
ATOM    978 3HD1 LEU A  62       9.110   6.641  -2.746  1.00  3.090          H  
ATOM    979 1HD2 LEU A  62       8.052   6.043   0.080  1.00  3.090          H  
ATOM    980 2HD2 LEU A  62       9.665   6.691  -0.272  1.00  3.090          H  
ATOM    981 3HD2 LEU A  62       8.585   7.542   0.835  1.00  3.090          H  
ATOM    982  N   PRO A  63      11.333  11.079  -0.430  1.00  2.190          N  
ATOM    983  CA  PRO A  63      12.412  12.030  -0.749  1.00  2.340          C  
ATOM    984  C   PRO A  63      12.501  12.620  -2.161  1.00  2.190          C  
ATOM    985  O   PRO A  63      12.906  13.770  -2.299  1.00  2.270          O  
ATOM    986  CB  PRO A  63      13.656  11.179  -0.481  1.00  3.510          C  
ATOM    987  CG  PRO A  63      13.249  10.258   0.628  1.00  3.510          C  
ATOM    988  CD  PRO A  63      11.801   9.920   0.379  1.00  3.510          C  
ATOM    989  HA  PRO A  63      12.360  12.850  -0.018  1.00  2.810          H  
ATOM    990 1HB  PRO A  63      13.954  10.647  -1.402  1.00  4.210          H  
ATOM    991 2HB  PRO A  63      14.500  11.829  -0.208  1.00  4.210          H  
ATOM    992 1HG  PRO A  63      13.897   9.379   0.619  1.00  4.210          H  
ATOM    993 2HG  PRO A  63      13.398  10.748   1.603  1.00  4.210          H  
ATOM    994 1HD  PRO A  63      11.677   8.976  -0.122  1.00  4.210          H  
ATOM    995 2HD  PRO A  63      11.326   9.922   1.376  1.00  4.210          H  
ATOM    996  N   ASP A  64      12.124  11.884  -3.209  1.00  2.040          N  
ATOM    997  CA  ASP A  64      12.206  12.464  -4.558  1.00  1.980          C  
ATOM    998  C   ASP A  64      10.877  13.091  -4.953  1.00  1.730          C  
ATOM    999  O   ASP A  64      10.727  13.657  -6.040  1.00  1.800          O  
ATOM   1000  CB  ASP A  64      12.628  11.435  -5.609  1.00  2.800          C  
ATOM   1001  CG  ASP A  64      14.087  10.966  -5.496  1.00  2.800          C  
ATOM   1002  OD1 ASP A  64      14.917  11.669  -4.970  1.00  2.800          O  
ATOM   1003  OD2 ASP A  64      14.354   9.894  -5.973  1.00  2.800          O  
ATOM   1004  H   ASP A  64      11.794  10.936  -3.102  1.00  2.450          H  
ATOM   1005  HA  ASP A  64      12.959  13.252  -4.551  1.00  2.380          H  
ATOM   1006 1HB  ASP A  64      11.990  10.562  -5.520  1.00  3.360          H  
ATOM   1007 2HB  ASP A  64      12.467  11.849  -6.605  1.00  3.360          H  
ATOM   1008  N   TYR A  65       9.903  12.942  -4.064  1.00  1.560          N  
ATOM   1009  CA  TYR A  65       8.541  13.389  -4.229  1.00  1.450          C  
ATOM   1010  C   TYR A  65       8.026  14.108  -2.970  1.00  1.610          C  
ATOM   1011  O   TYR A  65       6.892  13.850  -2.566  1.00  1.770          O  
ATOM   1012  CB  TYR A  65       7.680  12.163  -4.508  1.00  2.070          C  
ATOM   1013  CG  TYR A  65       8.173  11.358  -5.697  1.00  2.070          C  
ATOM   1014  CD1 TYR A  65       8.977  10.218  -5.510  1.00  2.070          C  
ATOM   1015  CD2 TYR A  65       7.833  11.752  -6.965  1.00  2.070          C  
ATOM   1016  CE1 TYR A  65       9.410   9.500  -6.609  1.00  2.070          C  
ATOM   1017  CE2 TYR A  65       8.272  11.044  -8.051  1.00  2.070          C  
ATOM   1018  CZ  TYR A  65       9.048   9.928  -7.887  1.00  2.070          C  
ATOM   1019  OH  TYR A  65       9.473   9.248  -9.007  1.00  2.070          O  
ATOM   1020  H   TYR A  65      10.119  12.517  -3.164  1.00  1.870          H  
ATOM   1021  HA  TYR A  65       8.491  14.081  -5.069  1.00  1.740          H  
ATOM   1022 1HB  TYR A  65       7.676  11.521  -3.629  1.00  2.490          H  
ATOM   1023 2HB  TYR A  65       6.652  12.468  -4.699  1.00  2.490          H  
ATOM   1024  HD1 TYR A  65       9.254   9.899  -4.508  1.00  2.490          H  
ATOM   1025  HD2 TYR A  65       7.215  12.636  -7.110  1.00  2.490          H  
ATOM   1026  HE1 TYR A  65      10.032   8.612  -6.480  1.00  2.490          H  
ATOM   1027  HE2 TYR A  65       8.000  11.368  -9.055  1.00  2.490          H  
ATOM   1028  HH  TYR A  65       9.757   8.345  -8.762  1.00  2.490          H  
ATOM   1029  N   PRO A  66       8.808  15.004  -2.328  1.00  2.060          N  
ATOM   1030  CA  PRO A  66       8.489  15.632  -1.066  1.00  2.460          C  
ATOM   1031  C   PRO A  66       7.344  16.598  -1.211  1.00  2.040          C  
ATOM   1032  O   PRO A  66       7.129  17.155  -2.287  1.00  2.070          O  
ATOM   1033  CB  PRO A  66       9.758  16.420  -0.744  1.00  3.690          C  
ATOM   1034  CG  PRO A  66      10.341  16.752  -2.100  1.00  3.690          C  
ATOM   1035  CD  PRO A  66      10.030  15.557  -2.954  1.00  3.690          C  
ATOM   1036  HA  PRO A  66       8.279  14.858  -0.311  1.00  2.950          H  
ATOM   1037 1HB  PRO A  66       9.497  17.318  -0.156  1.00  4.430          H  
ATOM   1038 2HB  PRO A  66      10.433  15.806  -0.128  1.00  4.430          H  
ATOM   1039 1HG  PRO A  66       9.888  17.677  -2.491  1.00  4.430          H  
ATOM   1040 2HG  PRO A  66      11.424  16.932  -2.015  1.00  4.430          H  
ATOM   1041 1HD  PRO A  66       9.856  15.842  -4.000  1.00  4.430          H  
ATOM   1042 2HD  PRO A  66      10.868  14.905  -2.830  1.00  4.430          H  
ATOM   1043  N   LEU A  67       6.652  16.842  -0.117  1.00  2.180          N  
ATOM   1044  CA  LEU A  67       5.618  17.854  -0.112  1.00  2.080          C  
ATOM   1045  C   LEU A  67       6.284  19.177   0.186  1.00  2.420          C  
ATOM   1046  O   LEU A  67       7.267  19.229   0.925  1.00  3.170          O  
ATOM   1047  CB  LEU A  67       4.578  17.564   0.978  1.00  2.950          C  
ATOM   1048  CG  LEU A  67       3.835  16.223   0.894  1.00  2.950          C  
ATOM   1049  CD1 LEU A  67       2.984  16.070   2.142  1.00  2.950          C  
ATOM   1050  CD2 LEU A  67       2.969  16.174  -0.358  1.00  2.950          C  
ATOM   1051  H   LEU A  67       6.866  16.334   0.726  1.00  2.620          H  
ATOM   1052  HA  LEU A  67       5.153  17.911  -1.094  1.00  2.500          H  
ATOM   1053 1HB  LEU A  67       5.057  17.617   1.942  1.00  3.540          H  
ATOM   1054 2HB  LEU A  67       3.823  18.343   0.938  1.00  3.540          H  
ATOM   1055  HG  LEU A  67       4.552  15.403   0.866  1.00  3.540          H  
ATOM   1056 1HD1 LEU A  67       2.463  15.111   2.106  1.00  3.540          H  
ATOM   1057 2HD1 LEU A  67       3.624  16.100   3.025  1.00  3.540          H  
ATOM   1058 3HD1 LEU A  67       2.261  16.869   2.201  1.00  3.540          H  
ATOM   1059 1HD2 LEU A  67       2.446  15.216  -0.392  1.00  3.540          H  
ATOM   1060 2HD2 LEU A  67       2.242  16.979  -0.338  1.00  3.540          H  
ATOM   1061 3HD2 LEU A  67       3.589  16.267  -1.244  1.00  3.540          H  
ATOM   1062  N   LEU A  68       5.719  20.266  -0.320  1.00  2.490          N  
ATOM   1063  CA  LEU A  68       6.249  21.593  -0.013  1.00  3.260          C  
ATOM   1064  C   LEU A  68       5.513  22.176   1.186  1.00  2.940          C  
ATOM   1065  O   LEU A  68       5.734  23.313   1.594  1.00  3.460          O  
ATOM   1066  CB  LEU A  68       6.116  22.505  -1.234  1.00  4.260          C  
ATOM   1067  CG  LEU A  68       6.864  22.033  -2.529  1.00  4.260          C  
ATOM   1068  CD1 LEU A  68       6.563  23.017  -3.648  1.00  4.260          C  
ATOM   1069  CD2 LEU A  68       8.379  21.924  -2.282  1.00  4.260          C  
ATOM   1070  H   LEU A  68       4.927  20.173  -0.945  1.00  2.990          H  
ATOM   1071  HA  LEU A  68       7.296  21.505   0.264  1.00  3.910          H  
ATOM   1072 1HB  LEU A  68       5.060  22.608  -1.476  1.00  5.110          H  
ATOM   1073 2HB  LEU A  68       6.501  23.491  -0.970  1.00  5.110          H  
ATOM   1074  HG  LEU A  68       6.486  21.056  -2.829  1.00  5.110          H  
ATOM   1075 1HD1 LEU A  68       7.058  22.690  -4.563  1.00  5.110          H  
ATOM   1076 2HD1 LEU A  68       5.487  23.061  -3.816  1.00  5.110          H  
ATOM   1077 3HD1 LEU A  68       6.928  24.006  -3.373  1.00  5.110          H  
ATOM   1078 1HD2 LEU A  68       8.867  21.595  -3.199  1.00  5.110          H  
ATOM   1079 2HD2 LEU A  68       8.775  22.895  -1.987  1.00  5.110          H  
ATOM   1080 3HD2 LEU A  68       8.586  21.195  -1.500  1.00  5.110          H  
ATOM   1081  N   MET A  69       4.614  21.363   1.724  1.00  2.670          N  
ATOM   1082  CA  MET A  69       3.768  21.654   2.867  1.00  2.890          C  
ATOM   1083  C   MET A  69       4.403  21.203   4.180  1.00  3.120          C  
ATOM   1084  O   MET A  69       3.786  21.306   5.241  1.00  3.610          O  
ATOM   1085  CB  MET A  69       2.433  20.954   2.669  1.00  3.960          C  
ATOM   1086  CG  MET A  69       1.629  21.494   1.496  1.00  3.960          C  
ATOM   1087  SD  MET A  69      -0.017  20.768   1.363  1.00  3.960          S  
ATOM   1088  CE  MET A  69       0.365  19.138   0.708  1.00  3.960          C  
ATOM   1089  H   MET A  69       4.527  20.455   1.300  1.00  3.200          H  
ATOM   1090  HA  MET A  69       3.614  22.732   2.922  1.00  3.470          H  
ATOM   1091 1HB  MET A  69       2.608  19.895   2.525  1.00  4.750          H  
ATOM   1092 2HB  MET A  69       1.830  21.067   3.570  1.00  4.750          H  
ATOM   1093 1HG  MET A  69       1.522  22.572   1.608  1.00  4.750          H  
ATOM   1094 2HG  MET A  69       2.165  21.305   0.571  1.00  4.750          H  
ATOM   1095 1HE  MET A  69      -0.559  18.578   0.566  1.00  4.750          H  
ATOM   1096 2HE  MET A  69       0.878  19.241  -0.250  1.00  4.750          H  
ATOM   1097 3HE  MET A  69       0.997  18.607   1.400  1.00  4.750          H  
ATOM   1098  N   ASN A  70       5.610  20.657   4.099  1.00  3.380          N  
ATOM   1099  CA  ASN A  70       6.310  20.160   5.271  1.00  4.140          C  
ATOM   1100  C   ASN A  70       7.099  21.265   5.951  1.00  4.280          C  
ATOM   1101  O   ASN A  70       7.498  22.241   5.313  1.00  4.260          O  
ATOM   1102  CB  ASN A  70       7.231  19.013   4.908  1.00  5.490          C  
ATOM   1103  CG  ASN A  70       6.512  17.755   4.509  1.00  5.490          C  
ATOM   1104  OD1 ASN A  70       5.424  17.422   5.000  1.00  5.490          O  
ATOM   1105  ND2 ASN A  70       7.131  17.019   3.631  1.00  5.490          N  
ATOM   1106  H   ASN A  70       6.058  20.614   3.193  1.00  4.060          H  
ATOM   1107  HA  ASN A  70       5.572  19.803   5.992  1.00  4.970          H  
ATOM   1108 1HB  ASN A  70       7.865  19.321   4.073  1.00  6.590          H  
ATOM   1109 2HB  ASN A  70       7.886  18.795   5.750  1.00  6.590          H  
ATOM   1110 1HD2 ASN A  70       6.730  16.156   3.337  1.00  6.590          H  
ATOM   1111 2HD2 ASN A  70       8.015  17.318   3.263  1.00  6.590          H  
ATOM   1112  N   ALA A  71       7.351  21.088   7.241  1.00  4.720          N  
ATOM   1113  CA  ALA A  71       8.148  22.018   8.021  1.00  5.070          C  
ATOM   1114  C   ALA A  71       8.588  21.347   9.310  1.00  5.810          C  
ATOM   1115  O   ALA A  71       9.082  22.012  10.221  1.00  6.310          O  
ATOM   1116  OXT ALA A  71       8.174  20.211   9.541  1.00  7.610          O  
ATOM   1117  CB  ALA A  71       7.355  23.281   8.322  1.00  6.630          C  
ATOM   1118  H   ALA A  71       6.979  20.268   7.703  1.00  5.660          H  
ATOM   1119  HA  ALA A  71       9.038  22.278   7.447  1.00  6.080          H  
ATOM   1120 1HB  ALA A  71       7.975  23.967   8.899  1.00  7.960          H  
ATOM   1121 2HB  ALA A  71       7.058  23.759   7.389  1.00  7.960          H  
ATOM   1122 3HB  ALA A  71       6.468  23.023   8.896  1.00  7.960          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 -393.798 43.7728 286.209 -23.7206 6.10106 16.1656 146.154 -156.446 -0.44637 -2.47636 -133.68 -12.7158 -51.0815 -3.96149 -6.99169 -5.44933 0 0.8399 4.0494 34.8282 74.9446 -11.1944 4.28492 0.75494 0.48691 42.2265 -141.143
CYS:NtermProteinFull_1 -5.26232 0.37909 1.45151 -0.05016 0.00485 0.01425 1.02921 -1.09961 -0 -0 -0.95658 0.16895 0 0 -1.1954 0 0 0.04682 0.09436 0.23637 0 0 0 3.6196 0 0.28354 -1.23551
VAL_2 -3.75718 0.77369 0.30882 -0.34142 0.14696 0.07894 0.61142 -0.93655 -0 -0 0.28414 0.14951 0 0 0 0 0 0.30263 0.13312 1.18338 0 -0.30171 0 1.9342 -0.0161 0.98436 1.53823
PHE_3 -7.20652 0.67187 2.92508 -0.59265 0.02765 0.31902 1.71338 -2.18017 -0 -0 -0.54091 0.16081 0 0 -1.54913 0 0 0.12239 0.01496 0 2.0061 -0.23745 0 1.0402 -0.17801 0.82211 -2.66128
GLY_4 -1.87053 0.09529 1.02923 -0.00021 0 0 0.16478 -0.64482 -0 -0 0.03313 -0.1717 0 0 0 0 0 -0.02478 0 0 0 -1.49983 0 0.83697 -0.12233 0.339 -1.83581
CYS_5 -4.06902 0.65899 2.55593 -0.07171 0.00285 0.05287 1.79977 -1.54049 -0 -0 -0.64711 -0.33392 0 0 0 0 0 -0.00314 0.03799 0.46546 0 0.11727 0 3.6196 -0.22638 1.00037 3.41933
PRO_6 -4.26899 0.81365 1.08254 -0.08576 0.00019 0.05326 1.06577 -0.77675 -0 -0 0.07014 0.66455 0 0 0 0 0 -0.12781 0.0087 0.58948 0 -0.45138 0 -2.4119 -0.50045 1.23275 -3.042
SER_7 -2.19719 0.18839 2.03208 -0.03127 0.00076 0.05447 1.1354 -1.04171 -0 -0 -0.74025 -1.02974 0 0 0 0 0 0.0474 0.00127 0.43352 0 -0.23928 0.60043 -0.77834 -0.52743 0.5542 -1.5373
ALA_8 -4.41163 0.56611 3.05659 -0.02976 0.0028 0 2.26325 -2.02561 -0 -0 -2.17637 -0.46218 0 0 0 0 0 0.24948 0 0 0 -0.03667 0 1.8394 -0.09285 0.42756 -0.82989
ALA_9 -3.78115 0.91022 2.52362 -0.02088 0 0 1.74985 -1.75265 -0 -0 -2.16714 -0.11805 0 0 0 0 0 0.14493 0 0 0 -0.1481 0 1.8394 0.18126 0.60837 -0.03034
ASP_10 -3.77714 0.68055 6.31481 -0.07848 0.00127 0.25167 3.33816 -2.62161 -0 -0 -5.70772 -0.23857 0 0 0 -0.8278 0 -0.03339 0.00032 0 3.56487 0.16346 0 -2.3716 3.48236 0.83555 2.97671
LYS_11 -4.7519 0.40234 4.75323 -0.4364 0.07921 0.25069 2.33338 -2.2002 -0 -0 -2.6553 -0.1274 0 0 0 0 0 -0.02818 0.02715 1.49947 0 -0.07384 0 -1.5107 3.79678 0.95838 2.31669
LEU_12 -9.85125 1.46432 4.83743 -0.57548 0.42135 0.16684 3.77161 -3.4429 -0 -0 -2.03129 0.03124 0 0 0 0 0 0.27746 0.34055 2.91504 0 -0.16576 0 0.18072 0.12619 1.14118 -0.39276
TRP_13 -10.706 1.46898 4.88694 -1.28204 0.09971 0.51071 2.72354 -2.98798 -0 -0 -3.12144 -0.42636 0 0 0 0 0 -0.03752 0.47271 0 3.19766 -0.1164 0 1.6906 -0.24453 1.51829 -2.35315
ASP_14 -4.8344 0.417 6.62644 -0.11302 0.00273 0.34546 2.43919 -2.92616 -0.00501 -0.04539 -3.04453 -0.62601 0 0 0 0 0 0.00744 0.01723 0 2.84838 -0.1236 0 -2.3716 -0.19362 1.08617 -0.49328
GLU_15 -5.67662 0.16031 6.09185 -0.42685 0.04524 0.81614 2.35835 -2.65518 -0 -0 -2.94562 -0.4553 0 0 0 0 0 -0.04307 0.04296 0 3.3573 -0.25467 0 -2.7348 -0.34231 0.43986 -2.22239
ASN_16 -8.08998 0.70883 7.08007 -0.22344 0.02121 0.30147 4.22239 -3.66345 -0 -0 -4.24093 -0.2734 0 0 -1.54913 0 0 -0.00419 0.00377 0 3.03462 0.18159 0 -0.93687 -0.13215 0.55088 -3.00874
LYS_17 -9.43606 1.20944 7.89385 -0.45043 0.08672 0.24193 3.19919 -3.61755 -0.05227 -0.23211 -3.82014 0.49374 0 0 0 0 0 -0.00841 0.35615 2.32775 0 -0.14093 0 -1.5107 -0.06335 1.03948 -2.48372
SER_18 -3.81891 0.27192 4.97166 -0.02605 0 0.0608 1.93239 -2.27266 -0 -0 -1.8257 -0.64462 0 0 0 0 0 -0.02025 0 0.66922 0 0.34939 0.60028 -0.77834 -0.02894 0.74576 0.18595
HIS_D_19 -5.58941 0.30592 5.27216 -0.39828 0.00803 0.42508 2.12682 -2.67981 -0 -0 -2.13614 -0.12956 0 0 0 0 0 -0.00646 0.00176 0 2.93887 -0.04506 0 -0.45461 0.08524 0.22249 -0.05297
PHE_20 -9.20775 1.03315 4.55359 -1.04795 0.18071 0.41658 2.72985 -3.02824 -0 -0 -2.61195 0.05761 0 0 0 0 0 0.11398 0.00143 0 1.79106 -0.43595 0 1.0402 -0.00496 0.36923 -4.04941
ILE_21 -9.2651 1.26304 4.95162 -0.51642 0.37109 0.10699 2.74965 -2.94791 -0 -0 -3.3105 -0.02471 0 0 0 0 0 -0.01679 0.0275 0.56313 0 -0.41804 0 0.73287 0.03223 0.83834 -4.863
GLU_22 -4.6062 0.32427 5.45797 -0.36394 0.14425 0.43158 2.58449 -2.54403 -0.0176 -0.08692 -2.46571 -0.58862 0 0 0 -0.90813 0 -0.0274 0.018 0 3.15486 -0.09745 0 -2.7348 -0.15112 0.90829 -1.56822
ASP_23 -4.39714 0.22407 6.89785 -0.22432 0.0007 0.73122 2.95373 -2.97421 -0.02136 -0.06173 -4.92697 -0.09288 0 0 0 -0.51232 0 0.01003 0.02361 0 3.1637 0.30149 0 -2.3716 -0.16396 0.46883 -0.97126
PHE_24 -10.2576 1.34464 4.37486 -0.83795 0.04224 0.22269 2.74772 -3.16528 -0 -0 -2.74896 -0.07981 0 0 0 0 0 -0.00405 0.01293 0 1.74957 -0.48909 0 1.0402 0.03608 0.37707 -5.63478
CYS_25 -8.10251 0.79956 5.64409 -0.05005 0 0.01805 2.89112 -2.96207 -0.00369 -0.02731 -3.53779 0.01228 0 0 0 0 0 -0.00314 0.00918 0.27264 0 0.26712 0 3.6196 0.15333 0.70751 -0.29207
TRP_26 -5.69943 0.40889 6.04159 -0.93687 0.15003 0.30034 3.02278 -2.87366 -0 -0 -3.11354 -0.47669 0 0 0 -0.90813 0 0.01717 0.04181 0 2.22488 -0.10655 0 1.6906 -0.00741 0.64125 0.41706
LYS_27 -5.51372 0.3117 7.66014 -0.35417 0.04349 0.21333 3.49197 -3.30387 -0.02136 -0.06173 -5.50497 0.35517 0 0 0 -0.51232 0 0.07265 0.04841 2.3415 0 0.00892 0 -1.5107 -0.30111 0.3874 -2.14927
LEU_28 -9.10446 1.25971 5.36034 -0.54711 0.18504 0.12546 3.25764 -3.55862 -0 -0 -1.60178 0.06392 0 0 0 0 0 -0.04535 0.09691 3.34011 0 -0.27208 0 0.18072 -0.32825 0.67946 -0.90835
HIS_D_29 -5.78704 0.45302 5.42418 -0.36273 0.01047 0.42478 1.88457 -2.74269 -0.00475 -0.06741 -2.35496 -0.41149 0 0 0 0 0 0.0648 0.00069 0 2.65151 0.0825 0 -0.45461 -0.23564 0.63729 -0.78752
ARG_30 -3.33373 0.23299 3.81383 -0.44462 0.05243 0.22298 1.47137 -1.6877 -0.00369 -0.02731 -0.76807 0.35087 0 0 0 0 0 -0.0301 0.03459 2.07475 0 -0.18265 0 -1.2888 -0.36919 0.29364 0.41159
ARG_31 -3.7745 0.50907 4.53441 -0.68581 0.15978 0.52045 2.38455 -2.04891 -0.01717 -0.14096 -2.64701 -0.08185 0 0 0 0 0 0.04479 0.02195 1.72358 0 -0.12818 0 -1.2888 -0.42767 0.41868 -0.92359
GLU_32 -2.9524 0.41936 3.91561 -0.18137 0.02668 0.25435 1.45016 -1.86899 -0.02192 -0.20837 -1.20848 -0.60952 0 0 0 0 0 0.07327 0.00313 0 2.49368 0.08914 0 -2.7348 1.30229 0.5216 0.76343
GLY_33 -1.76501 0.27251 1.68871 -0.00014 0 0 0.78528 -0.87491 -0 -0 -0.80034 -0.23616 0 0 0 0 0 0.07814 0 0 0 -1.3475 0 0.83697 1.78194 0.32128 0.74078
ALA_34 -2.82506 0.37755 1.94493 -0.02793 0.00831 0 1.5183 -1.32833 -0.01408 -0.06238 -0.27808 -0.45059 0 0 0 0 0 0.00641 0 0 0 0.19696 0 1.8394 1.66348 0.25772 2.82661
CYS_35 -5.57286 0.75583 2.47627 -0.04429 0.00103 0.01863 1.24741 -1.42895 -0.00573 -0.04967 -2.0286 -0.34807 0 0 0 0 0 0.10703 0 0.53792 0 0.15515 0 3.6196 1.08154 0.35559 0.87785
VAL_36 -2.81279 0.43328 1.60609 -0.37446 0.26287 0.09251 0.68324 -1.18969 -0 -0 0.11648 -0.20375 0 0 0 0 0 -0.09363 2e-05 0.69651 0 0.402 0 1.9342 -0.38192 0.27277 1.44371
ASN_37 -5.69127 0.62194 4.33371 -0.19378 0.02841 0.30974 2.71876 -2.5544 -0.01408 -0.06238 -2.60754 -0.4182 0 0 0 0 0 -0.02908 0.05743 0 2.03249 -0.54197 0 -0.93687 -0.52136 0.21286 -3.25558
CYS_38 -7.41567 0.99575 4.10916 -0.07196 1e-05 0.03874 2.62808 -2.35852 -0 -0 -2.65343 0.05433 0 0 0 0 0 0.10427 0.00012 0.55047 0 0.29086 0 3.6196 -0.54672 0.47037 -0.18455
GLU_39 -5.46775 0.45257 4.38574 -0.21739 0.02657 0.28855 1.80585 -2.26157 -0.03538 -0.14947 -1.57254 -0.58668 0 0 0 0 0 0.01376 0.17126 0 3.07951 -0.31716 0 -2.7348 -0.3245 0.47482 -2.9686
MET_40 -4.82764 0.28351 4.25336 -0.3348 0.07588 0.09135 1.94761 -2.29365 -0 -0 -1.11987 -0.07852 0 0 0 0 0 0.0217 0.01052 1.76323 0 -0.02827 0 0.60916 -0.24108 0.2426 0.37511
HIS_D_41 -7.25034 0.6292 5.82876 -0.41483 0.0086 0.43586 2.74477 -3.16678 -0 -0 -1.86132 -0.18044 0 0 0 0 0 0.21537 0.036 0 2.69329 0.01824 0 -0.45461 -0.15095 0.36353 -0.50568
ALA_42 -7.20443 0.6555 3.8475 -0.02078 0 0 3.01836 -3.03976 -0.00677 -0.04072 -2.21535 -0.36342 0 0 0 0 0 -0.03244 0 0 0 -0.22966 0 1.8394 -0.27688 0.53645 -3.53301
LEU_43 -8.81017 1.221 4.9366 -0.51275 0.31219 0.12482 3.07683 -3.15329 -0 -0 -2.66438 0.26342 0 0 0 0 0 0.03031 0.04021 0.33945 0 -0.2685 0 0.18072 -0.3518 0.6168 -4.61855
ASN_44 -4.25289 0.15728 5.13935 -0.17564 0.03317 0.26345 2.2141 -2.47987 -0 -0 -1.71208 -0.32589 0 0 0 0 0 -0.01274 2e-05 0 1.4167 0.32603 0 -0.93687 -0.14764 0.48001 -0.01351
GLU_45 -4.73251 0.20994 4.94368 -0.59937 0.11464 1.08385 2.40052 -2.31479 -0 -0 -2.16969 -0.66615 0 0 0 0 0 -0.02002 0.04902 0 3.3021 -0.23652 0 -2.7348 -0.12927 0.24396 -1.25541
ILE_46 -9.16344 1.36149 3.71536 -0.51704 0.49446 0.09958 2.99113 -3.05823 -0 -0 -2.30093 0.07823 0 0 0 0 0 0.02904 0.02454 0.54891 0 -0.47347 0 0.73287 -0.12883 0.35876 -5.20758
GLN_47 -6.74994 0.50767 6.32655 -0.39546 0.0973 0.24876 3.13815 -3.07803 -0.00678 -0.04098 -4.33494 -0.46708 0 0 0 -0.47641 0 -0.01108 0.20216 0 3.22463 0.05266 0 -0.18838 0.0522 0.5292 -1.36982
GLU_48 -5.11864 0.35347 5.8081 -0.59282 0.12862 1.0764 2.3665 -2.68596 -0 -0 -2.13282 -0.69455 0 0 0 0 0 -0.0313 0.01062 0 3.51485 -0.19617 0 -2.7348 -0.15073 0.61954 -0.45969
VAL_49 -7.36188 0.71149 4.35828 -0.35771 0.2274 0.08696 2.62486 -3.02313 -0 -0 -1.00653 -0.09392 0 0 0 0 0 -0.02144 0.00134 0.9663 0 -0.0972 0 1.9342 -0.28636 0.78112 -0.55621
PHE_50 -11.4927 1.49965 4.31917 -0.51423 0.16385 0.21937 3.17789 -3.44471 -0 -0 -3.0189 -0.18408 0 0 0 0 0 -0.02606 0.0525 0 3.44127 -0.15196 0 1.0402 -0.16476 0.95281 -4.13073
THR_51 -4.33363 0.28679 5.63566 -0.20029 0.11193 0.0709 2.69079 -2.58552 -0.01442 -0.14043 -3.13141 0.00749 0 0 0 0 0 -0.02898 0.00631 0.07425 0 0.03 2.28981 -1.0874 -0.01702 0.64147 0.30631
LEU_52 -4.43682 0.39869 3.7541 -0.50854 0.20699 0.14067 1.3772 -1.88879 -0 -0 -1.2571 0.20942 0 0 0 0 0 -0.07935 0.04248 0.28352 0 -0.11993 0 0.18072 -0.09532 0.33171 -1.46037
HIS_53 -4.78927 0.36862 5.03568 -0.42591 0.09586 0.4537 2.84471 -2.48956 -0.03388 -0.13903 -1.97187 -0.33637 0 0 -1.1954 0 0 -0.04173 8e-05 0 3.14684 -0.36547 0 -0.45461 -0.4246 0.30854 -0.41367
GLY_54 -1.70342 0.07732 2.27428 -5e-05 0 0 0.94342 -1.08158 -0 -0 -1.12395 -0.3661 0 0 0 0 0 -0.17135 0 0 0 -1.38903 0 0.83697 -0.71595 0.35834 -2.0611
MET_55 -6.62411 0.37236 3.94249 -0.32165 0.13077 0.02847 1.77103 -2.00319 -0.04828 -0.2792 -1.71413 -0.12281 0 0 0 0 0 0.00256 0.35733 1.34645 0 0.0204 0 0.60916 -0.28203 0.38465 -2.42972
LYS_56 -4.99026 0.37653 4.84902 -0.48927 0.15231 0.28435 1.88977 -2.21405 -0 -0 -1.51617 -0.02214 0 0 -0.75131 0 0 0.01149 0.01396 1.7986 0 -0.0114 0 -1.5107 0.09159 0.21563 -1.82206
CYS_57 -6.92247 1.1916 3.20346 -0.04228 0 0.01668 1.78396 -1.78089 -0 -0 -1.84545 -0.25898 0 0 0 0 0 -0.05416 0.0144 0.29384 0 0.27679 0 3.6196 -0.01011 0.29623 -0.21779
SER_58 -4.09224 0.39159 3.83813 -0.02831 0 0.04468 1.80994 -1.94405 -0.01886 -0.14618 -0.53478 -1.04705 0 0 0 0 0 -0.08215 0.00036 0.16706 0 -0.20557 0.60007 -0.77834 -0.30802 0.40511 -1.92863
HIS_59 -5.95845 0.50729 4.89948 -0.42329 0.05999 0.41021 2.67235 -2.54871 -0 -0 -1.83888 -0.5935 0 0 -0.75131 0 0 -0.05525 0.009 0 2.84562 -0.05292 0 -0.45461 -0.54393 0.321 -1.49592
PHE_60 -10.4938 1.79989 2.47646 -0.69991 0.09609 0.39991 2.4638 -2.62695 -0.03017 -0.13016 -1.90886 0.09875 0 0 0 0 0 0.00681 0.00827 0 2.11253 -0.18737 0 1.0402 -0.33497 0.4665 -5.44292
LYS_61 -5.54053 0.29077 5.67333 -0.36827 0.09524 0.25792 2.47609 -2.35884 -0 -0 -3.93809 -0.4195 0 0 0 -0.8278 0 -0.09609 0.37232 1.53469 0 -0.13617 0 -1.5107 -0.30479 0.78292 -4.0175
LEU_62 -8.56427 1.40015 2.4687 -0.45347 0.21968 0.07516 2.17575 -2.14747 -0.03017 -0.13016 -1.12398 0.3745 0 0 0 0 0 -0.01773 0.17124 0.49651 0 -0.02689 0 0.18072 -0.40191 1.35367 -3.97996
PRO_63 -4.15833 0.79463 1.86033 -0.06861 0 0.04289 0.56012 -0.82504 -0 -0 0.36918 0.56344 0 0 0 0 0 -0.1599 0.16571 0.17888 0 -0.75217 0 -2.4119 -0.01103 1.59089 -2.26092
ASP_64 -3.54066 0.47704 2.35965 -0.1146 0.01847 0.3579 0.43431 -1.26541 -0 -0 -0.37163 -0.19427 0 0 0 0 0 -0.03875 0.04644 0 2.10408 -0.21009 0 -2.3716 -0.05927 0.86972 -1.49867
TYR_65 -7.31799 1.13649 3.9361 -0.66956 0.06384 0.42284 1.95602 -2.23424 -0.01886 -0.14618 -2.62342 -0.18651 0 0 0 -0.47641 0 0.30742 0.08956 0 2.10781 0.03269 0.19432 1.2797 0.18089 1.16942 -0.79606
PRO_66 -3.31668 0.68674 2.14613 -0.20235 0.01396 0.15151 0.3225 -0.96619 -0 -0 -0.13524 0.00434 0 0 0 0 0 0.03168 0.04848 0.54073 0 -1.00368 0 -2.4119 0.22291 1.21515 -2.65193
LEU_67 -5.34018 0.37735 2.58024 -0.47393 0.17503 0.09034 1.35523 -1.55654 -4e-05 -0.0001 0.53273 0.23843 0 0 0 0 0 -0.01325 0.06287 0.39059 0 -0.30851 0 0.18072 -0.45603 0.43354 -1.73153
LEU_68 -1.56478 0.1196 1.50744 -0.50408 0.23783 0.13834 0.35601 -0.75106 -0 -0 0.62539 0.0778 0 0 0 0 0 -0.06233 0.04831 0.11759 0 -0.14894 0 0.18072 -0.49966 0.40489 0.28307
MET_69 -2.38432 0.2618 1.38426 -0.37809 0.10439 0.14797 0.37926 -0.82727 -0 -0 0.2402 -0.25846 0 0 0 0 0 -0.06916 0.03461 1.56734 0 0.16421 0 0.60916 -0.58578 0.29001 0.68015
ASN_70 -3.41902 0.18755 3.54993 -0.15967 0.01225 0.22018 1.17569 -1.60258 -4e-05 -0.0001 -0.55579 -0.24824 0 0 0 0 0 -0.0093 0.00879 0 1.74587 0.0499 0 -0.93687 -0.28042 0.1295 -0.13237
ALA:CtermProteinFull_71 -0.43345 0.04001 0.48898 -0.03548 0.00466 0 0.03098 -0.24112 -0 -0 -0.32542 -0.44072 0 0 0 0 0 0 0 0 0 0 0 1.8394 0.008 0.12855 1.06438
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 114277 DOMAINID 110982 MODEL 3 2021-08-21_00000149_1_11
MODEL     3
REMARK    Rerank model02.pdb to model03.pdb score: 44.847
REMARK    CLUSTER 0002 t000_.out.valid.rescored.best_scoring.binary cluster_size: 15 cluster_threshold: 2.900464
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE    fa_intra_rep:           0.657
REMARK    SCORE          fa_dun:          89.229
REMARK    SCORE     total_score:        -318.859
REMARK    SCORE     description: cluster0002_0001
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE     hbond_lr_bb:          -2.946
REMARK    SCORE atom_pair_constraint:        -194.333
REMARK    SCORE fa_intra_sol_xover4:          15.115
REMARK    SCORE           omega:           0.105
REMARK    SCORE     lk_ball_wtd:         -13.898
REMARK    SCORE         p_aa_pp:         -11.535
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE           score:        -318.859
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE            time:           0.000
REMARK    SCORE     cart_bonded:          38.793
REMARK    SCORE             ref:          27.225
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE     rama_prepro:          -8.957
REMARK    SCORE     hbond_sr_bb:         -43.816
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE          fa_sol:         226.848
REMARK    SCORE         fa_elec:         -95.956
REMARK    SCORE          fa_atr:        -374.555
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE        hbond_sc:          -5.352
REMARK    SCORE          fa_rep:          38.807
REMARK    SCORE     hbond_bb_sc:          -4.290
ATOM      1  N   CYS A   1      -1.110   1.851   0.338  1.00  3.750          N  
ATOM      2  CA  CYS A   1       0.261   1.547   0.718  1.00  3.100          C  
ATOM      3  C   CYS A   1       1.196   2.711   0.418  1.00  2.400          C  
ATOM      4  O   CYS A   1       0.794   3.726  -0.147  1.00  2.690          O  
ATOM      5  CB  CYS A   1       0.787   0.321  -0.033  1.00  4.600          C  
ATOM      6  SG  CYS A   1      -0.005  -1.248   0.327  1.00  4.600          S  
ATOM      7 1H   CYS A   1      -1.743   1.180   0.749  1.00  4.500          H  
ATOM      8 2H   CYS A   1      -1.353   2.783   0.641  1.00  4.500          H  
ATOM      9 3H   CYS A   1      -1.151   1.799  -0.676  1.00  4.500          H  
ATOM     10  HA  CYS A   1       0.286   1.345   1.782  1.00  3.720          H  
ATOM     11 1HB  CYS A   1       0.708   0.492  -1.094  1.00  5.520          H  
ATOM     12 2HB  CYS A   1       1.809   0.208   0.169  1.00  5.520          H  
ATOM     13  HG  CYS A   1       0.629  -1.928  -0.625  1.00  5.520          H  
ATOM     14  N   VAL A   2       2.468   2.530   0.738  1.00  2.150          N  
ATOM     15  CA  VAL A   2       3.504   3.539   0.531  1.00  2.230          C  
ATOM     16  C   VAL A   2       3.613   3.935  -0.938  1.00  2.260          C  
ATOM     17  O   VAL A   2       3.855   5.094  -1.267  1.00  2.770          O  
ATOM     18  CB  VAL A   2       4.865   3.016   1.043  1.00  3.090          C  
ATOM     19  CG1 VAL A   2       6.010   3.951   0.654  1.00  3.090          C  
ATOM     20  CG2 VAL A   2       4.792   2.861   2.566  1.00  3.090          C  
ATOM     21  H   VAL A   2       2.729   1.660   1.182  1.00  2.580          H  
ATOM     22  HA  VAL A   2       3.236   4.427   1.108  1.00  2.680          H  
ATOM     23  HB  VAL A   2       5.073   2.073   0.587  1.00  3.710          H  
ATOM     24 1HG1 VAL A   2       6.950   3.542   1.031  1.00  3.710          H  
ATOM     25 2HG1 VAL A   2       6.080   4.050  -0.428  1.00  3.710          H  
ATOM     26 3HG1 VAL A   2       5.840   4.934   1.094  1.00  3.710          H  
ATOM     27 1HG2 VAL A   2       5.741   2.476   2.940  1.00  3.710          H  
ATOM     28 2HG2 VAL A   2       4.593   3.832   3.016  1.00  3.710          H  
ATOM     29 3HG2 VAL A   2       3.994   2.173   2.839  1.00  3.710          H  
ATOM     30  N   PHE A   3       3.502   2.948  -1.811  1.00  2.240          N  
ATOM     31  CA  PHE A   3       3.616   3.112  -3.246  1.00  2.790          C  
ATOM     32  C   PHE A   3       2.259   3.328  -3.946  1.00  2.590          C  
ATOM     33  O   PHE A   3       2.204   3.356  -5.174  1.00  3.080          O  
ATOM     34  CB  PHE A   3       4.270   1.856  -3.825  1.00  3.690          C  
ATOM     35  CG  PHE A   3       3.497   0.614  -3.457  1.00  3.690          C  
ATOM     36  CD1 PHE A   3       2.419   0.245  -4.201  1.00  3.690          C  
ATOM     37  CD2 PHE A   3       3.821  -0.154  -2.366  1.00  3.690          C  
ATOM     38  CE1 PHE A   3       1.653  -0.831  -3.894  1.00  3.690          C  
ATOM     39  CE2 PHE A   3       3.053  -1.269  -2.051  1.00  3.690          C  
ATOM     40  CZ  PHE A   3       1.958  -1.584  -2.821  1.00  3.690          C  
ATOM     41  H   PHE A   3       3.303   2.023  -1.465  1.00  2.690          H  
ATOM     42  HA  PHE A   3       4.249   3.978  -3.445  1.00  3.350          H  
ATOM     43 1HB  PHE A   3       4.312   1.933  -4.912  1.00  4.420          H  
ATOM     44 2HB  PHE A   3       5.291   1.761  -3.458  1.00  4.420          H  
ATOM     45  HD1 PHE A   3       2.183   0.840  -5.052  1.00  4.420          H  
ATOM     46  HD2 PHE A   3       4.691   0.114  -1.766  1.00  4.420          H  
ATOM     47  HE1 PHE A   3       0.798  -1.074  -4.511  1.00  4.420          H  
ATOM     48  HE2 PHE A   3       3.302  -1.893  -1.198  1.00  4.420          H  
ATOM     49  HZ  PHE A   3       1.344  -2.434  -2.574  1.00  4.420          H  
ATOM     50  N   GLY A   4       1.164   3.471  -3.189  1.00  2.340          N  
ATOM     51  CA  GLY A   4      -0.165   3.602  -3.790  1.00  2.560          C  
ATOM     52  C   GLY A   4      -1.072   2.417  -3.434  1.00  2.200          C  
ATOM     53  O   GLY A   4      -0.714   1.567  -2.622  1.00  2.360          O  
ATOM     54  H   GLY A   4       1.245   3.520  -2.172  1.00  2.810          H  
ATOM     55 1HA  GLY A   4      -0.622   4.529  -3.445  1.00  3.070          H  
ATOM     56 2HA  GLY A   4      -0.072   3.680  -4.871  1.00  3.070          H  
ATOM     57  N   CYS A   5      -2.288   2.390  -3.983  1.00  2.130          N  
ATOM     58  CA  CYS A   5      -3.248   1.333  -3.659  1.00  2.100          C  
ATOM     59  C   CYS A   5      -2.778  -0.033  -4.188  1.00  1.780          C  
ATOM     60  O   CYS A   5      -2.732  -0.191  -5.408  1.00  1.870          O  
ATOM     61  CB  CYS A   5      -4.606   1.646  -4.281  1.00  2.950          C  
ATOM     62  SG  CYS A   5      -5.871   0.412  -3.936  1.00  2.950          S  
ATOM     63  H   CYS A   5      -2.542   3.115  -4.644  1.00  2.560          H  
ATOM     64  HA  CYS A   5      -3.357   1.327  -2.580  1.00  2.520          H  
ATOM     65 1HB  CYS A   5      -4.963   2.611  -3.919  1.00  3.540          H  
ATOM     66 2HB  CYS A   5      -4.498   1.721  -5.364  1.00  3.540          H  
ATOM     67  HG  CYS A   5      -6.783   0.917  -4.757  1.00  3.540          H  
ATOM     68  N   PRO A   6      -2.632  -1.081  -3.337  1.00  2.080          N  
ATOM     69  CA  PRO A   6      -2.096  -2.387  -3.691  1.00  2.420          C  
ATOM     70  C   PRO A   6      -2.875  -3.107  -4.779  1.00  2.130          C  
ATOM     71  O   PRO A   6      -2.299  -3.922  -5.494  1.00  2.210          O  
ATOM     72  CB  PRO A   6      -2.148  -3.158  -2.367  1.00  3.630          C  
ATOM     73  CG  PRO A   6      -3.193  -2.461  -1.539  1.00  3.630          C  
ATOM     74  CD  PRO A   6      -3.105  -0.999  -1.938  1.00  3.630          C  
ATOM     75  HA  PRO A   6      -1.051  -2.258  -4.003  1.00  2.900          H  
ATOM     76 1HB  PRO A   6      -2.414  -4.201  -2.560  1.00  4.360          H  
ATOM     77 2HB  PRO A   6      -1.156  -3.166  -1.897  1.00  4.360          H  
ATOM     78 1HG  PRO A   6      -4.185  -2.900  -1.727  1.00  4.360          H  
ATOM     79 2HG  PRO A   6      -2.982  -2.615  -0.465  1.00  4.360          H  
ATOM     80 1HD  PRO A   6      -4.111  -0.580  -1.861  1.00  4.360          H  
ATOM     81 2HD  PRO A   6      -2.378  -0.457  -1.325  1.00  4.360          H  
ATOM     82  N   SER A   7      -4.157  -2.787  -4.982  1.00  2.050          N  
ATOM     83  CA  SER A   7      -4.915  -3.462  -6.031  1.00  1.930          C  
ATOM     84  C   SER A   7      -4.354  -3.149  -7.424  1.00  1.650          C  
ATOM     85  O   SER A   7      -4.669  -3.835  -8.399  1.00  1.800          O  
ATOM     86  CB  SER A   7      -6.374  -3.059  -5.980  1.00  2.750          C  
ATOM     87  OG  SER A   7      -6.541  -1.715  -6.332  1.00  2.750          O  
ATOM     88  H   SER A   7      -4.658  -2.118  -4.409  1.00  2.460          H  
ATOM     89  HA  SER A   7      -4.844  -4.537  -5.869  1.00  2.320          H  
ATOM     90 1HB  SER A   7      -6.948  -3.689  -6.658  1.00  3.300          H  
ATOM     91 2HB  SER A   7      -6.757  -3.222  -4.974  1.00  3.300          H  
ATOM     92  HG  SER A   7      -7.489  -1.563  -6.351  1.00  3.300          H  
ATOM     93  N   ALA A   8      -3.511  -2.117  -7.512  1.00  1.570          N  
ATOM     94  CA  ALA A   8      -2.866  -1.697  -8.739  1.00  1.650          C  
ATOM     95  C   ALA A   8      -1.375  -2.044  -8.723  1.00  1.500          C  
ATOM     96  O   ALA A   8      -0.639  -1.613  -9.615  1.00  1.300          O  
ATOM     97  CB  ALA A   8      -3.062  -0.206  -8.942  1.00  2.280          C  
ATOM     98  H   ALA A   8      -3.300  -1.579  -6.666  1.00  1.880          H  
ATOM     99  HA  ALA A   8      -3.327  -2.236  -9.568  1.00  1.980          H  
ATOM    100 1HB  ALA A   8      -2.593   0.104  -9.874  1.00  2.730          H  
ATOM    101 2HB  ALA A   8      -4.126   0.016  -8.975  1.00  2.730          H  
ATOM    102 3HB  ALA A   8      -2.615   0.323  -8.116  1.00  2.730          H  
ATOM    103  N   ALA A   9      -0.930  -2.876  -7.766  1.00  1.720          N  
ATOM    104  CA  ALA A   9       0.489  -3.205  -7.579  1.00  1.720          C  
ATOM    105  C   ALA A   9       1.132  -3.759  -8.847  1.00  1.560          C  
ATOM    106  O   ALA A   9       2.299  -3.484  -9.129  1.00  1.430          O  
ATOM    107  CB  ALA A   9       0.675  -4.184  -6.445  1.00  2.410          C  
ATOM    108  H   ALA A   9      -1.593  -3.254  -7.086  1.00  2.060          H  
ATOM    109  HA  ALA A   9       1.001  -2.298  -7.308  1.00  2.060          H  
ATOM    110 1HB  ALA A   9       1.729  -4.373  -6.297  1.00  2.890          H  
ATOM    111 2HB  ALA A   9       0.253  -3.779  -5.532  1.00  2.890          H  
ATOM    112 3HB  ALA A   9       0.172  -5.100  -6.702  1.00  2.890          H  
ATOM    113  N   ASP A  10       0.352  -4.449  -9.679  1.00  1.690          N  
ATOM    114  CA  ASP A  10       0.863  -5.022 -10.920  1.00  1.720          C  
ATOM    115  C   ASP A  10       1.532  -3.953 -11.794  1.00  1.440          C  
ATOM    116  O   ASP A  10       2.391  -4.271 -12.617  1.00  1.420          O  
ATOM    117  CB  ASP A  10      -0.282  -5.614 -11.741  1.00  2.400          C  
ATOM    118  CG  ASP A  10      -0.919  -6.851 -11.142  1.00  2.400          C  
ATOM    119  OD1 ASP A  10      -0.390  -7.405 -10.215  1.00  2.400          O  
ATOM    120  OD2 ASP A  10      -1.958  -7.222 -11.623  1.00  2.400          O  
ATOM    121  H   ASP A  10      -0.599  -4.662  -9.406  1.00  2.030          H  
ATOM    122  HA  ASP A  10       1.594  -5.794 -10.680  1.00  2.060          H  
ATOM    123 1HB  ASP A  10      -1.055  -4.856 -11.870  1.00  2.880          H  
ATOM    124 2HB  ASP A  10       0.088  -5.864 -12.734  1.00  2.880          H  
ATOM    125  N   LYS A  11       1.082  -2.694 -11.663  1.00  1.330          N  
ATOM    126  CA  LYS A  11       1.613  -1.560 -12.412  1.00  1.220          C  
ATOM    127  C   LYS A  11       2.351  -0.577 -11.492  1.00  1.000          C  
ATOM    128  O   LYS A  11       3.338   0.040 -11.911  1.00  1.070          O  
ATOM    129  CB  LYS A  11       0.494  -0.860 -13.185  1.00  1.750          C  
ATOM    130  CG  LYS A  11      -0.177  -1.730 -14.277  1.00  1.750          C  
ATOM    131  CD  LYS A  11       0.809  -2.038 -15.428  1.00  1.750          C  
ATOM    132  CE  LYS A  11       0.167  -2.800 -16.568  1.00  1.750          C  
ATOM    133  NZ  LYS A  11       1.137  -3.015 -17.696  1.00  1.750          N  
ATOM    134  H   LYS A  11       0.366  -2.512 -10.962  1.00  1.600          H  
ATOM    135  HA  LYS A  11       2.351  -1.930 -13.118  1.00  1.460          H  
ATOM    136 1HB  LYS A  11      -0.279  -0.544 -12.481  1.00  2.100          H  
ATOM    137 2HB  LYS A  11       0.890   0.036 -13.662  1.00  2.100          H  
ATOM    138 1HG  LYS A  11      -0.510  -2.669 -13.832  1.00  2.100          H  
ATOM    139 2HG  LYS A  11      -1.048  -1.208 -14.672  1.00  2.100          H  
ATOM    140 1HD  LYS A  11       1.234  -1.108 -15.809  1.00  2.100          H  
ATOM    141 2HD  LYS A  11       1.623  -2.662 -15.063  1.00  2.100          H  
ATOM    142 1HE  LYS A  11      -0.165  -3.770 -16.199  1.00  2.100          H  
ATOM    143 2HE  LYS A  11      -0.697  -2.249 -16.940  1.00  2.100          H  
ATOM    144 1HZ  LYS A  11       0.686  -3.533 -18.439  1.00  2.100          H  
ATOM    145 2HZ  LYS A  11       1.440  -2.117 -18.049  1.00  2.100          H  
ATOM    146 3HZ  LYS A  11       1.950  -3.528 -17.371  1.00  2.100          H  
ATOM    147  N   LEU A  12       1.939  -0.476 -10.220  1.00  0.920          N  
ATOM    148  CA  LEU A  12       2.591   0.463  -9.299  1.00  0.900          C  
ATOM    149  C   LEU A  12       4.038   0.020  -9.120  1.00  0.900          C  
ATOM    150  O   LEU A  12       4.910   0.827  -8.820  1.00  1.040          O  
ATOM    151  CB  LEU A  12       1.879   0.545  -7.949  1.00  1.270          C  
ATOM    152  CG  LEU A  12       0.443   1.134  -7.962  1.00  1.270          C  
ATOM    153  CD1 LEU A  12      -0.187   0.953  -6.609  1.00  1.270          C  
ATOM    154  CD2 LEU A  12       0.474   2.601  -8.305  1.00  1.270          C  
ATOM    155  H   LEU A  12       1.133  -1.021  -9.915  1.00  1.100          H  
ATOM    156  HA  LEU A  12       2.607   1.450  -9.756  1.00  1.080          H  
ATOM    157 1HB  LEU A  12       1.875  -0.405  -7.498  1.00  1.520          H  
ATOM    158 2HB  LEU A  12       2.475   1.207  -7.318  1.00  1.520          H  
ATOM    159  HG  LEU A  12      -0.147   0.616  -8.694  1.00  1.520          H  
ATOM    160 1HD1 LEU A  12      -1.189   1.360  -6.628  1.00  1.520          H  
ATOM    161 2HD1 LEU A  12      -0.235  -0.103  -6.356  1.00  1.520          H  
ATOM    162 3HD1 LEU A  12       0.376   1.479  -5.876  1.00  1.520          H  
ATOM    163 1HD2 LEU A  12      -0.540   2.992  -8.303  1.00  1.520          H  
ATOM    164 2HD2 LEU A  12       1.072   3.139  -7.562  1.00  1.520          H  
ATOM    165 3HD2 LEU A  12       0.907   2.764  -9.288  1.00  1.520          H  
ATOM    166  N   TRP A  13       4.301  -1.281  -9.282  1.00  0.940          N  
ATOM    167  CA  TRP A  13       5.657  -1.795  -9.265  1.00  1.060          C  
ATOM    168  C   TRP A  13       6.523  -1.112 -10.336  1.00  1.100          C  
ATOM    169  O   TRP A  13       7.667  -0.774 -10.069  1.00  1.310          O  
ATOM    170  CB  TRP A  13       5.664  -3.310  -9.439  1.00  1.440          C  
ATOM    171  CG  TRP A  13       7.037  -3.894  -9.616  1.00  1.440          C  
ATOM    172  CD1 TRP A  13       7.487  -4.532 -10.735  1.00  1.440          C  
ATOM    173  CD2 TRP A  13       8.163  -3.861  -8.696  1.00  1.440          C  
ATOM    174  NE1 TRP A  13       8.796  -4.914 -10.571  1.00  1.440          N  
ATOM    175  CE2 TRP A  13       9.228  -4.506  -9.338  1.00  1.440          C  
ATOM    176  CE3 TRP A  13       8.357  -3.337  -7.402  1.00  1.440          C  
ATOM    177  CZ2 TRP A  13      10.457  -4.640  -8.746  1.00  1.440          C  
ATOM    178  CZ3 TRP A  13       9.601  -3.474  -6.819  1.00  1.440          C  
ATOM    179  CH2 TRP A  13      10.617  -4.113  -7.479  1.00  1.440          C  
ATOM    180  H   TRP A  13       3.531  -1.947  -9.407  1.00  1.130          H  
ATOM    181  HA  TRP A  13       6.085  -1.573  -8.295  1.00  1.270          H  
ATOM    182 1HB  TRP A  13       5.213  -3.755  -8.560  1.00  1.720          H  
ATOM    183 2HB  TRP A  13       5.048  -3.588 -10.298  1.00  1.720          H  
ATOM    184  HD1 TRP A  13       6.894  -4.708 -11.634  1.00  1.720          H  
ATOM    185  HE1 TRP A  13       9.378  -5.419 -11.290  1.00  1.720          H  
ATOM    186  HE3 TRP A  13       7.557  -2.829  -6.877  1.00  1.720          H  
ATOM    187  HZ2 TRP A  13      11.289  -5.144  -9.244  1.00  1.720          H  
ATOM    188  HZ3 TRP A  13       9.759  -3.069  -5.825  1.00  1.720          H  
ATOM    189  HH2 TRP A  13      11.577  -4.208  -7.004  1.00  1.720          H  
ATOM    190  N   ASP A  14       6.011  -0.904 -11.557  1.00  1.100          N  
ATOM    191  CA  ASP A  14       6.821  -0.279 -12.611  1.00  1.320          C  
ATOM    192  C   ASP A  14       7.140   1.161 -12.220  1.00  1.420          C  
ATOM    193  O   ASP A  14       8.249   1.675 -12.427  1.00  1.670          O  
ATOM    194  CB  ASP A  14       6.087  -0.284 -13.957  1.00  1.760          C  
ATOM    195  CG  ASP A  14       5.998  -1.655 -14.635  1.00  1.760          C  
ATOM    196  OD1 ASP A  14       6.730  -2.552 -14.278  1.00  1.760          O  
ATOM    197  OD2 ASP A  14       5.170  -1.784 -15.506  1.00  1.760          O  
ATOM    198  H   ASP A  14       5.035  -1.113 -11.747  1.00  1.320          H  
ATOM    199  HA  ASP A  14       7.753  -0.831 -12.712  1.00  1.580          H  
ATOM    200 1HB  ASP A  14       5.071   0.085 -13.806  1.00  2.110          H  
ATOM    201 2HB  ASP A  14       6.582   0.405 -14.639  1.00  2.110          H  
ATOM    202  N   GLU A  15       6.182   1.790 -11.561  1.00  1.370          N  
ATOM    203  CA  GLU A  15       6.363   3.161 -11.100  1.00  1.670          C  
ATOM    204  C   GLU A  15       7.488   3.239 -10.060  1.00  1.780          C  
ATOM    205  O   GLU A  15       8.056   4.307  -9.812  1.00  2.090          O  
ATOM    206  CB  GLU A  15       5.070   3.749 -10.529  1.00  2.220          C  
ATOM    207  CG  GLU A  15       3.961   3.962 -11.562  1.00  2.220          C  
ATOM    208  CD  GLU A  15       2.753   4.646 -10.983  1.00  2.220          C  
ATOM    209  OE1 GLU A  15       2.705   4.794  -9.789  1.00  2.220          O  
ATOM    210  OE2 GLU A  15       1.884   5.020 -11.731  1.00  2.220          O  
ATOM    211  H   GLU A  15       5.282   1.310 -11.450  1.00  1.640          H  
ATOM    212  HA  GLU A  15       6.653   3.769 -11.955  1.00  2.000          H  
ATOM    213 1HB  GLU A  15       4.687   3.099  -9.756  1.00  2.660          H  
ATOM    214 2HB  GLU A  15       5.288   4.711 -10.066  1.00  2.660          H  
ATOM    215 1HG  GLU A  15       4.348   4.551 -12.388  1.00  2.660          H  
ATOM    216 2HG  GLU A  15       3.664   2.985 -11.950  1.00  2.660          H  
ATOM    217  N   ASN A  16       7.828   2.115  -9.431  1.00  1.660          N  
ATOM    218  CA  ASN A  16       8.849   2.125  -8.429  1.00  1.950          C  
ATOM    219  C   ASN A  16      10.210   1.957  -9.072  1.00  1.800          C  
ATOM    220  O   ASN A  16      11.229   2.152  -8.405  1.00  1.810          O  
ATOM    221  CB  ASN A  16       8.579   1.069  -7.394  1.00  2.610          C  
ATOM    222  CG  ASN A  16       7.418   1.432  -6.522  1.00  2.610          C  
ATOM    223  OD1 ASN A  16       7.224   2.589  -6.130  1.00  2.610          O  
ATOM    224  ND2 ASN A  16       6.625   0.464  -6.227  1.00  2.610          N  
ATOM    225  H   ASN A  16       7.414   1.215  -9.684  1.00  1.990          H  
ATOM    226  HA  ASN A  16       8.834   3.093  -7.934  1.00  2.340          H  
ATOM    227 1HB  ASN A  16       8.366   0.130  -7.882  1.00  3.140          H  
ATOM    228 2HB  ASN A  16       9.452   0.925  -6.801  1.00  3.140          H  
ATOM    229 1HD2 ASN A  16       5.820   0.634  -5.661  1.00  3.140          H  
ATOM    230 2HD2 ASN A  16       6.813  -0.447  -6.579  1.00  3.140          H  
ATOM    231  N   LYS A  17      10.245   1.718 -10.388  1.00  1.760          N  
ATOM    232  CA  LYS A  17      11.518   1.640 -11.061  1.00  1.860          C  
ATOM    233  C   LYS A  17      11.917   3.081 -11.270  1.00  1.750          C  
ATOM    234  O   LYS A  17      13.094   3.439 -11.248  1.00  1.940          O  
ATOM    235  CB  LYS A  17      11.463   0.830 -12.343  1.00  2.560          C  
ATOM    236  CG  LYS A  17      11.238  -0.643 -12.070  1.00  2.560          C  
ATOM    237  CD  LYS A  17      11.235  -1.489 -13.327  1.00  2.560          C  
ATOM    238  CE  LYS A  17      10.971  -2.941 -12.957  1.00  2.560          C  
ATOM    239  NZ  LYS A  17      10.975  -3.859 -14.125  1.00  2.560          N  
ATOM    240  H   LYS A  17       9.393   1.607 -10.939  1.00  2.110          H  
ATOM    241  HA  LYS A  17      12.226   1.171 -10.411  1.00  2.230          H  
ATOM    242 1HB  LYS A  17      10.656   1.194 -12.979  1.00  3.080          H  
ATOM    243 2HB  LYS A  17      12.396   0.943 -12.890  1.00  3.080          H  
ATOM    244 1HG  LYS A  17      12.023  -1.003 -11.401  1.00  3.080          H  
ATOM    245 2HG  LYS A  17      10.275  -0.766 -11.561  1.00  3.080          H  
ATOM    246 1HD  LYS A  17      10.448  -1.144 -13.998  1.00  3.080          H  
ATOM    247 2HD  LYS A  17      12.198  -1.413 -13.835  1.00  3.080          H  
ATOM    248 1HE  LYS A  17      11.729  -3.275 -12.247  1.00  3.080          H  
ATOM    249 2HE  LYS A  17       9.991  -2.996 -12.477  1.00  3.080          H  
ATOM    250 1HZ  LYS A  17      10.770  -4.804 -13.752  1.00  3.080          H  
ATOM    251 2HZ  LYS A  17      10.265  -3.595 -14.784  1.00  3.080          H  
ATOM    252 3HZ  LYS A  17      11.879  -3.858 -14.574  1.00  3.080          H  
ATOM    253  N   SER A  18      10.896   3.919 -11.450  1.00  1.620          N  
ATOM    254  CA  SER A  18      11.114   5.353 -11.570  1.00  1.720          C  
ATOM    255  C   SER A  18      11.566   5.928 -10.215  1.00  1.660          C  
ATOM    256  O   SER A  18      12.437   6.795 -10.170  1.00  1.870          O  
ATOM    257  CB  SER A  18       9.857   6.081 -12.033  1.00  2.370          C  
ATOM    258  OG  SER A  18       9.507   5.718 -13.344  1.00  2.370          O  
ATOM    259  H   SER A  18       9.958   3.512 -11.544  1.00  1.940          H  
ATOM    260  HA  SER A  18      11.904   5.525 -12.300  1.00  2.060          H  
ATOM    261 1HB  SER A  18       9.036   5.860 -11.366  1.00  2.840          H  
ATOM    262 2HB  SER A  18      10.026   7.156 -11.981  1.00  2.840          H  
ATOM    263  HG  SER A  18       8.731   6.243 -13.564  1.00  2.840          H  
ATOM    264  N   HIS A  19      10.978   5.430  -9.107  1.00  1.490          N  
ATOM    265  CA  HIS A  19      11.307   5.971  -7.773  1.00  1.490          C  
ATOM    266  C   HIS A  19      12.147   5.132  -6.753  1.00  1.380          C  
ATOM    267  O   HIS A  19      13.095   5.678  -6.172  1.00  1.430          O  
ATOM    268  CB  HIS A  19       9.992   6.369  -7.102  1.00  2.090          C  
ATOM    269  CG  HIS A  19       9.295   7.490  -7.824  1.00  2.090          C  
ATOM    270  ND1 HIS A  19       9.755   8.794  -7.805  1.00  2.090          N  
ATOM    271  CD2 HIS A  19       8.186   7.492  -8.600  1.00  2.090          C  
ATOM    272  CE1 HIS A  19       8.951   9.549  -8.535  1.00  2.090          C  
ATOM    273  NE2 HIS A  19       7.993   8.787  -9.027  1.00  2.090          N  
ATOM    274  H   HIS A  19      10.229   4.753  -9.238  1.00  1.790          H  
ATOM    275  HA  HIS A  19      11.869   6.892  -7.927  1.00  1.790          H  
ATOM    276 1HB  HIS A  19       9.316   5.508  -7.078  1.00  2.500          H  
ATOM    277 2HB  HIS A  19      10.180   6.672  -6.077  1.00  2.500          H  
ATOM    278  HD1 HIS A  19      10.671   9.086  -7.521  1.00  2.500          H  
ATOM    279  HD2 HIS A  19       7.494   6.705  -8.909  1.00  2.500          H  
ATOM    280  HE1 HIS A  19       9.143  10.617  -8.642  1.00  2.500          H  
ATOM    281  N   PHE A  20      11.830   3.846  -6.502  1.00  1.320          N  
ATOM    282  CA  PHE A  20      12.555   3.084  -5.472  1.00  1.350          C  
ATOM    283  C   PHE A  20      13.988   2.902  -5.895  1.00  1.210          C  
ATOM    284  O   PHE A  20      14.908   3.037  -5.085  1.00  1.260          O  
ATOM    285  CB  PHE A  20      12.001   1.660  -5.204  1.00  1.880          C  
ATOM    286  CG  PHE A  20      10.695   1.474  -4.395  1.00  1.880          C  
ATOM    287  CD1 PHE A  20      10.006   2.522  -3.785  1.00  1.880          C  
ATOM    288  CD2 PHE A  20      10.181   0.169  -4.216  1.00  1.880          C  
ATOM    289  CE1 PHE A  20       8.841   2.268  -3.047  1.00  1.880          C  
ATOM    290  CE2 PHE A  20       9.036  -0.063  -3.483  1.00  1.880          C  
ATOM    291  CZ  PHE A  20       8.365   0.979  -2.902  1.00  1.880          C  
ATOM    292  H   PHE A  20      11.118   3.379  -7.040  1.00  1.580          H  
ATOM    293  HA  PHE A  20      12.555   3.651  -4.539  1.00  1.620          H  
ATOM    294 1HB  PHE A  20      11.861   1.167  -6.162  1.00  2.250          H  
ATOM    295 2HB  PHE A  20      12.768   1.096  -4.700  1.00  2.250          H  
ATOM    296  HD1 PHE A  20      10.368   3.543  -3.884  1.00  2.250          H  
ATOM    297  HD2 PHE A  20      10.695  -0.672  -4.658  1.00  2.250          H  
ATOM    298  HE1 PHE A  20       8.304   3.097  -2.576  1.00  2.250          H  
ATOM    299  HE2 PHE A  20       8.672  -1.074  -3.364  1.00  2.250          H  
ATOM    300  HZ  PHE A  20       7.460   0.790  -2.322  1.00  2.250          H  
ATOM    301  N   ILE A  21      14.176   2.652  -7.181  1.00  1.100          N  
ATOM    302  CA  ILE A  21      15.507   2.402  -7.709  1.00  1.060          C  
ATOM    303  C   ILE A  21      16.436   3.567  -7.464  1.00  1.020          C  
ATOM    304  O   ILE A  21      17.603   3.337  -7.175  1.00  1.040          O  
ATOM    305  CB  ILE A  21      15.460   2.071  -9.208  1.00  1.500          C  
ATOM    306  CG1 ILE A  21      14.697   0.732  -9.424  1.00  1.500          C  
ATOM    307  CG2 ILE A  21      16.873   2.040  -9.834  1.00  1.500          C  
ATOM    308  CD1 ILE A  21      15.294  -0.513  -8.869  1.00  1.500          C  
ATOM    309  H   ILE A  21      13.339   2.582  -7.771  1.00  1.320          H  
ATOM    310  HA  ILE A  21      15.930   1.556  -7.176  1.00  1.270          H  
ATOM    311  HB  ILE A  21      14.881   2.841  -9.709  1.00  1.800          H  
ATOM    312 1HG1 ILE A  21      13.738   0.828  -8.943  1.00  1.800          H  
ATOM    313 2HG1 ILE A  21      14.554   0.591 -10.497  1.00  1.800          H  
ATOM    314 1HG2 ILE A  21      16.791   1.822 -10.897  1.00  1.800          H  
ATOM    315 2HG2 ILE A  21      17.366   3.003  -9.716  1.00  1.800          H  
ATOM    316 3HG2 ILE A  21      17.474   1.294  -9.367  1.00  1.800          H  
ATOM    317 1HD1 ILE A  21      14.617  -1.322  -9.095  1.00  1.800          H  
ATOM    318 2HD1 ILE A  21      16.250  -0.703  -9.334  1.00  1.800          H  
ATOM    319 3HD1 ILE A  21      15.416  -0.448  -7.799  1.00  1.800          H  
ATOM    320  N   GLU A  22      15.986   4.809  -7.648  1.00  1.050          N  
ATOM    321  CA  GLU A  22      16.901   5.909  -7.394  1.00  1.090          C  
ATOM    322  C   GLU A  22      17.314   5.939  -5.930  1.00  1.060          C  
ATOM    323  O   GLU A  22      18.508   6.077  -5.628  1.00  1.070          O  
ATOM    324  CB  GLU A  22      16.331   7.269  -7.785  1.00  1.510          C  
ATOM    325  CG  GLU A  22      17.359   8.380  -7.544  1.00  1.510          C  
ATOM    326  CD  GLU A  22      16.978   9.747  -7.961  1.00  1.510          C  
ATOM    327  OE1 GLU A  22      15.887   9.946  -8.426  1.00  1.510          O  
ATOM    328  OE2 GLU A  22      17.813  10.620  -7.796  1.00  1.510          O  
ATOM    329  H   GLU A  22      15.022   4.977  -7.910  1.00  1.260          H  
ATOM    330  HA  GLU A  22      17.798   5.747  -7.990  1.00  1.310          H  
ATOM    331 1HB  GLU A  22      16.046   7.264  -8.837  1.00  1.810          H  
ATOM    332 2HB  GLU A  22      15.436   7.477  -7.193  1.00  1.810          H  
ATOM    333 1HG  GLU A  22      17.542   8.423  -6.480  1.00  1.810          H  
ATOM    334 2HG  GLU A  22      18.295   8.103  -8.029  1.00  1.810          H  
ATOM    335  N   ASP A  23      16.347   5.788  -5.009  1.00  1.090          N  
ATOM    336  CA  ASP A  23      16.698   5.819  -3.592  1.00  1.180          C  
ATOM    337  C   ASP A  23      17.672   4.707  -3.235  1.00  1.120          C  
ATOM    338  O   ASP A  23      18.621   4.922  -2.463  1.00  1.170          O  
ATOM    339  CB  ASP A  23      15.461   5.671  -2.703  1.00  1.620          C  
ATOM    340  CG  ASP A  23      14.559   6.911  -2.626  1.00  1.620          C  
ATOM    341  OD1 ASP A  23      14.983   7.987  -2.987  1.00  1.620          O  
ATOM    342  OD2 ASP A  23      13.444   6.756  -2.191  1.00  1.620          O  
ATOM    343  H   ASP A  23      15.367   5.682  -5.308  1.00  1.310          H  
ATOM    344  HA  ASP A  23      17.174   6.776  -3.379  1.00  1.420          H  
ATOM    345 1HB  ASP A  23      14.860   4.836  -3.081  1.00  1.940          H  
ATOM    346 2HB  ASP A  23      15.775   5.404  -1.698  1.00  1.940          H  
ATOM    347  N   PHE A  24      17.456   3.521  -3.811  1.00  1.090          N  
ATOM    348  CA  PHE A  24      18.331   2.411  -3.515  1.00  1.170          C  
ATOM    349  C   PHE A  24      19.665   2.577  -4.174  1.00  1.120          C  
ATOM    350  O   PHE A  24      20.678   2.258  -3.564  1.00  1.250          O  
ATOM    351  CB  PHE A  24      17.704   1.066  -3.868  1.00  1.610          C  
ATOM    352  CG  PHE A  24      16.683   0.692  -2.857  1.00  1.610          C  
ATOM    353  CD1 PHE A  24      15.347   0.585  -3.184  1.00  1.610          C  
ATOM    354  CD2 PHE A  24      17.070   0.495  -1.529  1.00  1.610          C  
ATOM    355  CE1 PHE A  24      14.418   0.294  -2.205  1.00  1.610          C  
ATOM    356  CE2 PHE A  24      16.153   0.202  -0.572  1.00  1.610          C  
ATOM    357  CZ  PHE A  24      14.832   0.107  -0.902  1.00  1.610          C  
ATOM    358  H   PHE A  24      16.640   3.394  -4.417  1.00  1.310          H  
ATOM    359  HA  PHE A  24      18.507   2.417  -2.444  1.00  1.400          H  
ATOM    360 1HB  PHE A  24      17.223   1.130  -4.847  1.00  1.930          H  
ATOM    361 2HB  PHE A  24      18.467   0.290  -3.914  1.00  1.930          H  
ATOM    362  HD1 PHE A  24      15.037   0.743  -4.212  1.00  1.930          H  
ATOM    363  HD2 PHE A  24      18.125   0.579  -1.254  1.00  1.930          H  
ATOM    364  HE1 PHE A  24      13.358   0.218  -2.449  1.00  1.930          H  
ATOM    365  HE2 PHE A  24      16.463   0.052   0.461  1.00  1.930          H  
ATOM    366  HZ  PHE A  24      14.109  -0.114  -0.119  1.00  1.930          H  
ATOM    367  N   CYS A  25      19.706   3.110  -5.387  1.00  1.010          N  
ATOM    368  CA  CYS A  25      20.978   3.286  -6.040  1.00  1.070          C  
ATOM    369  C   CYS A  25      21.862   4.179  -5.225  1.00  1.090          C  
ATOM    370  O   CYS A  25      23.051   3.897  -5.118  1.00  1.200          O  
ATOM    371  CB  CYS A  25      20.863   3.892  -7.425  1.00  1.470          C  
ATOM    372  SG  CYS A  25      22.482   3.959  -8.253  1.00  1.470          S  
ATOM    373  H   CYS A  25      18.853   3.340  -5.891  1.00  1.210          H  
ATOM    374  HA  CYS A  25      21.465   2.321  -6.121  1.00  1.280          H  
ATOM    375 1HB  CYS A  25      20.170   3.317  -8.037  1.00  1.770          H  
ATOM    376 2HB  CYS A  25      20.469   4.909  -7.342  1.00  1.770          H  
ATOM    377  HG  CYS A  25      23.171   4.311  -7.148  1.00  1.770          H  
ATOM    378  N   TRP A  26      21.337   5.280  -4.684  1.00  1.060          N  
ATOM    379  CA  TRP A  26      22.210   6.140  -3.902  1.00  1.170          C  
ATOM    380  C   TRP A  26      22.699   5.455  -2.623  1.00  1.250          C  
ATOM    381  O   TRP A  26      23.891   5.533  -2.294  1.00  1.380          O  
ATOM    382  CB  TRP A  26      21.512   7.449  -3.529  1.00  1.590          C  
ATOM    383  CG  TRP A  26      21.322   8.385  -4.676  1.00  1.590          C  
ATOM    384  CD1 TRP A  26      20.134   8.803  -5.194  1.00  1.590          C  
ATOM    385  CD2 TRP A  26      22.353   9.016  -5.472  1.00  1.590          C  
ATOM    386  NE1 TRP A  26      20.349   9.655  -6.252  1.00  1.590          N  
ATOM    387  CE2 TRP A  26      21.703   9.790  -6.440  1.00  1.590          C  
ATOM    388  CE3 TRP A  26      23.762   8.979  -5.450  1.00  1.590          C  
ATOM    389  CZ2 TRP A  26      22.403  10.530  -7.372  1.00  1.590          C  
ATOM    390  CZ3 TRP A  26      24.460   9.718  -6.387  1.00  1.590          C  
ATOM    391  CH2 TRP A  26      23.800  10.472  -7.326  1.00  1.590          C  
ATOM    392  H   TRP A  26      20.349   5.518  -4.848  1.00  1.270          H  
ATOM    393  HA  TRP A  26      23.075   6.375  -4.513  1.00  1.400          H  
ATOM    394 1HB  TRP A  26      20.525   7.218  -3.117  1.00  1.910          H  
ATOM    395 2HB  TRP A  26      22.079   7.959  -2.756  1.00  1.910          H  
ATOM    396  HD1 TRP A  26      19.154   8.505  -4.823  1.00  1.910          H  
ATOM    397  HE1 TRP A  26      19.584  10.107  -6.819  1.00  1.910          H  
ATOM    398  HE3 TRP A  26      24.297   8.387  -4.709  1.00  1.910          H  
ATOM    399  HZ2 TRP A  26      21.898  11.133  -8.126  1.00  1.910          H  
ATOM    400  HZ3 TRP A  26      25.550   9.685  -6.363  1.00  1.910          H  
ATOM    401  HH2 TRP A  26      24.380  11.041  -8.050  1.00  1.910          H  
ATOM    402  N   LYS A  27      21.798   4.757  -1.913  1.00  1.270          N  
ATOM    403  CA  LYS A  27      22.165   4.063  -0.680  1.00  1.490          C  
ATOM    404  C   LYS A  27      23.181   2.950  -0.934  1.00  1.550          C  
ATOM    405  O   LYS A  27      24.071   2.692  -0.117  1.00  1.780          O  
ATOM    406  CB  LYS A  27      20.922   3.496   0.005  1.00  2.000          C  
ATOM    407  CG  LYS A  27      20.008   4.552   0.622  1.00  2.000          C  
ATOM    408  CD  LYS A  27      18.760   3.933   1.253  1.00  2.000          C  
ATOM    409  CE  LYS A  27      17.884   5.009   1.898  1.00  2.000          C  
ATOM    410  NZ  LYS A  27      16.642   4.444   2.507  1.00  2.000          N  
ATOM    411  H   LYS A  27      20.818   4.724  -2.224  1.00  1.520          H  
ATOM    412  HA  LYS A  27      22.630   4.790  -0.011  1.00  1.790          H  
ATOM    413 1HB  LYS A  27      20.336   2.940  -0.732  1.00  2.400          H  
ATOM    414 2HB  LYS A  27      21.218   2.795   0.783  1.00  2.400          H  
ATOM    415 1HG  LYS A  27      20.559   5.105   1.382  1.00  2.400          H  
ATOM    416 2HG  LYS A  27      19.700   5.254  -0.152  1.00  2.400          H  
ATOM    417 1HD  LYS A  27      18.182   3.424   0.474  1.00  2.400          H  
ATOM    418 2HD  LYS A  27      19.050   3.202   2.006  1.00  2.400          H  
ATOM    419 1HE  LYS A  27      18.460   5.509   2.675  1.00  2.400          H  
ATOM    420 2HE  LYS A  27      17.605   5.740   1.139  1.00  2.400          H  
ATOM    421 1HZ  LYS A  27      16.102   5.192   2.922  1.00  2.400          H  
ATOM    422 2HZ  LYS A  27      16.090   3.991   1.792  1.00  2.400          H  
ATOM    423 3HZ  LYS A  27      16.887   3.773   3.221  1.00  2.400          H  
ATOM    424  N   LEU A  28      23.001   2.264  -2.057  1.00  1.420          N  
ATOM    425  CA  LEU A  28      23.836   1.159  -2.473  1.00  1.550          C  
ATOM    426  C   LEU A  28      25.185   1.665  -2.992  1.00  1.520          C  
ATOM    427  O   LEU A  28      26.234   1.122  -2.627  1.00  1.690          O  
ATOM    428  CB  LEU A  28      23.039   0.362  -3.518  1.00  2.120          C  
ATOM    429  CG  LEU A  28      23.602  -0.923  -4.094  1.00  2.120          C  
ATOM    430  CD1 LEU A  28      23.887  -1.927  -2.980  1.00  2.120          C  
ATOM    431  CD2 LEU A  28      22.544  -1.494  -5.043  1.00  2.120          C  
ATOM    432  H   LEU A  28      22.209   2.504  -2.646  1.00  1.700          H  
ATOM    433  HA  LEU A  28      24.010   0.533  -1.604  1.00  1.860          H  
ATOM    434 1HB  LEU A  28      22.074   0.117  -3.079  1.00  2.540          H  
ATOM    435 2HB  LEU A  28      22.852   1.028  -4.361  1.00  2.540          H  
ATOM    436  HG  LEU A  28      24.518  -0.723  -4.646  1.00  2.540          H  
ATOM    437 1HD1 LEU A  28      24.256  -2.855  -3.413  1.00  2.540          H  
ATOM    438 2HD1 LEU A  28      24.635  -1.533  -2.297  1.00  2.540          H  
ATOM    439 3HD1 LEU A  28      22.969  -2.124  -2.433  1.00  2.540          H  
ATOM    440 1HD2 LEU A  28      22.902  -2.420  -5.470  1.00  2.540          H  
ATOM    441 2HD2 LEU A  28      21.622  -1.687  -4.495  1.00  2.540          H  
ATOM    442 3HD2 LEU A  28      22.346  -0.780  -5.835  1.00  2.540          H  
ATOM    443  N   HIS A  29      25.180   2.742  -3.784  1.00  1.410          N  
ATOM    444  CA  HIS A  29      26.381   3.365  -4.333  1.00  1.530          C  
ATOM    445  C   HIS A  29      27.309   3.769  -3.194  1.00  1.590          C  
ATOM    446  O   HIS A  29      28.509   3.492  -3.213  1.00  1.710          O  
ATOM    447  CB  HIS A  29      26.003   4.583  -5.187  1.00  2.090          C  
ATOM    448  CG  HIS A  29      27.145   5.330  -5.775  1.00  2.090          C  
ATOM    449  ND1 HIS A  29      27.900   4.842  -6.823  1.00  2.090          N  
ATOM    450  CD2 HIS A  29      27.655   6.543  -5.470  1.00  2.090          C  
ATOM    451  CE1 HIS A  29      28.830   5.730  -7.134  1.00  2.090          C  
ATOM    452  NE2 HIS A  29      28.701   6.770  -6.330  1.00  2.090          N  
ATOM    453  H   HIS A  29      24.292   3.148  -4.069  1.00  1.690          H  
ATOM    454  HA  HIS A  29      26.909   2.652  -4.967  1.00  1.840          H  
ATOM    455 1HB  HIS A  29      25.371   4.256  -6.009  1.00  2.510          H  
ATOM    456 2HB  HIS A  29      25.416   5.275  -4.586  1.00  2.510          H  
ATOM    457  HD1 HIS A  29      27.941   3.884  -7.113  1.00  2.510          H  
ATOM    458  HD2 HIS A  29      27.384   7.290  -4.724  1.00  2.510          H  
ATOM    459  HE1 HIS A  29      29.536   5.535  -7.941  1.00  2.510          H  
ATOM    460  N   ARG A  30      26.733   4.392  -2.167  1.00  1.580          N  
ATOM    461  CA  ARG A  30      27.445   4.836  -0.978  1.00  1.760          C  
ATOM    462  C   ARG A  30      28.223   3.720  -0.261  1.00  1.880          C  
ATOM    463  O   ARG A  30      29.141   4.005   0.519  1.00  2.060          O  
ATOM    464  CB  ARG A  30      26.460   5.483  -0.007  1.00  2.390          C  
ATOM    465  CG  ARG A  30      27.024   5.927   1.353  1.00  2.390          C  
ATOM    466  CD  ARG A  30      28.067   6.985   1.231  1.00  2.390          C  
ATOM    467  NE  ARG A  30      28.629   7.336   2.524  1.00  2.390          N  
ATOM    468  CZ  ARG A  30      29.605   6.643   3.163  1.00  2.390          C  
ATOM    469  NH1 ARG A  30      30.116   5.539   2.632  1.00  2.390          N  
ATOM    470  NH2 ARG A  30      30.051   7.076   4.336  1.00  2.390          N  
ATOM    471  H   ARG A  30      25.734   4.618  -2.229  1.00  1.900          H  
ATOM    472  HA  ARG A  30      28.156   5.594  -1.300  1.00  2.110          H  
ATOM    473 1HB  ARG A  30      26.000   6.347  -0.482  1.00  2.870          H  
ATOM    474 2HB  ARG A  30      25.658   4.772   0.198  1.00  2.870          H  
ATOM    475 1HG  ARG A  30      26.206   6.357   1.925  1.00  2.870          H  
ATOM    476 2HG  ARG A  30      27.413   5.076   1.904  1.00  2.870          H  
ATOM    477 1HD  ARG A  30      28.879   6.661   0.591  1.00  2.870          H  
ATOM    478 2HD  ARG A  30      27.615   7.880   0.806  1.00  2.870          H  
ATOM    479  HE  ARG A  30      28.274   8.168   2.973  1.00  2.870          H  
ATOM    480 1HH1 ARG A  30      29.771   5.176   1.726  1.00  2.870          H  
ATOM    481 2HH1 ARG A  30      30.838   5.031   3.116  1.00  2.870          H  
ATOM    482 1HH2 ARG A  30      29.665   7.917   4.745  1.00  2.870          H  
ATOM    483 2HH2 ARG A  30      30.776   6.569   4.821  1.00  2.870          H  
ATOM    484  N   ARG A  31      27.803   2.466  -0.457  1.00  1.810          N  
ATOM    485  CA  ARG A  31      28.379   1.290   0.171  1.00  1.930          C  
ATOM    486  C   ARG A  31      29.210   0.468  -0.823  1.00  1.980          C  
ATOM    487  O   ARG A  31      29.609  -0.659  -0.517  1.00  2.020          O  
ATOM    488  CB  ARG A  31      27.258   0.439   0.749  1.00  2.650          C  
ATOM    489  CG  ARG A  31      26.537   1.067   1.943  1.00  2.650          C  
ATOM    490  CD  ARG A  31      25.243   0.383   2.237  1.00  2.650          C  
ATOM    491  NE  ARG A  31      24.629   0.872   3.482  1.00  2.650          N  
ATOM    492  CZ  ARG A  31      23.931   2.029   3.657  1.00  2.650          C  
ATOM    493  NH1 ARG A  31      23.716   2.881   2.669  1.00  2.650          N  
ATOM    494  NH2 ARG A  31      23.454   2.307   4.863  1.00  2.650          N  
ATOM    495  H   ARG A  31      27.077   2.281  -1.147  1.00  2.170          H  
ATOM    496  HA  ARG A  31      29.029   1.613   0.981  1.00  2.320          H  
ATOM    497 1HB  ARG A  31      26.512   0.258  -0.028  1.00  3.180          H  
ATOM    498 2HB  ARG A  31      27.652  -0.526   1.062  1.00  3.180          H  
ATOM    499 1HG  ARG A  31      27.168   1.003   2.824  1.00  3.180          H  
ATOM    500 2HG  ARG A  31      26.331   2.115   1.720  1.00  3.180          H  
ATOM    501 1HD  ARG A  31      24.545   0.551   1.416  1.00  3.180          H  
ATOM    502 2HD  ARG A  31      25.421  -0.686   2.342  1.00  3.180          H  
ATOM    503  HE  ARG A  31      24.742   0.282   4.295  1.00  3.180          H  
ATOM    504 1HH1 ARG A  31      24.060   2.701   1.714  1.00  3.180          H  
ATOM    505 2HH1 ARG A  31      23.194   3.724   2.837  1.00  3.180          H  
ATOM    506 1HH2 ARG A  31      23.610   1.666   5.630  1.00  3.180          H  
ATOM    507 2HH2 ARG A  31      22.935   3.158   5.019  1.00  3.180          H  
ATOM    508  N   GLU A  32      29.467   1.056  -1.998  1.00  2.090          N  
ATOM    509  CA  GLU A  32      30.187   0.473  -3.131  1.00  2.310          C  
ATOM    510  C   GLU A  32      29.502  -0.754  -3.740  1.00  1.850          C  
ATOM    511  O   GLU A  32      30.175  -1.684  -4.192  1.00  1.990          O  
ATOM    512  CB  GLU A  32      31.625   0.082  -2.732  1.00  3.150          C  
ATOM    513  CG  GLU A  32      32.519   1.230  -2.262  1.00  3.150          C  
ATOM    514  CD  GLU A  32      33.931   0.768  -1.959  1.00  3.150          C  
ATOM    515  OE1 GLU A  32      34.113  -0.417  -1.814  1.00  3.150          O  
ATOM    516  OE2 GLU A  32      34.813   1.590  -1.880  1.00  3.150          O  
ATOM    517  H   GLU A  32      29.104   1.998  -2.157  1.00  2.510          H  
ATOM    518  HA  GLU A  32      30.244   1.237  -3.907  1.00  2.770          H  
ATOM    519 1HB  GLU A  32      31.608  -0.677  -1.956  1.00  3.780          H  
ATOM    520 2HB  GLU A  32      32.117  -0.362  -3.596  1.00  3.780          H  
ATOM    521 1HG  GLU A  32      32.551   1.995  -3.036  1.00  3.780          H  
ATOM    522 2HG  GLU A  32      32.084   1.673  -1.368  1.00  3.780          H  
ATOM    523  N   GLY A  33      28.168  -0.748  -3.804  1.00  1.840          N  
ATOM    524  CA  GLY A  33      27.454  -1.846  -4.430  1.00  2.000          C  
ATOM    525  C   GLY A  33      27.240  -1.576  -5.917  1.00  1.780          C  
ATOM    526  O   GLY A  33      27.773  -0.611  -6.470  1.00  1.850          O  
ATOM    527  H   GLY A  33      27.622   0.022  -3.410  1.00  2.210          H  
ATOM    528 1HA  GLY A  33      28.013  -2.771  -4.297  1.00  2.400          H  
ATOM    529 2HA  GLY A  33      26.500  -1.978  -3.937  1.00  2.400          H  
ATOM    530  N   ALA A  34      26.457  -2.431  -6.574  1.00  1.690          N  
ATOM    531  CA  ALA A  34      26.204  -2.257  -8.002  1.00  1.700          C  
ATOM    532  C   ALA A  34      24.893  -1.537  -8.245  1.00  1.360          C  
ATOM    533  O   ALA A  34      23.874  -1.868  -7.647  1.00  1.170          O  
ATOM    534  CB  ALA A  34      26.186  -3.592  -8.711  1.00  2.380          C  
ATOM    535  H   ALA A  34      26.042  -3.195  -6.064  1.00  2.030          H  
ATOM    536  HA  ALA A  34      27.010  -1.649  -8.416  1.00  2.040          H  
ATOM    537 1HB  ALA A  34      26.038  -3.426  -9.766  1.00  2.850          H  
ATOM    538 2HB  ALA A  34      27.138  -4.099  -8.557  1.00  2.850          H  
ATOM    539 3HB  ALA A  34      25.386  -4.195  -8.321  1.00  2.850          H  
ATOM    540  N   CYS A  35      24.870  -0.664  -9.244  1.00  1.480          N  
ATOM    541  CA  CYS A  35      23.672   0.102  -9.602  1.00  1.380          C  
ATOM    542  C   CYS A  35      22.576  -0.742 -10.247  1.00  1.320          C  
ATOM    543  O   CYS A  35      21.486  -0.246 -10.543  1.00  1.350          O  
ATOM    544  CB  CYS A  35      24.033   1.225 -10.561  1.00  1.970          C  
ATOM    545  SG  CYS A  35      24.546   0.639 -12.175  1.00  1.970          S  
ATOM    546  H   CYS A  35      25.738  -0.461  -9.722  1.00  1.780          H  
ATOM    547  HA  CYS A  35      23.274   0.547  -8.687  1.00  1.660          H  
ATOM    548 1HB  CYS A  35      23.172   1.879 -10.696  1.00  2.370          H  
ATOM    549 2HB  CYS A  35      24.838   1.824 -10.139  1.00  2.370          H  
ATOM    550  HG  CYS A  35      23.354   0.140 -12.517  1.00  2.370          H  
ATOM    551  N   VAL A  36      22.887  -2.003 -10.517  1.00  1.420          N  
ATOM    552  CA  VAL A  36      21.942  -2.913 -11.134  1.00  1.640          C  
ATOM    553  C   VAL A  36      21.316  -3.861 -10.120  1.00  1.480          C  
ATOM    554  O   VAL A  36      20.406  -4.610 -10.462  1.00  1.800          O  
ATOM    555  CB  VAL A  36      22.609  -3.741 -12.249  1.00  2.210          C  
ATOM    556  CG1 VAL A  36      23.165  -2.815 -13.308  1.00  2.210          C  
ATOM    557  CG2 VAL A  36      23.712  -4.624 -11.671  1.00  2.210          C  
ATOM    558  H   VAL A  36      23.810  -2.318 -10.267  1.00  1.700          H  
ATOM    559  HA  VAL A  36      21.143  -2.322 -11.586  1.00  1.970          H  
ATOM    560  HB  VAL A  36      21.852  -4.368 -12.721  1.00  2.650          H  
ATOM    561 1HG1 VAL A  36      23.612  -3.406 -14.107  1.00  2.650          H  
ATOM    562 2HG1 VAL A  36      22.359  -2.205 -13.711  1.00  2.650          H  
ATOM    563 3HG1 VAL A  36      23.919  -2.178 -12.871  1.00  2.650          H  
ATOM    564 1HG2 VAL A  36      24.161  -5.207 -12.475  1.00  2.650          H  
ATOM    565 2HG2 VAL A  36      24.461  -4.009 -11.222  1.00  2.650          H  
ATOM    566 3HG2 VAL A  36      23.302  -5.307 -10.924  1.00  2.650          H  
ATOM    567  N   ASN A  37      21.770  -3.827  -8.860  1.00  1.200          N  
ATOM    568  CA  ASN A  37      21.189  -4.720  -7.862  1.00  1.310          C  
ATOM    569  C   ASN A  37      20.106  -3.984  -7.080  1.00  1.180          C  
ATOM    570  O   ASN A  37      19.509  -4.508  -6.127  1.00  1.250          O  
ATOM    571  CB  ASN A  37      22.256  -5.309  -6.969  1.00  1.790          C  
ATOM    572  CG  ASN A  37      23.130  -6.292  -7.713  1.00  1.790          C  
ATOM    573  OD1 ASN A  37      22.709  -6.949  -8.672  1.00  1.790          O  
ATOM    574  ND2 ASN A  37      24.345  -6.424  -7.268  1.00  1.790          N  
ATOM    575  H   ASN A  37      22.516  -3.179  -8.585  1.00  1.440          H  
ATOM    576  HA  ASN A  37      20.701  -5.547  -8.377  1.00  1.570          H  
ATOM    577 1HB  ASN A  37      22.885  -4.509  -6.585  1.00  2.150          H  
ATOM    578 2HB  ASN A  37      21.793  -5.810  -6.119  1.00  2.150          H  
ATOM    579 1HD2 ASN A  37      24.971  -7.066  -7.710  1.00  2.150          H  
ATOM    580 2HD2 ASN A  37      24.649  -5.896  -6.479  1.00  2.150          H  
ATOM    581  N   CYS A  38      19.809  -2.788  -7.568  1.00  1.120          N  
ATOM    582  CA  CYS A  38      18.819  -1.886  -7.019  1.00  1.070          C  
ATOM    583  C   CYS A  38      17.447  -2.526  -7.068  1.00  1.020          C  
ATOM    584  O   CYS A  38      16.625  -2.285  -6.183  1.00  1.000          O  
ATOM    585  CB  CYS A  38      18.814  -0.621  -7.839  1.00  1.520          C  
ATOM    586  SG  CYS A  38      20.296   0.283  -7.686  1.00  1.520          S  
ATOM    587  H   CYS A  38      20.350  -2.480  -8.362  1.00  1.340          H  
ATOM    588  HA  CYS A  38      19.081  -1.651  -5.988  1.00  1.280          H  
ATOM    589 1HB  CYS A  38      18.679  -0.870  -8.894  1.00  1.820          H  
ATOM    590 2HB  CYS A  38      17.996   0.022  -7.528  1.00  1.820          H  
ATOM    591  HG  CYS A  38      20.442   0.569  -9.002  1.00  1.820          H  
ATOM    592  N   GLU A  39      17.194  -3.342  -8.094  1.00  1.120          N  
ATOM    593  CA  GLU A  39      15.931  -4.043  -8.224  1.00  1.180          C  
ATOM    594  C   GLU A  39      15.708  -5.055  -7.114  1.00  1.140          C  
ATOM    595  O   GLU A  39      14.559  -5.339  -6.783  1.00  1.180          O  
ATOM    596  CB  GLU A  39      15.792  -4.711  -9.587  1.00  1.630          C  
ATOM    597  CG  GLU A  39      15.600  -3.722 -10.735  1.00  1.630          C  
ATOM    598  CD  GLU A  39      15.403  -4.368 -12.069  1.00  1.630          C  
ATOM    599  OE1 GLU A  39      15.567  -5.558 -12.168  1.00  1.630          O  
ATOM    600  OE2 GLU A  39      15.073  -3.662 -12.994  1.00  1.630          O  
ATOM    601  H   GLU A  39      17.889  -3.477  -8.821  1.00  1.340          H  
ATOM    602  HA  GLU A  39      15.132  -3.312  -8.148  1.00  1.420          H  
ATOM    603 1HB  GLU A  39      16.688  -5.301  -9.793  1.00  1.950          H  
ATOM    604 2HB  GLU A  39      14.943  -5.396  -9.576  1.00  1.950          H  
ATOM    605 1HG  GLU A  39      14.721  -3.125 -10.523  1.00  1.950          H  
ATOM    606 2HG  GLU A  39      16.459  -3.054 -10.777  1.00  1.950          H  
ATOM    607  N   MET A  40      16.777  -5.670  -6.575  1.00  1.150          N  
ATOM    608  CA  MET A  40      16.546  -6.657  -5.537  1.00  1.260          C  
ATOM    609  C   MET A  40      16.177  -5.926  -4.268  1.00  1.200          C  
ATOM    610  O   MET A  40      15.341  -6.383  -3.483  1.00  1.280          O  
ATOM    611  CB  MET A  40      17.771  -7.534  -5.331  1.00  1.720          C  
ATOM    612  CG  MET A  40      18.098  -8.446  -6.514  1.00  1.720          C  
ATOM    613  SD  MET A  40      16.695  -9.479  -7.050  1.00  1.720          S  
ATOM    614  CE  MET A  40      16.358 -10.514  -5.626  1.00  1.720          C  
ATOM    615  H   MET A  40      17.738  -5.421  -6.812  1.00  1.380          H  
ATOM    616  HA  MET A  40      15.700  -7.279  -5.818  1.00  1.510          H  
ATOM    617 1HB  MET A  40      18.639  -6.889  -5.170  1.00  2.060          H  
ATOM    618 2HB  MET A  40      17.653  -8.135  -4.435  1.00  2.060          H  
ATOM    619 1HG  MET A  40      18.410  -7.828  -7.359  1.00  2.060          H  
ATOM    620 2HG  MET A  40      18.928  -9.100  -6.249  1.00  2.060          H  
ATOM    621 1HE  MET A  40      15.528 -11.182  -5.856  1.00  2.060          H  
ATOM    622 2HE  MET A  40      17.244 -11.104  -5.385  1.00  2.060          H  
ATOM    623 3HE  MET A  40      16.088  -9.892  -4.773  1.00  2.060          H  
ATOM    624  N   HIS A  41      16.747  -4.735  -4.117  1.00  1.130          N  
ATOM    625  CA  HIS A  41      16.473  -3.913  -2.959  1.00  1.210          C  
ATOM    626  C   HIS A  41      15.050  -3.374  -3.070  1.00  1.120          C  
ATOM    627  O   HIS A  41      14.311  -3.359  -2.080  1.00  1.180          O  
ATOM    628  CB  HIS A  41      17.487  -2.782  -2.866  1.00  1.660          C  
ATOM    629  CG  HIS A  41      18.869  -3.238  -2.523  1.00  1.660          C  
ATOM    630  ND1 HIS A  41      19.727  -3.811  -3.446  1.00  1.660          N  
ATOM    631  CD2 HIS A  41      19.547  -3.198  -1.355  1.00  1.660          C  
ATOM    632  CE1 HIS A  41      20.861  -4.110  -2.856  1.00  1.660          C  
ATOM    633  NE2 HIS A  41      20.781  -3.747  -1.584  1.00  1.660          N  
ATOM    634  H   HIS A  41      17.453  -4.457  -4.802  1.00  1.360          H  
ATOM    635  HA  HIS A  41      16.544  -4.508  -2.052  1.00  1.450          H  
ATOM    636 1HB  HIS A  41      17.513  -2.221  -3.793  1.00  1.990          H  
ATOM    637 2HB  HIS A  41      17.169  -2.126  -2.090  1.00  1.990          H  
ATOM    638  HD1 HIS A  41      19.554  -4.004  -4.433  1.00  1.990          H  
ATOM    639  HD2 HIS A  41      19.286  -2.836  -0.361  1.00  1.990          H  
ATOM    640  HE1 HIS A  41      21.667  -4.573  -3.423  1.00  1.990          H  
ATOM    641  N   ALA A  42      14.655  -2.960  -4.283  1.00  1.010          N  
ATOM    642  CA  ALA A  42      13.303  -2.487  -4.530  1.00  1.010          C  
ATOM    643  C   ALA A  42      12.300  -3.619  -4.260  1.00  0.960          C  
ATOM    644  O   ALA A  42      11.223  -3.359  -3.717  1.00  1.020          O  
ATOM    645  CB  ALA A  42      13.189  -1.953  -5.941  1.00  1.410          C  
ATOM    646  H   ALA A  42      15.337  -2.939  -5.042  1.00  1.210          H  
ATOM    647  HA  ALA A  42      13.090  -1.682  -3.834  1.00  1.210          H  
ATOM    648 1HB  ALA A  42      12.190  -1.579  -6.124  1.00  1.700          H  
ATOM    649 2HB  ALA A  42      13.908  -1.145  -6.071  1.00  1.700          H  
ATOM    650 3HB  ALA A  42      13.409  -2.746  -6.641  1.00  1.700          H  
ATOM    651  N   LEU A  43      12.635  -4.872  -4.623  1.00  0.920          N  
ATOM    652  CA  LEU A  43      11.751  -5.994  -4.311  1.00  0.930          C  
ATOM    653  C   LEU A  43      11.641  -6.214  -2.812  1.00  0.940          C  
ATOM    654  O   LEU A  43      10.548  -6.456  -2.297  1.00  0.940          O  
ATOM    655  CB  LEU A  43      12.205  -7.295  -4.977  1.00  1.300          C  
ATOM    656  CG  LEU A  43      12.011  -7.416  -6.498  1.00  1.300          C  
ATOM    657  CD1 LEU A  43      12.780  -8.629  -6.981  1.00  1.300          C  
ATOM    658  CD2 LEU A  43      10.478  -7.590  -6.839  1.00  1.300          C  
ATOM    659  H   LEU A  43      13.496  -5.043  -5.156  1.00  1.100          H  
ATOM    660  HA  LEU A  43      10.771  -5.747  -4.689  1.00  1.120          H  
ATOM    661 1HB  LEU A  43      13.272  -7.408  -4.786  1.00  1.560          H  
ATOM    662 2HB  LEU A  43      11.691  -8.126  -4.505  1.00  1.560          H  
ATOM    663  HG  LEU A  43      12.400  -6.536  -6.990  1.00  1.560          H  
ATOM    664 1HD1 LEU A  43      12.669  -8.727  -8.056  1.00  1.560          H  
ATOM    665 2HD1 LEU A  43      13.830  -8.501  -6.744  1.00  1.560          H  
ATOM    666 3HD1 LEU A  43      12.406  -9.525  -6.497  1.00  1.560          H  
ATOM    667 1HD2 LEU A  43      10.361  -7.687  -7.917  1.00  1.560          H  
ATOM    668 2HD2 LEU A  43      10.097  -8.490  -6.356  1.00  1.560          H  
ATOM    669 3HD2 LEU A  43       9.904  -6.739  -6.502  1.00  1.560          H  
ATOM    670  N   ASN A  44      12.748  -6.102  -2.079  1.00  1.020          N  
ATOM    671  CA  ASN A  44      12.635  -6.285  -0.642  1.00  1.090          C  
ATOM    672  C   ASN A  44      11.720  -5.209  -0.054  1.00  1.080          C  
ATOM    673  O   ASN A  44      10.918  -5.492   0.845  1.00  1.120          O  
ATOM    674  CB  ASN A  44      14.002  -6.236   0.015  1.00  1.500          C  
ATOM    675  CG  ASN A  44      14.832  -7.461  -0.256  1.00  1.500          C  
ATOM    676  OD1 ASN A  44      14.324  -8.525  -0.626  1.00  1.500          O  
ATOM    677  ND2 ASN A  44      16.122  -7.332  -0.069  1.00  1.500          N  
ATOM    678  H   ASN A  44      13.660  -5.969  -2.530  1.00  1.220          H  
ATOM    679  HA  ASN A  44      12.176  -7.254  -0.447  1.00  1.310          H  
ATOM    680 1HB  ASN A  44      14.541  -5.361  -0.348  1.00  1.800          H  
ATOM    681 2HB  ASN A  44      13.880  -6.123   1.089  1.00  1.800          H  
ATOM    682 1HD2 ASN A  44      16.727  -8.111  -0.231  1.00  1.800          H  
ATOM    683 2HD2 ASN A  44      16.501  -6.460   0.232  1.00  1.800          H  
ATOM    684  N   GLU A  45      11.812  -3.985  -0.595  1.00  1.100          N  
ATOM    685  CA  GLU A  45      11.004  -2.865  -0.136  1.00  1.230          C  
ATOM    686  C   GLU A  45       9.536  -3.036  -0.477  1.00  1.130          C  
ATOM    687  O   GLU A  45       8.679  -2.775   0.367  1.00  1.210          O  
ATOM    688  CB  GLU A  45      11.500  -1.570  -0.765  1.00  1.670          C  
ATOM    689  CG  GLU A  45      10.820  -0.266  -0.297  1.00  1.670          C  
ATOM    690  CD  GLU A  45      11.067   0.068   1.149  1.00  1.670          C  
ATOM    691  OE1 GLU A  45      11.964  -0.493   1.734  1.00  1.670          O  
ATOM    692  OE2 GLU A  45      10.359   0.898   1.667  1.00  1.670          O  
ATOM    693  H   GLU A  45      12.539  -3.821  -1.300  1.00  1.320          H  
ATOM    694  HA  GLU A  45      11.101  -2.794   0.949  1.00  1.480          H  
ATOM    695 1HB  GLU A  45      12.547  -1.504  -0.586  1.00  2.000          H  
ATOM    696 2HB  GLU A  45      11.368  -1.622  -1.841  1.00  2.000          H  
ATOM    697 1HG  GLU A  45      11.183   0.555  -0.915  1.00  2.000          H  
ATOM    698 2HG  GLU A  45       9.748  -0.350  -0.459  1.00  2.000          H  
ATOM    699  N   ILE A  46       9.221  -3.522  -1.682  1.00  1.060          N  
ATOM    700  CA  ILE A  46       7.813  -3.617  -2.017  1.00  1.090          C  
ATOM    701  C   ILE A  46       7.178  -4.697  -1.155  1.00  0.960          C  
ATOM    702  O   ILE A  46       6.052  -4.515  -0.685  1.00  1.020          O  
ATOM    703  CB  ILE A  46       7.602  -3.930  -3.542  1.00  1.510          C  
ATOM    704  CG1 ILE A  46       6.189  -3.599  -4.014  1.00  1.510          C  
ATOM    705  CG2 ILE A  46       7.841  -5.384  -3.902  1.00  1.510          C  
ATOM    706  CD1 ILE A  46       5.860  -2.169  -4.044  1.00  1.510          C  
ATOM    707  H   ILE A  46       9.954  -3.701  -2.371  1.00  1.270          H  
ATOM    708  HA  ILE A  46       7.349  -2.676  -1.767  1.00  1.310          H  
ATOM    709  HB  ILE A  46       8.301  -3.325  -4.098  1.00  1.820          H  
ATOM    710 1HG1 ILE A  46       6.055  -3.988  -5.012  1.00  1.820          H  
ATOM    711 2HG1 ILE A  46       5.484  -4.082  -3.347  1.00  1.820          H  
ATOM    712 1HG2 ILE A  46       7.725  -5.504  -4.969  1.00  1.820          H  
ATOM    713 2HG2 ILE A  46       8.813  -5.653  -3.635  1.00  1.820          H  
ATOM    714 3HG2 ILE A  46       7.132  -6.031  -3.399  1.00  1.820          H  
ATOM    715 1HD1 ILE A  46       4.839  -2.049  -4.400  1.00  1.820          H  
ATOM    716 2HD1 ILE A  46       5.947  -1.735  -3.068  1.00  1.820          H  
ATOM    717 3HD1 ILE A  46       6.539  -1.677  -4.713  1.00  1.820          H  
ATOM    718  N   GLN A  47       7.911  -5.788  -0.885  1.00  0.890          N  
ATOM    719  CA  GLN A  47       7.361  -6.851  -0.077  1.00  0.870          C  
ATOM    720  C   GLN A  47       7.161  -6.416   1.374  1.00  0.850          C  
ATOM    721  O   GLN A  47       6.147  -6.779   1.991  1.00  0.870          O  
ATOM    722  CB  GLN A  47       8.204  -8.110  -0.184  1.00  1.230          C  
ATOM    723  CG  GLN A  47       8.161  -8.725  -1.582  1.00  1.230          C  
ATOM    724  CD  GLN A  47       8.842 -10.064  -1.666  1.00  1.230          C  
ATOM    725  OE1 GLN A  47       8.690 -10.895  -0.760  1.00  1.230          O  
ATOM    726  NE2 GLN A  47       9.587 -10.292  -2.734  1.00  1.230          N  
ATOM    727  H   GLN A  47       8.850  -5.895  -1.291  1.00  1.070          H  
ATOM    728  HA  GLN A  47       6.384  -7.091  -0.474  1.00  1.040          H  
ATOM    729 1HB  GLN A  47       9.247  -7.867   0.048  1.00  1.470          H  
ATOM    730 2HB  GLN A  47       7.863  -8.850   0.537  1.00  1.470          H  
ATOM    731 1HG  GLN A  47       7.152  -8.790  -1.925  1.00  1.470          H  
ATOM    732 2HG  GLN A  47       8.699  -8.062  -2.244  1.00  1.470          H  
ATOM    733 1HE2 GLN A  47      10.065 -11.164  -2.829  1.00  1.470          H  
ATOM    734 2HE2 GLN A  47       9.683  -9.584  -3.436  1.00  1.470          H  
ATOM    735  N   GLU A  48       8.092  -5.600   1.909  1.00  0.880          N  
ATOM    736  CA  GLU A  48       7.940  -5.112   3.274  1.00  0.950          C  
ATOM    737  C   GLU A  48       6.730  -4.196   3.346  1.00  0.860          C  
ATOM    738  O   GLU A  48       5.946  -4.287   4.292  1.00  0.920          O  
ATOM    739  CB  GLU A  48       9.192  -4.346   3.727  1.00  1.300          C  
ATOM    740  CG  GLU A  48       9.162  -3.822   5.191  1.00  1.300          C  
ATOM    741  CD  GLU A  48       9.141  -4.919   6.235  1.00  1.300          C  
ATOM    742  OE1 GLU A  48       9.446  -6.039   5.897  1.00  1.300          O  
ATOM    743  OE2 GLU A  48       8.845  -4.633   7.367  1.00  1.300          O  
ATOM    744  H   GLU A  48       8.949  -5.383   1.390  1.00  1.060          H  
ATOM    745  HA  GLU A  48       7.784  -5.958   3.938  1.00  1.140          H  
ATOM    746 1HB  GLU A  48      10.061  -4.993   3.619  1.00  1.560          H  
ATOM    747 2HB  GLU A  48       9.346  -3.489   3.065  1.00  1.560          H  
ATOM    748 1HG  GLU A  48      10.046  -3.208   5.353  1.00  1.560          H  
ATOM    749 2HG  GLU A  48       8.289  -3.184   5.326  1.00  1.560          H  
ATOM    750  N   VAL A  49       6.535  -3.347   2.335  1.00  0.820          N  
ATOM    751  CA  VAL A  49       5.392  -2.453   2.347  1.00  0.880          C  
ATOM    752  C   VAL A  49       4.094  -3.253   2.279  1.00  0.860          C  
ATOM    753  O   VAL A  49       3.141  -2.948   3.005  1.00  0.930          O  
ATOM    754  CB  VAL A  49       5.448  -1.429   1.212  1.00  1.210          C  
ATOM    755  CG1 VAL A  49       4.154  -0.664   1.183  1.00  1.210          C  
ATOM    756  CG2 VAL A  49       6.610  -0.455   1.438  1.00  1.210          C  
ATOM    757  H   VAL A  49       7.228  -3.290   1.579  1.00  0.980          H  
ATOM    758  HA  VAL A  49       5.402  -1.907   3.284  1.00  1.060          H  
ATOM    759  HB  VAL A  49       5.576  -1.952   0.258  1.00  1.450          H  
ATOM    760 1HG1 VAL A  49       4.188   0.047   0.398  1.00  1.450          H  
ATOM    761 2HG1 VAL A  49       3.313  -1.331   1.024  1.00  1.450          H  
ATOM    762 3HG1 VAL A  49       4.037  -0.152   2.128  1.00  1.450          H  
ATOM    763 1HG2 VAL A  49       6.649   0.269   0.628  1.00  1.450          H  
ATOM    764 2HG2 VAL A  49       6.466   0.062   2.385  1.00  1.450          H  
ATOM    765 3HG2 VAL A  49       7.550  -0.990   1.475  1.00  1.450          H  
ATOM    766  N   PHE A  50       4.033  -4.259   1.399  1.00  0.840          N  
ATOM    767  CA  PHE A  50       2.828  -5.060   1.303  1.00  0.930          C  
ATOM    768  C   PHE A  50       2.497  -5.616   2.683  1.00  0.950          C  
ATOM    769  O   PHE A  50       1.360  -5.473   3.152  1.00  1.060          O  
ATOM    770  CB  PHE A  50       3.037  -6.274   0.371  1.00  1.270          C  
ATOM    771  CG  PHE A  50       3.138  -6.045  -1.139  1.00  1.270          C  
ATOM    772  CD1 PHE A  50       2.458  -5.044  -1.811  1.00  1.270          C  
ATOM    773  CD2 PHE A  50       3.939  -6.895  -1.891  1.00  1.270          C  
ATOM    774  CE1 PHE A  50       2.584  -4.924  -3.191  1.00  1.270          C  
ATOM    775  CE2 PHE A  50       4.061  -6.758  -3.248  1.00  1.270          C  
ATOM    776  CZ  PHE A  50       3.373  -5.772  -3.890  1.00  1.270          C  
ATOM    777  H   PHE A  50       4.824  -4.453   0.777  1.00  1.010          H  
ATOM    778  HA  PHE A  50       2.002  -4.437   0.966  1.00  1.120          H  
ATOM    779 1HB  PHE A  50       3.944  -6.783   0.678  1.00  1.520          H  
ATOM    780 2HB  PHE A  50       2.230  -6.980   0.541  1.00  1.520          H  
ATOM    781  HD1 PHE A  50       1.816  -4.364  -1.265  1.00  1.520          H  
ATOM    782  HD2 PHE A  50       4.472  -7.687  -1.386  1.00  1.520          H  
ATOM    783  HE1 PHE A  50       2.049  -4.163  -3.727  1.00  1.520          H  
ATOM    784  HE2 PHE A  50       4.694  -7.439  -3.812  1.00  1.520          H  
ATOM    785  HZ  PHE A  50       3.448  -5.660  -4.954  1.00  1.520          H  
ATOM    786  N   THR A  51       3.526  -6.150   3.370  1.00  0.930          N  
ATOM    787  CA  THR A  51       3.378  -6.761   4.688  1.00  1.080          C  
ATOM    788  C   THR A  51       2.853  -5.760   5.722  1.00  1.110          C  
ATOM    789  O   THR A  51       1.903  -6.046   6.458  1.00  1.220          O  
ATOM    790  CB  THR A  51       4.737  -7.333   5.174  1.00  1.450          C  
ATOM    791  OG1 THR A  51       5.205  -8.340   4.249  1.00  1.450          O  
ATOM    792  CG2 THR A  51       4.584  -7.964   6.556  1.00  1.450          C  
ATOM    793  H   THR A  51       4.443  -6.202   2.924  1.00  1.120          H  
ATOM    794  HA  THR A  51       2.663  -7.579   4.606  1.00  1.300          H  
ATOM    795  HB  THR A  51       5.472  -6.536   5.230  1.00  1.740          H  
ATOM    796  HG1 THR A  51       5.488  -7.904   3.415  1.00  1.740          H  
ATOM    797 1HG2 THR A  51       5.547  -8.360   6.873  1.00  1.740          H  
ATOM    798 2HG2 THR A  51       4.250  -7.221   7.278  1.00  1.740          H  
ATOM    799 3HG2 THR A  51       3.855  -8.772   6.504  1.00  1.740          H  
ATOM    800  N   LEU A  52       3.424  -4.551   5.736  1.00  1.090          N  
ATOM    801  CA  LEU A  52       3.039  -3.524   6.704  1.00  1.200          C  
ATOM    802  C   LEU A  52       1.570  -3.155   6.582  1.00  1.240          C  
ATOM    803  O   LEU A  52       0.912  -2.863   7.587  1.00  1.380          O  
ATOM    804  CB  LEU A  52       3.861  -2.243   6.477  1.00  1.640          C  
ATOM    805  CG  LEU A  52       5.371  -2.285   6.819  1.00  1.640          C  
ATOM    806  CD1 LEU A  52       6.017  -0.995   6.312  1.00  1.640          C  
ATOM    807  CD2 LEU A  52       5.581  -2.436   8.319  1.00  1.640          C  
ATOM    808  H   LEU A  52       4.213  -4.381   5.107  1.00  1.310          H  
ATOM    809  HA  LEU A  52       3.204  -3.909   7.699  1.00  1.440          H  
ATOM    810 1HB  LEU A  52       3.779  -1.982   5.423  1.00  1.960          H  
ATOM    811 2HB  LEU A  52       3.407  -1.439   7.056  1.00  1.960          H  
ATOM    812  HG  LEU A  52       5.836  -3.117   6.326  1.00  1.960          H  
ATOM    813 1HD1 LEU A  52       7.085  -1.018   6.532  1.00  1.960          H  
ATOM    814 2HD1 LEU A  52       5.876  -0.907   5.244  1.00  1.960          H  
ATOM    815 3HD1 LEU A  52       5.560  -0.140   6.807  1.00  1.960          H  
ATOM    816 1HD2 LEU A  52       6.654  -2.459   8.525  1.00  1.960          H  
ATOM    817 2HD2 LEU A  52       5.128  -1.594   8.841  1.00  1.960          H  
ATOM    818 3HD2 LEU A  52       5.137  -3.360   8.672  1.00  1.960          H  
ATOM    819  N   HIS A  53       1.040  -3.199   5.368  1.00  1.190          N  
ATOM    820  CA  HIS A  53      -0.346  -2.851   5.125  1.00  1.360          C  
ATOM    821  C   HIS A  53      -1.296  -4.065   5.040  1.00  1.450          C  
ATOM    822  O   HIS A  53      -2.439  -3.931   4.593  1.00  1.690          O  
ATOM    823  CB  HIS A  53      -0.410  -1.982   3.880  1.00  1.840          C  
ATOM    824  CG  HIS A  53       0.245  -0.637   4.101  1.00  1.840          C  
ATOM    825  ND1 HIS A  53      -0.428   0.443   4.643  1.00  1.840          N  
ATOM    826  CD2 HIS A  53       1.513  -0.227   3.910  1.00  1.840          C  
ATOM    827  CE1 HIS A  53       0.402   1.467   4.743  1.00  1.840          C  
ATOM    828  NE2 HIS A  53       1.585   1.087   4.306  1.00  1.840          N  
ATOM    829  H   HIS A  53       1.645  -3.421   4.562  1.00  1.430          H  
ATOM    830  HA  HIS A  53      -0.696  -2.238   5.953  1.00  1.630          H  
ATOM    831 1HB  HIS A  53       0.118  -2.495   3.072  1.00  2.200          H  
ATOM    832 2HB  HIS A  53      -1.441  -1.834   3.571  1.00  2.200          H  
ATOM    833  HD1 HIS A  53      -1.314   0.403   5.107  1.00  2.200          H  
ATOM    834  HD2 HIS A  53       2.387  -0.724   3.540  1.00  2.200          H  
ATOM    835  HE1 HIS A  53       0.062   2.422   5.144  1.00  2.200          H  
ATOM    836  N   GLY A  54      -0.839  -5.240   5.504  1.00  1.380          N  
ATOM    837  CA  GLY A  54      -1.666  -6.451   5.567  1.00  1.550          C  
ATOM    838  C   GLY A  54      -1.733  -7.377   4.342  1.00  1.420          C  
ATOM    839  O   GLY A  54      -2.537  -8.313   4.335  1.00  1.550          O  
ATOM    840  H   GLY A  54       0.125  -5.306   5.844  1.00  1.660          H  
ATOM    841 1HA  GLY A  54      -1.309  -7.040   6.413  1.00  1.860          H  
ATOM    842 2HA  GLY A  54      -2.679  -6.153   5.828  1.00  1.860          H  
ATOM    843  N   MET A  55      -0.934  -7.134   3.309  1.00  1.240          N  
ATOM    844  CA  MET A  55      -0.944  -7.973   2.112  1.00  1.210          C  
ATOM    845  C   MET A  55       0.303  -8.838   2.058  1.00  1.110          C  
ATOM    846  O   MET A  55       1.314  -8.513   2.666  1.00  1.140          O  
ATOM    847  CB  MET A  55      -1.050  -7.114   0.866  1.00  1.710          C  
ATOM    848  CG  MET A  55      -2.302  -6.239   0.790  1.00  1.710          C  
ATOM    849  SD  MET A  55      -3.828  -7.219   0.623  1.00  1.710          S  
ATOM    850  CE  MET A  55      -3.729  -7.882  -1.060  1.00  1.710          C  
ATOM    851  H   MET A  55      -0.258  -6.369   3.340  1.00  1.490          H  
ATOM    852  HA  MET A  55      -1.803  -8.642   2.151  1.00  1.450          H  
ATOM    853 1HB  MET A  55      -0.178  -6.467   0.795  1.00  2.050          H  
ATOM    854 2HB  MET A  55      -1.044  -7.771   0.023  1.00  2.050          H  
ATOM    855 1HG  MET A  55      -2.377  -5.652   1.709  1.00  2.050          H  
ATOM    856 2HG  MET A  55      -2.238  -5.543  -0.040  1.00  2.050          H  
ATOM    857 1HE  MET A  55      -4.608  -8.495  -1.259  1.00  2.050          H  
ATOM    858 2HE  MET A  55      -3.692  -7.062  -1.777  1.00  2.050          H  
ATOM    859 3HE  MET A  55      -2.842  -8.499  -1.166  1.00  2.050          H  
ATOM    860  N   LYS A  56       0.258  -9.939   1.329  1.00  1.260          N  
ATOM    861  CA  LYS A  56       1.456 -10.751   1.176  1.00  1.400          C  
ATOM    862  C   LYS A  56       2.006 -10.603  -0.229  1.00  1.330          C  
ATOM    863  O   LYS A  56       1.278 -10.334  -1.172  1.00  1.270          O  
ATOM    864  CB  LYS A  56       1.164 -12.212   1.508  1.00  1.900          C  
ATOM    865  CG  LYS A  56       0.776 -12.432   2.967  1.00  1.900          C  
ATOM    866  CD  LYS A  56       0.555 -13.908   3.282  1.00  1.900          C  
ATOM    867  CE  LYS A  56       0.188 -14.118   4.755  1.00  1.900          C  
ATOM    868  NZ  LYS A  56      -0.013 -15.563   5.087  1.00  1.900          N  
ATOM    869  H   LYS A  56      -0.604 -10.221   0.855  1.00  1.510          H  
ATOM    870  HA  LYS A  56       2.221 -10.393   1.867  1.00  1.680          H  
ATOM    871 1HB  LYS A  56       0.352 -12.575   0.877  1.00  2.280          H  
ATOM    872 2HB  LYS A  56       2.040 -12.819   1.289  1.00  2.280          H  
ATOM    873 1HG  LYS A  56       1.562 -12.034   3.612  1.00  2.280          H  
ATOM    874 2HG  LYS A  56      -0.143 -11.881   3.172  1.00  2.280          H  
ATOM    875 1HD  LYS A  56      -0.254 -14.291   2.655  1.00  2.280          H  
ATOM    876 2HD  LYS A  56       1.461 -14.472   3.057  1.00  2.280          H  
ATOM    877 1HE  LYS A  56       0.987 -13.722   5.381  1.00  2.280          H  
ATOM    878 2HE  LYS A  56      -0.732 -13.576   4.973  1.00  2.280          H  
ATOM    879 1HZ  LYS A  56      -0.253 -15.655   6.066  1.00  2.280          H  
ATOM    880 2HZ  LYS A  56      -0.761 -15.942   4.524  1.00  2.280          H  
ATOM    881 3HZ  LYS A  56       0.838 -16.075   4.903  1.00  2.280          H  
ATOM    882  N   CYS A  57       3.286 -10.854  -0.408  1.00  1.540          N  
ATOM    883  CA  CYS A  57       3.859 -10.755  -1.743  1.00  1.650          C  
ATOM    884  C   CYS A  57       3.308 -11.788  -2.738  1.00  1.740          C  
ATOM    885  O   CYS A  57       3.220 -11.522  -3.949  1.00  1.810          O  
ATOM    886  CB  CYS A  57       5.352 -10.876  -1.610  1.00  2.270          C  
ATOM    887  SG  CYS A  57       5.913 -12.450  -0.974  1.00  2.270          S  
ATOM    888  H   CYS A  57       3.873 -11.077   0.386  1.00  1.850          H  
ATOM    889  HA  CYS A  57       3.635  -9.764  -2.130  1.00  1.980          H  
ATOM    890 1HB  CYS A  57       5.826 -10.689  -2.565  1.00  2.720          H  
ATOM    891 2HB  CYS A  57       5.686 -10.121  -0.913  1.00  2.720          H  
ATOM    892  HG  CYS A  57       7.197 -12.034  -0.774  1.00  2.720          H  
ATOM    893  N   SER A  58       2.840 -12.925  -2.211  1.00  1.910          N  
ATOM    894  CA  SER A  58       2.265 -14.014  -2.991  1.00  2.180          C  
ATOM    895  C   SER A  58       0.883 -13.641  -3.542  1.00  1.990          C  
ATOM    896  O   SER A  58       0.308 -14.359  -4.377  1.00  2.300          O  
ATOM    897  CB  SER A  58       2.183 -15.260  -2.132  1.00  2.940          C  
ATOM    898  OG  SER A  58       1.275 -15.095  -1.082  1.00  2.940          O  
ATOM    899  H   SER A  58       2.938 -13.090  -1.218  1.00  2.290          H  
ATOM    900  HA  SER A  58       2.930 -14.217  -3.832  1.00  2.620          H  
ATOM    901 1HB  SER A  58       1.875 -16.101  -2.749  1.00  3.530          H  
ATOM    902 2HB  SER A  58       3.172 -15.490  -1.734  1.00  3.530          H  
ATOM    903  HG  SER A  58       1.303 -15.912  -0.574  1.00  3.530          H  
ATOM    904  N   HIS A  59       0.319 -12.530  -3.046  1.00  1.670          N  
ATOM    905  CA  HIS A  59      -0.969 -12.020  -3.485  1.00  1.800          C  
ATOM    906  C   HIS A  59      -0.822 -11.237  -4.769  1.00  1.780          C  
ATOM    907  O   HIS A  59      -1.813 -10.967  -5.451  1.00  2.070          O  
ATOM    908  CB  HIS A  59      -1.604 -11.087  -2.445  1.00  2.470          C  
ATOM    909  CG  HIS A  59      -2.109 -11.742  -1.204  1.00  2.470          C  
ATOM    910  ND1 HIS A  59      -2.060 -11.129   0.034  1.00  2.470          N  
ATOM    911  CD2 HIS A  59      -2.714 -12.937  -1.005  1.00  2.470          C  
ATOM    912  CE1 HIS A  59      -2.629 -11.914   0.934  1.00  2.470          C  
ATOM    913  NE2 HIS A  59      -3.027 -13.018   0.331  1.00  2.470          N  
ATOM    914  H   HIS A  59       0.817 -11.970  -2.353  1.00  2.000          H  
ATOM    915  HA  HIS A  59      -1.649 -12.848  -3.674  1.00  2.160          H  
ATOM    916 1HB  HIS A  59      -0.895 -10.328  -2.164  1.00  2.960          H  
ATOM    917 2HB  HIS A  59      -2.440 -10.568  -2.907  1.00  2.960          H  
ATOM    918  HD2 HIS A  59      -2.930 -13.692  -1.763  1.00  2.960          H  
ATOM    919  HE1 HIS A  59      -2.740 -11.687   1.996  1.00  2.960          H  
ATOM    920  HE2 HIS A  59      -3.492 -13.799   0.773  1.00  2.960          H  
ATOM    921  N   PHE A  60       0.407 -10.826  -5.086  1.00  1.660          N  
ATOM    922  CA  PHE A  60       0.607  -9.979  -6.239  1.00  1.860          C  
ATOM    923  C   PHE A  60       1.357 -10.688  -7.340  1.00  1.960          C  
ATOM    924  O   PHE A  60       1.010 -10.542  -8.508  1.00  2.760          O  
ATOM    925  CB  PHE A  60       1.369  -8.749  -5.800  1.00  2.520          C  
ATOM    926  CG  PHE A  60       0.619  -8.039  -4.764  1.00  2.520          C  
ATOM    927  CD1 PHE A  60       0.969  -8.196  -3.462  1.00  2.520          C  
ATOM    928  CD2 PHE A  60      -0.450  -7.247  -5.064  1.00  2.520          C  
ATOM    929  CE1 PHE A  60       0.295  -7.575  -2.476  1.00  2.520          C  
ATOM    930  CE2 PHE A  60      -1.137  -6.613  -4.072  1.00  2.520          C  
ATOM    931  CZ  PHE A  60      -0.758  -6.776  -2.775  1.00  2.520          C  
ATOM    932  H   PHE A  60       1.207 -11.099  -4.518  1.00  1.990          H  
ATOM    933  HA  PHE A  60      -0.363  -9.677  -6.629  1.00  2.230          H  
ATOM    934 1HB  PHE A  60       2.342  -9.030  -5.396  1.00  3.030          H  
ATOM    935 2HB  PHE A  60       1.524  -8.083  -6.643  1.00  3.030          H  
ATOM    936  HD1 PHE A  60       1.807  -8.832  -3.210  1.00  3.030          H  
ATOM    937  HD2 PHE A  60      -0.756  -7.124  -6.105  1.00  3.030          H  
ATOM    938  HE1 PHE A  60       0.616  -7.730  -1.453  1.00  3.030          H  
ATOM    939  HE2 PHE A  60      -1.986  -5.984  -4.322  1.00  3.030          H  
ATOM    940  HZ  PHE A  60      -1.295  -6.279  -1.993  1.00  3.030          H  
ATOM    941  N   LYS A  61       2.379 -11.470  -6.987  1.00  1.580          N  
ATOM    942  CA  LYS A  61       3.151 -12.162  -8.017  1.00  1.750          C  
ATOM    943  C   LYS A  61       3.574 -11.177  -9.111  1.00  1.670          C  
ATOM    944  O   LYS A  61       3.322 -11.392 -10.298  1.00  1.940          O  
ATOM    945  CB  LYS A  61       2.346 -13.316  -8.608  1.00  2.380          C  
ATOM    946  CG  LYS A  61       1.951 -14.383  -7.597  1.00  2.380          C  
ATOM    947  CD  LYS A  61       1.204 -15.520  -8.287  1.00  2.380          C  
ATOM    948  CE  LYS A  61       0.867 -16.691  -7.348  1.00  2.380          C  
ATOM    949  NZ  LYS A  61      -0.194 -16.358  -6.327  1.00  2.380          N  
ATOM    950  H   LYS A  61       2.644 -11.565  -6.002  1.00  1.900          H  
ATOM    951  HA  LYS A  61       4.048 -12.560  -7.561  1.00  2.100          H  
ATOM    952 1HB  LYS A  61       1.438 -12.943  -9.079  1.00  2.860          H  
ATOM    953 2HB  LYS A  61       2.938 -13.800  -9.385  1.00  2.860          H  
ATOM    954 1HG  LYS A  61       2.843 -14.770  -7.100  1.00  2.860          H  
ATOM    955 2HG  LYS A  61       1.306 -13.931  -6.842  1.00  2.860          H  
ATOM    956 1HD  LYS A  61       0.273 -15.129  -8.700  1.00  2.860          H  
ATOM    957 2HD  LYS A  61       1.810 -15.897  -9.109  1.00  2.860          H  
ATOM    958 1HE  LYS A  61       0.511 -17.519  -7.957  1.00  2.860          H  
ATOM    959 2HE  LYS A  61       1.766 -17.003  -6.833  1.00  2.860          H  
ATOM    960 1HZ  LYS A  61      -0.374 -17.173  -5.760  1.00  2.860          H  
ATOM    961 2HZ  LYS A  61       0.097 -15.582  -5.698  1.00  2.860          H  
ATOM    962 3HZ  LYS A  61      -1.040 -16.090  -6.800  1.00  2.860          H  
ATOM    963  N   LEU A  62       4.235 -10.113  -8.684  1.00  1.670          N  
ATOM    964  CA  LEU A  62       4.651  -9.007  -9.528  1.00  1.790          C  
ATOM    965  C   LEU A  62       5.519  -9.439 -10.709  1.00  1.920          C  
ATOM    966  O   LEU A  62       6.137 -10.506 -10.671  1.00  1.990          O  
ATOM    967  CB  LEU A  62       5.466  -8.011  -8.682  1.00  2.460          C  
ATOM    968  CG  LEU A  62       4.755  -7.291  -7.553  1.00  2.460          C  
ATOM    969  CD1 LEU A  62       5.804  -6.466  -6.847  1.00  2.460          C  
ATOM    970  CD2 LEU A  62       3.592  -6.420  -8.091  1.00  2.460          C  
ATOM    971  H   LEU A  62       4.395 -10.053  -7.690  1.00  2.000          H  
ATOM    972  HA  LEU A  62       3.744  -8.549  -9.894  1.00  2.150          H  
ATOM    973 1HB  LEU A  62       6.281  -8.558  -8.227  1.00  2.950          H  
ATOM    974 2HB  LEU A  62       5.914  -7.258  -9.302  1.00  2.950          H  
ATOM    975  HG  LEU A  62       4.359  -8.009  -6.837  1.00  2.950          H  
ATOM    976 1HD1 LEU A  62       5.365  -5.946  -6.024  1.00  2.950          H  
ATOM    977 2HD1 LEU A  62       6.594  -7.122  -6.479  1.00  2.950          H  
ATOM    978 3HD1 LEU A  62       6.228  -5.751  -7.534  1.00  2.950          H  
ATOM    979 1HD2 LEU A  62       3.125  -5.905  -7.271  1.00  2.950          H  
ATOM    980 2HD2 LEU A  62       3.966  -5.691  -8.803  1.00  2.950          H  
ATOM    981 3HD2 LEU A  62       2.842  -7.035  -8.581  1.00  2.950          H  
ATOM    982  N   PRO A  63       5.603  -8.618 -11.784  1.00  2.130          N  
ATOM    983  CA  PRO A  63       6.406  -8.855 -12.977  1.00  2.430          C  
ATOM    984  C   PRO A  63       7.845  -9.296 -12.706  1.00  2.710          C  
ATOM    985  O   PRO A  63       8.390 -10.064 -13.496  1.00  3.020          O  
ATOM    986  CB  PRO A  63       6.359  -7.493 -13.670  1.00  3.650          C  
ATOM    987  CG  PRO A  63       5.005  -6.914 -13.280  1.00  3.650          C  
ATOM    988  CD  PRO A  63       4.783  -7.349 -11.862  1.00  3.650          C  
ATOM    989  HA  PRO A  63       5.897  -9.613 -13.592  1.00  2.920          H  
ATOM    990 1HB  PRO A  63       7.214  -6.869 -13.339  1.00  4.370          H  
ATOM    991 2HB  PRO A  63       6.471  -7.622 -14.757  1.00  4.370          H  
ATOM    992 1HG  PRO A  63       5.014  -5.808 -13.387  1.00  4.370          H  
ATOM    993 2HG  PRO A  63       4.225  -7.284 -13.963  1.00  4.370          H  
ATOM    994 1HD  PRO A  63       5.138  -6.562 -11.194  1.00  4.370          H  
ATOM    995 2HD  PRO A  63       3.704  -7.537 -11.753  1.00  4.370          H  
ATOM    996  N   ASP A  64       8.462  -8.855 -11.598  1.00  2.790          N  
ATOM    997  CA  ASP A  64       9.824  -9.292 -11.338  1.00  3.150          C  
ATOM    998  C   ASP A  64       9.884  -9.977  -9.980  1.00  3.050          C  
ATOM    999  O   ASP A  64      10.854  -9.846  -9.240  1.00  3.430          O  
ATOM   1000  CB  ASP A  64      10.748  -8.076 -11.307  1.00  4.270          C  
ATOM   1001  CG  ASP A  64      10.802  -7.305 -12.630  1.00  4.270          C  
ATOM   1002  OD1 ASP A  64      11.204  -7.838 -13.632  1.00  4.270          O  
ATOM   1003  OD2 ASP A  64      10.372  -6.155 -12.622  1.00  4.270          O  
ATOM   1004  H   ASP A  64       8.032  -8.208 -10.952  1.00  3.350          H  
ATOM   1005  HA  ASP A  64      10.141  -9.997 -12.105  1.00  3.780          H  
ATOM   1006 1HB  ASP A  64      10.425  -7.405 -10.515  1.00  5.120          H  
ATOM   1007 2HB  ASP A  64      11.760  -8.402 -11.059  1.00  5.120          H  
ATOM   1008  N   TYR A  65       8.882 -10.792  -9.705  1.00  2.640          N  
ATOM   1009  CA  TYR A  65       8.791 -11.578  -8.490  1.00  2.630          C  
ATOM   1010  C   TYR A  65       9.448 -12.946  -8.731  1.00  2.510          C  
ATOM   1011  O   TYR A  65       9.277 -13.504  -9.815  1.00  2.620          O  
ATOM   1012  CB  TYR A  65       7.319 -11.709  -8.107  1.00  3.690          C  
ATOM   1013  CG  TYR A  65       7.013 -12.484  -6.889  1.00  3.690          C  
ATOM   1014  CD1 TYR A  65       7.238 -11.938  -5.646  1.00  3.690          C  
ATOM   1015  CD2 TYR A  65       6.467 -13.739  -7.008  1.00  3.690          C  
ATOM   1016  CE1 TYR A  65       6.934 -12.659  -4.530  1.00  3.690          C  
ATOM   1017  CE2 TYR A  65       6.151 -14.452  -5.891  1.00  3.690          C  
ATOM   1018  CZ  TYR A  65       6.379 -13.922  -4.653  1.00  3.690          C  
ATOM   1019  OH  TYR A  65       6.069 -14.652  -3.531  1.00  3.690          O  
ATOM   1020  H   TYR A  65       8.081 -10.837 -10.347  1.00  3.170          H  
ATOM   1021  HA  TYR A  65       9.294 -11.030  -7.706  1.00  3.160          H  
ATOM   1022 1HB  TYR A  65       6.913 -10.723  -7.977  1.00  4.420          H  
ATOM   1023 2HB  TYR A  65       6.781 -12.169  -8.932  1.00  4.420          H  
ATOM   1024  HD1 TYR A  65       7.668 -10.941  -5.552  1.00  4.420          H  
ATOM   1025  HD2 TYR A  65       6.287 -14.163  -7.996  1.00  4.420          H  
ATOM   1026  HE1 TYR A  65       7.128 -12.239  -3.561  1.00  4.420          H  
ATOM   1027  HE2 TYR A  65       5.718 -15.430  -5.991  1.00  4.420          H  
ATOM   1028  HH  TYR A  65       6.158 -14.096  -2.752  1.00  4.420          H  
ATOM   1029  N   PRO A  66      10.253 -13.491  -7.800  1.00  2.970          N  
ATOM   1030  CA  PRO A  66      10.854 -14.810  -7.909  1.00  3.360          C  
ATOM   1031  C   PRO A  66       9.775 -15.849  -8.171  1.00  2.870          C  
ATOM   1032  O   PRO A  66       8.693 -15.775  -7.601  1.00  2.600          O  
ATOM   1033  CB  PRO A  66      11.497 -14.994  -6.531  1.00  5.040          C  
ATOM   1034  CG  PRO A  66      11.818 -13.583  -6.079  1.00  5.040          C  
ATOM   1035  CD  PRO A  66      10.673 -12.738  -6.594  1.00  5.040          C  
ATOM   1036  HA  PRO A  66      11.601 -14.807  -8.714  1.00  4.030          H  
ATOM   1037 1HB  PRO A  66      10.792 -15.510  -5.860  1.00  6.050          H  
ATOM   1038 2HB  PRO A  66      12.387 -15.636  -6.614  1.00  6.050          H  
ATOM   1039 1HG  PRO A  66      11.909 -13.551  -4.980  1.00  6.050          H  
ATOM   1040 2HG  PRO A  66      12.789 -13.262  -6.486  1.00  6.050          H  
ATOM   1041 1HD  PRO A  66       9.874 -12.696  -5.857  1.00  6.050          H  
ATOM   1042 2HD  PRO A  66      11.083 -11.750  -6.852  1.00  6.050          H  
ATOM   1043  N   LEU A  67      10.068 -16.827  -9.014  1.00  3.320          N  
ATOM   1044  CA  LEU A  67       9.060 -17.826  -9.339  1.00  3.330          C  
ATOM   1045  C   LEU A  67       8.606 -18.650  -8.143  1.00  3.060          C  
ATOM   1046  O   LEU A  67       9.399 -19.311  -7.470  1.00  3.530          O  
ATOM   1047  CB  LEU A  67       9.589 -18.758 -10.436  1.00  4.660          C  
ATOM   1048  CG  LEU A  67       8.630 -19.870 -10.924  1.00  4.660          C  
ATOM   1049  CD1 LEU A  67       7.400 -19.274 -11.623  1.00  4.660          C  
ATOM   1050  CD2 LEU A  67       9.396 -20.786 -11.875  1.00  4.660          C  
ATOM   1051  H   LEU A  67      10.976 -16.866  -9.452  1.00  3.980          H  
ATOM   1052  HA  LEU A  67       8.195 -17.288  -9.722  1.00  4.000          H  
ATOM   1053 1HB  LEU A  67       9.856 -18.150 -11.299  1.00  5.590          H  
ATOM   1054 2HB  LEU A  67      10.492 -19.242 -10.066  1.00  5.590          H  
ATOM   1055  HG  LEU A  67       8.286 -20.439 -10.073  1.00  5.590          H  
ATOM   1056 1HD1 LEU A  67       6.748 -20.084 -11.951  1.00  5.590          H  
ATOM   1057 2HD1 LEU A  67       6.846 -18.637 -10.944  1.00  5.590          H  
ATOM   1058 3HD1 LEU A  67       7.717 -18.693 -12.486  1.00  5.590          H  
ATOM   1059 1HD2 LEU A  67       8.744 -21.590 -12.217  1.00  5.590          H  
ATOM   1060 2HD2 LEU A  67       9.744 -20.215 -12.735  1.00  5.590          H  
ATOM   1061 3HD2 LEU A  67      10.251 -21.215 -11.351  1.00  5.590          H  
ATOM   1062  N   LEU A  68       7.302 -18.606  -7.913  1.00  2.850          N  
ATOM   1063  CA  LEU A  68       6.617 -19.288  -6.831  1.00  3.040          C  
ATOM   1064  C   LEU A  68       5.714 -20.389  -7.363  1.00  2.800          C  
ATOM   1065  O   LEU A  68       5.006 -20.186  -8.352  1.00  2.990          O  
ATOM   1066  CB  LEU A  68       5.794 -18.250  -6.048  1.00  4.180          C  
ATOM   1067  CG  LEU A  68       4.882 -18.727  -4.886  1.00  4.180          C  
ATOM   1068  CD1 LEU A  68       5.717 -19.258  -3.734  1.00  4.180          C  
ATOM   1069  CD2 LEU A  68       4.027 -17.549  -4.428  1.00  4.180          C  
ATOM   1070  H   LEU A  68       6.751 -18.026  -8.529  1.00  3.420          H  
ATOM   1071  HA  LEU A  68       7.366 -19.734  -6.178  1.00  3.650          H  
ATOM   1072 1HB  LEU A  68       6.503 -17.540  -5.622  1.00  5.020          H  
ATOM   1073 2HB  LEU A  68       5.165 -17.715  -6.755  1.00  5.020          H  
ATOM   1074  HG  LEU A  68       4.228 -19.532  -5.234  1.00  5.020          H  
ATOM   1075 1HD1 LEU A  68       5.056 -19.582  -2.928  1.00  5.020          H  
ATOM   1076 2HD1 LEU A  68       6.314 -20.102  -4.061  1.00  5.020          H  
ATOM   1077 3HD1 LEU A  68       6.374 -18.470  -3.368  1.00  5.020          H  
ATOM   1078 1HD2 LEU A  68       3.372 -17.874  -3.622  1.00  5.020          H  
ATOM   1079 2HD2 LEU A  68       4.670 -16.747  -4.073  1.00  5.020          H  
ATOM   1080 3HD2 LEU A  68       3.434 -17.195  -5.257  1.00  5.020          H  
ATOM   1081  N   MET A  69       5.726 -21.546  -6.708  1.00  3.170          N  
ATOM   1082  CA  MET A  69       4.834 -22.632  -7.084  1.00  3.600          C  
ATOM   1083  C   MET A  69       3.527 -22.516  -6.328  1.00  4.020          C  
ATOM   1084  O   MET A  69       3.517 -22.193  -5.140  1.00  4.490          O  
ATOM   1085  CB  MET A  69       5.478 -23.982  -6.793  1.00  4.870          C  
ATOM   1086  CG  MET A  69       6.742 -24.279  -7.586  1.00  4.870          C  
ATOM   1087  SD  MET A  69       6.423 -24.477  -9.356  1.00  4.870          S  
ATOM   1088  CE  MET A  69       6.972 -22.917 -10.022  1.00  4.870          C  
ATOM   1089  H   MET A  69       6.360 -21.680  -5.933  1.00  3.800          H  
ATOM   1090  HA  MET A  69       4.602 -22.558  -8.144  1.00  4.320          H  
ATOM   1091 1HB  MET A  69       5.726 -24.040  -5.734  1.00  5.840          H  
ATOM   1092 2HB  MET A  69       4.757 -24.776  -6.998  1.00  5.840          H  
ATOM   1093 1HG  MET A  69       7.452 -23.463  -7.454  1.00  5.840          H  
ATOM   1094 2HG  MET A  69       7.200 -25.195  -7.213  1.00  5.840          H  
ATOM   1095 1HE  MET A  69       6.835 -22.915 -11.100  1.00  5.840          H  
ATOM   1096 2HE  MET A  69       6.406 -22.101  -9.594  1.00  5.840          H  
ATOM   1097 3HE  MET A  69       8.028 -22.784  -9.791  1.00  5.840          H  
ATOM   1098  N   ASN A  70       2.435 -22.821  -7.014  1.00  4.390          N  
ATOM   1099  CA  ASN A  70       1.115 -22.817  -6.408  1.00  5.260          C  
ATOM   1100  C   ASN A  70       0.779 -24.202  -5.880  1.00  5.770          C  
ATOM   1101  O   ASN A  70       0.592 -25.140  -6.658  1.00  6.100          O  
ATOM   1102  CB  ASN A  70       0.074 -22.363  -7.409  1.00  7.020          C  
ATOM   1103  CG  ASN A  70       0.274 -20.938  -7.855  1.00  7.020          C  
ATOM   1104  OD1 ASN A  70       0.454 -20.017  -7.043  1.00  7.020          O  
ATOM   1105  ND2 ASN A  70       0.242 -20.745  -9.151  1.00  7.020          N  
ATOM   1106  H   ASN A  70       2.531 -23.068  -7.990  1.00  5.270          H  
ATOM   1107  HA  ASN A  70       1.118 -22.133  -5.558  1.00  6.310          H  
ATOM   1108 1HB  ASN A  70       0.103 -23.012  -8.283  1.00  8.420          H  
ATOM   1109 2HB  ASN A  70      -0.915 -22.458  -6.964  1.00  8.420          H  
ATOM   1110 1HD2 ASN A  70       0.369 -19.830  -9.536  1.00  8.420          H  
ATOM   1111 2HD2 ASN A  70       0.091 -21.515  -9.768  1.00  8.420          H  
ATOM   1112  N   ALA A  71       0.741 -24.333  -4.564  1.00  6.180          N  
ATOM   1113  CA  ALA A  71       0.511 -25.610  -3.917  1.00  7.000          C  
ATOM   1114  C   ALA A  71       0.052 -25.387  -2.484  1.00  7.600          C  
ATOM   1115  O   ALA A  71       0.043 -26.317  -1.683  1.00  8.190          O  
ATOM   1116  OXT ALA A  71      -0.011 -24.230  -2.071  1.00 10.500          O  
ATOM   1117  CB  ALA A  71       1.778 -26.450  -3.949  1.00  8.960          C  
ATOM   1118  H   ALA A  71       0.901 -23.515  -3.989  1.00  7.420          H  
ATOM   1119  HA  ALA A  71      -0.283 -26.133  -4.452  1.00  8.400          H  
ATOM   1120 1HB  ALA A  71       1.587 -27.412  -3.472  1.00 10.750          H  
ATOM   1121 2HB  ALA A  71       2.081 -26.613  -4.984  1.00 10.750          H  
ATOM   1122 3HB  ALA A  71       2.569 -25.930  -3.416  1.00 10.750          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 -374.398 38.8246 275.717 -25.5259 6.83894 17.8194 140.546 -151.607 -0.54707 -3.2775 -110.727 -17.2183 -49.6477 -3.33629 -4.64813 -5.01813 0 0.13475 2.93167 29.9912 73.2674 -11.7289 4.15069 0.75494 -9.93915 39.3643 -137.279
CYS:NtermProteinFull_1 -6.77706 0.81426 3.38677 -0.04533 0 0.01131 1.67077 -1.85493 -0 -0 -1.34437 0.33774 0 0 0 0 0 0.0107 0.01541 0.40782 0 0 0 3.6196 0 0.17142 0.42412
VAL_2 -3.05729 0.29348 0.98766 -0.31529 0.23277 0.07277 0.90634 -0.94865 -0 -0 0.54258 -0.15569 0 0 0 0 0 -0.04974 1e-05 0.25423 0 -0.07627 0 1.9342 -0.10954 0.27917 0.79073
PHE_3 -8.74786 1.37984 0.42826 -1.07565 0.42946 0.59122 0.96305 -1.53253 -0.01566 -0.14629 0.60787 -0.87438 0 0 0 0 0 0.00417 0.00017 0 3.38732 -0.10301 0 1.0402 -0.37383 0.46687 -3.57079
GLY_4 -3.49402 0.29336 3.38275 -0.00061 0 0 2.00002 -1.85193 -0.00537 -0.02654 -1.46229 -0.23381 0 0 0 0 0 -0.10676 0 0 0 -1.53952 0 0.83697 0.06937 0.42301 -1.71538
CYS_5 -3.66865 0.60864 3.00938 -0.07341 0.00841 0.058 1.83047 -1.59734 -0 -0 -1.17909 -0.38428 0 0 0 0 0 0.05465 0.00331 0.37897 0 -0.01353 0 3.6196 0.05454 0.98303 3.69269
PRO_6 -5.64538 0.99875 2.20132 -0.0859 1e-05 0.05353 1.62628 -1.24233 -0.00177 -0.01565 -0.82864 0.70434 0 0 0 0 0 -0.13114 0.00912 0.5835 0 -0.37404 0 -2.4119 -0.51283 1.24359 -3.82913
SER_7 -2.17944 0.19125 2.10221 -0.03062 0.00026 0.05155 1.0866 -1.02801 -0 -0 0.16077 -1.00728 0 0 0 0 0 -0.06124 0.00398 0.14943 0 -0.36466 0.6142 -0.77834 -0.47694 0.38038 -1.18589
ALA_8 -4.09396 0.74492 3.64333 -0.02822 0.00766 0 2.72906 -2.15909 -0.0057 -0.04869 -3.25064 -0.44023 0 0 0 0 0 0.10586 0 0 0 0.55554 0 1.8394 -0.15817 0.24394 -0.315
ALA_9 -5.7497 0.84849 3.12271 -0.02337 0 0 2.57569 -2.45502 -0 -0 -1.87462 -0.36202 0 0 0 0 0 -0.08692 0 0 0 -0.39084 0 1.8394 -0.16357 0.41758 -2.3022
ASP_10 -2.97679 0.22985 3.25281 -0.11658 0.006 0.35641 0.88766 -1.50984 -0.00255 -0.01878 -0.34005 -0.65897 0 0 0 0 0 -0.09383 0.05212 0 1.75226 -0.01728 0 -2.3716 -0.31764 0.40717 -1.47963
LYS_11 -4.04516 0.61925 5.12797 -0.51288 0.23249 0.32897 2.60022 -2.32466 -0.02148 -0.12013 -2.37761 -0.02388 0 0 0 0 0 0.04643 0.14812 1.69402 0 -0.25055 0 -1.5107 -0.02074 0.35563 -0.0547
LEU_12 -8.61566 1.03714 5.29078 -0.48668 0.23547 0.11962 2.78965 -3.39258 -0.01827 -0.16209 -0.96046 0.17598 0 0 0 0 0 0.48677 0.08145 0.2967 0 -0.27448 0 0.18072 -0.14956 0.53132 -2.83418
TRP_13 -11.1698 0.9658 5.87518 -1.39216 0.08864 0.7043 3.3653 -3.63182 -0.04078 -0.16746 -2.93891 -0.20875 0 0 0 -0.88029 0 -0.04078 0.2082 0 2.29421 -0.11197 0 1.6906 -0.29826 0.71139 -4.97737
ASP_14 -4.31838 0.4535 5.93434 -0.10389 0.00834 0.31275 2.86103 -2.6472 -0.02148 -0.12013 -2.99337 -0.24157 0 0 0 0 0 0.04744 0.01504 0 1.75533 0.07887 0 -2.3716 -0.28386 0.52831 -1.10652
GLU_15 -4.92815 0.46663 5.58235 -0.22257 0.02496 0.31282 2.61747 -2.65442 -0.02753 -0.26219 -1.88428 -0.60647 0 0 0 0 0 -0.08594 0.08085 0 3.21904 -0.2623 0 -2.7348 -0.52364 0.35406 -1.5341
ASN_16 -8.51356 0.93906 7.19833 -0.19477 0.03282 0.30141 4.2446 -3.83468 -0 -0 -2.53687 -0.43038 0 0 0 0 0 0.24502 0.01627 0 1.88078 -0.10203 0 -0.93687 -0.63013 0.44186 -1.87912
LYS_17 -5.47356 0.62299 7.21671 -0.30781 0.03974 0.14479 3.11975 -2.95735 -0.06159 -0.21006 -4.24425 -0.1717 0 0 0 -0.72205 0 0.39483 0.04454 1.98659 0 -0.15613 0 -1.5107 -0.42358 0.85893 -1.80992
SER_18 -2.84098 0.2766 3.31938 -0.02346 0 0.02187 1.138 -1.57845 -0.00683 -0.09318 -0.09265 -0.27665 0 0 0 0 0 -0.04467 0 0.47678 0 0.30922 0.6024 -0.77834 -0.12984 0.81744 1.09664
HIS_D_19 -4.25099 0.20003 4.65577 -0.41468 0.01316 0.54133 2.14042 -2.28264 -0 -0 -0.52226 -0.21956 0 0 0 0 0 -0.00428 0.00398 0 2.0525 -0.2019 0 -0.45461 0.65822 1.09475 3.00923
PHE_20 -9.36632 0.68978 3.99294 -0.45081 0.10254 0.16446 2.91357 -2.78828 -0 -0 -2.17991 -0.15591 0 0 0 0 0 -0.04857 0.00944 0 3.4054 0.07665 0 1.0402 0.55752 1.46845 -0.56886
ILE_21 -7.36325 0.98735 4.47374 -0.6902 0.61589 0.1645 2.43863 -2.65444 -0 -0 -2.17118 0.18779 0 0 0 0 0 -0.03938 0.04663 0.57762 0 -0.28507 0 0.73287 -0.12133 1.11409 -1.98575
GLU_22 -4.54334 0.31703 5.50574 -0.36085 0.1349 0.4239 2.57063 -2.55741 -0.00683 -0.09318 -2.02065 -0.5897 0 0 0 -0.90673 0 -0.00979 0.00642 0 3.25079 -0.10101 0 -2.7348 -0.14804 0.83399 -1.02893
ASP_23 -4.19855 0.16235 5.10792 -0.10682 0.00891 0.32431 2.02519 -2.35797 -0 -0 -1.59212 -0.36072 0 0 0 0 0 -0.03551 0.03619 0 1.70475 0.20463 0 -2.3716 -0.25543 0.45528 -1.2492
PHE_24 -9.31306 0.94144 5.49351 -0.66726 0.2044 0.31191 2.74969 -3.24325 -0 -0 -2.81619 0.01539 0 0 0 0 0 0.02355 0.02791 0 2.56415 0.02193 0 1.0402 -0.14847 0.53673 -2.25741
CYS_25 -5.92938 0.53374 5.22296 -0.13333 0.0182 0.07687 2.62065 -2.53775 -0 -0 -3.33031 -0.97297 0 0 0 0 0 -0.02152 0.00828 0.95342 0 0.25778 0 3.6196 0.19894 0.76776 1.35294
TRP_26 -5.26327 0.30599 5.52105 -0.94632 0.14863 0.33866 2.86698 -2.65053 -0 -0 -3.07679 -0.3888 0 0 0 -0.90673 0 0.00421 0.00028 0 2.121 -0.09803 0 1.6906 0.16606 0.53699 0.36999
LYS_27 -4.9121 0.13318 5.57761 -0.30246 0.02757 0.13513 2.4261 -2.48659 -0 -0 -1.94409 -0.02091 0 0 -0.67981 0 0 -0.04662 0.01767 1.74069 0 -0.03367 0 -1.5107 -0.30071 0.27739 -1.90231
LEU_28 -8.20858 0.75527 6.08577 -0.64304 0.17781 0.20701 3.00797 -3.54336 -0 -0 -3.26225 0.13833 0 0 0 0 0 0.09797 0.04331 0.8564 0 -0.20885 0 0.18072 -0.26128 0.51921 -4.05758
HIS_D_29 -4.30522 0.39714 4.94413 -0.65594 0.00683 0.67464 2.40072 -2.40759 -0.00015 -0.00363 -2.44754 -0.31777 0 0 0 0 0 0.02858 0.01792 0 1.61731 -0.08647 0 -0.45461 0.00085 0.53698 -0.05383
ARG_30 -3.08413 0.14433 3.58559 -1.6764 0.53168 1.93997 1.26858 -1.60638 -0 -0 -0.92834 -2.26237 0 0 0 0 0 -0.14587 0.07925 3.34053 0 -0.09078 0 -1.2888 -0.11842 0.4536 0.14205
ARG_31 -4.15753 0.36133 4.93678 -0.65287 0.11296 0.48135 2.10584 -2.14637 -0.04578 -0.23851 -1.64072 -0.16728 0 0 -0.67981 0 0 -0.02805 0.11883 1.74196 0 -0.15014 0 -1.2888 -0.29726 0.62624 -1.00782
GLU_32 -1.90031 0.13596 2.56707 -0.24689 0.06254 0.43485 1.09403 -1.20121 -0.01056 -0.09609 -1.04972 -0.49444 0 0 0 0 0 -0.0675 0.00064 0 2.72881 0.13528 0 -2.7348 -0.10941 0.50216 -0.24957
GLY_33 -2.12363 0.18798 2.11776 -0.00032 0 0 0.7725 -1.14962 -0.03659 -0.14992 -0.77313 -0.16921 0 0 0 0 0 -0.1171 0 0 0 -0.79273 0 0.83697 0.06867 0.22449 -1.10387
ALA_34 -3.28084 0.6088 2.19936 -0.02518 0.00036 0 1.38438 -1.51901 -0.03481 -0.16378 -0.29123 -0.3151 0 0 0 0 0 -0.00599 0 0 0 0.19568 0 1.8394 0.12869 0.25103 0.97176
CYS_35 -3.02814 0.21206 1.16901 -0.10218 0.00283 0.05494 0.32496 -0.8343 -0.00122 -0.00387 -0.51249 -0.42097 0 0 0 0 0 -0.05825 0.00017 0.56185 0 0.16529 0 3.6196 -0.02619 0.30214 1.42527
VAL_36 -3.43729 0.56502 1.70741 -0.30727 0.19047 0.06038 0.77646 -1.3253 -0 -0 0.47869 0.00192 0 0 0 0 0 -0.04256 0.00181 0.28468 0 0.10269 0 1.9342 -0.10975 0.20797 1.08954
ASN_37 -4.99675 0.35611 4.33221 -0.18161 0.03607 0.28884 2.52684 -2.41916 -0.03481 -0.16378 -2.85954 -0.43829 0 0 0 0 0 -0.06575 0.00172 0 2.01309 -0.47231 0 -0.93687 -0.37475 0.36305 -3.02567
CYS_38 -7.94293 0.90778 4.39334 -0.04583 3e-05 0.01857 2.6084 -2.5593 -0 -0 -1.91901 -0.21779 0 0 0 0 0 0.05596 0.04293 0.37115 0 0.29975 0 3.6196 -0.44228 0.62166 -0.18797
GLU_39 -4.83276 0.52635 4.49686 -0.22419 0.02485 0.30891 1.69629 -2.32259 -0.02652 -0.09129 -1.10187 -0.59306 0 0 0 0 0 -0.06059 0.05603 0 3.06642 -0.36695 0 -2.7348 -0.35432 0.70302 -1.8302
MET_40 -4.848 0.20722 4.6651 -0.66586 0.16559 0.1706 2.22305 -2.33311 -0.02013 -0.11818 -1.60187 0.00474 0 0 0 0 0 0.05526 0.11435 0.95832 0 -0.03285 0 0.60916 -0.37279 0.52527 -0.29412
HIS_D_41 -7.53463 0.55659 6.08952 -0.42297 0.02089 0.46066 3.00741 -3.30962 -0.02013 -0.11818 -2.16049 -0.06015 0 0 0 0 0 0.1997 0.00453 0 2.80543 -0.03446 0 -0.45461 -0.0956 0.38719 -0.67893
ALA_42 -6.9381 0.39594 3.73688 -0.02168 0 0 2.76818 -2.90714 -0 -0 -2.18527 -0.37835 0 0 0 0 0 0.23881 0 0 0 -0.27398 0 1.8394 -0.30775 0.37523 -3.65784
LEU_43 -8.51069 1.03401 5.08183 -0.47092 0.17693 0.11585 3.27322 -3.28905 -0 -0 -2.33448 0.19764 0 0 0 0 0 0.04985 0.22054 0.39015 0 -0.26933 0 0.18072 -0.3961 0.52421 -4.02561
ASN_44 -4.26108 0.12571 5.27701 -0.17226 0.02251 0.25297 2.39234 -2.54977 -9e-05 -0.00229 -2.18491 -0.35122 0 0 0 0 0 -0.02826 0.00267 0 1.41043 0.35627 0 -0.93687 -0.11291 0.46907 -0.29071
GLU_45 -6.38594 0.61169 5.49851 -0.59988 0.10441 1.08843 2.71333 -2.75298 -0 -0 -2.54297 -0.655 0 0 0 0 0 -0.03885 0.0371 0 3.34817 -0.22604 0 -2.7348 -0.14874 0.45643 -2.22712
ILE_46 -9.76347 1.24715 3.19332 -0.66896 0.4307 0.20862 2.89127 -2.9026 -0 -0 -2.07146 0.37969 0 0 0 0 0 -0.06288 0.33511 1.09229 0 -0.16663 0 0.73287 -0.23013 0.81296 -4.54215
GLN_47 -7.14445 0.80786 5.88721 -0.27473 0.0398 0.20781 2.55841 -2.901 -0 -0 -3.31133 -0.45482 0 0 0 0 0 0.10679 0.35433 0 3.22113 -0.17639 0 -0.18838 -0.2031 0.80567 -0.66519
GLU_48 -5.04986 0.33818 5.82065 -0.59599 0.10273 1.07788 2.69231 -2.68916 -9e-05 -0.00229 -2.43999 -0.7014 0 0 0 0 0 0.00596 0.0059 0 3.43993 -0.23748 0 -2.7348 -0.36639 0.44596 -0.88796
VAL_49 -8.39474 1.25833 4.1796 -0.31837 0.32585 0.07273 3.04327 -2.96599 -0 -0 -1.81788 -0.18492 0 0 0 0 0 -0.04899 0.00265 0.08637 0 -0.30925 0 1.9342 -0.28433 0.33419 -3.08728
PHE_50 -11.9152 1.19663 4.11181 -0.4852 0.11686 0.19314 3.14383 -3.44621 -0 -0 -2.05614 -0.18647 0 0 0 0 0 -0.02785 0.01224 0 3.5324 -0.36392 0 1.0402 -0.06941 0.7091 -4.49415
THR_51 -4.41987 0.38699 5.77565 -0.19958 0.11432 0.07065 2.53504 -2.68092 -0.00968 -0.0705 -2.6431 -0.00606 0 0 0 0 0 -0.02829 0.02031 0.07181 0 -0.0014 2.28602 -1.0874 0.0299 0.67403 0.81792
LEU_52 -4.4725 0.34077 3.79496 -0.4856 0.18511 0.11778 1.68655 -1.93875 -0 -0 -1.12975 0.22936 0 0 0 0 0 -0.07365 0.03486 0.28054 0 -0.27796 0 0.18072 -0.14349 0.3221 -1.34893
HIS_D_53 -5.30649 0.49823 4.12896 -0.43573 0.03344 0.54707 1.73912 -2.18858 -0 -0 -1.65529 -0.39208 0 0 0 0 0 0.08085 0.0313 0 1.91067 -0.35892 0 -0.45461 -0.42277 0.43521 -1.80964
GLY_54 -1.79775 0.0727 2.38603 -5e-05 0 0 0.97256 -1.12169 -0 -0 -1.27616 -0.34481 0 0 0 0 0 -0.17729 0 0 0 -1.4827 0 0.83697 -0.70987 0.70953 -1.93254
MET_55 -6.11316 0.45742 3.89501 -0.44225 0.17889 0.05177 1.77357 -1.9909 -0.00968 -0.0705 -1.43062 -0.04707 0 0 0 0 0 0.00722 0.04566 1.41781 0 -0.02063 0 0.60916 -0.44116 0.59262 -1.53683
LYS_56 -4.89922 0.43629 4.89058 -0.29029 0.03687 0.13417 2.33764 -2.25164 -0 -0 -1.81434 -0.12013 0 0 -1.05616 0 0 0.01861 0.00801 1.96683 0 -0.05388 0 -1.5107 -0.02814 0.30483 -1.89068
CYS_57 -5.55113 0.77796 3.20016 -0.05898 0.00012 0.03365 1.47216 -1.71447 -0.00641 -0.06256 -2.21315 -0.32637 0 0 0 0 0 -0.0173 0.0307 0.51463 0 0.28559 0 3.6196 -0.21923 0.44255 0.20754
SER_58 -3.69617 0.25549 3.64696 -0.03062 0.00039 0.05118 1.76403 -1.77693 -0 -0 -1.28862 -1.01669 0 0 -0.58809 0 0 0.01308 0.00541 0.18241 0 -0.35809 0.60184 -0.77834 -0.45963 0.39239 -3.08
HIS_59 -5.76861 0.44414 4.63663 -0.40155 0.04976 0.39669 2.25789 -2.37296 -0 -0 -1.9069 -0.51179 0 0 -1.05616 0 0 0.00962 0.05048 0 3.39102 -0.11537 0 -0.45461 -0.50559 0.27923 -1.5781
PHE_60 -9.00584 1.27813 1.94813 -0.72066 0.09154 0.4284 1.77166 -2.14171 -0.00077 -0.00314 0.26297 0.33563 0 0 0 0 0 0.00961 0.09183 0 2.22664 -0.03955 0 1.0402 0.16046 0.47676 -1.7897
LYS_61 -4.42759 0.35673 4.23885 -0.37566 0.05735 0.27703 2.02355 -1.90675 -0 -0 -1.91579 -0.13544 0 0 -0.58809 0 0 0.10546 0.03084 1.69415 0 -0.21848 0 -1.5107 0.42584 0.52234 -1.34638
LEU_62 -7.37339 1.30484 2.36453 -0.48216 0.25265 0.07565 1.02434 -1.9406 -0.02693 -0.1955 -0.2957 0.52703 0 0 0 0 0 -0.01387 0.0136 0.19959 0 0.38518 0 0.18072 0.18878 1.02349 -2.78775
PRO_63 -2.96079 0.52571 2.05885 -0.06722 0 0.04223 0.63121 -0.79063 -0 -0 0.43878 0.57104 0 0 0 0 0 -0.15607 0.06916 0.19605 0 -0.82339 0 -2.4119 0.38336 1.20558 -1.08802
ASP_64 -3.85634 0.37081 4.65929 -0.12441 0.02148 0.3896 2.32885 -2.02423 -0 -0 -4.46699 -0.3331 0 0 0 -1.60234 0 0.02919 0.07987 0 3.72376 -0.35743 0 -2.3716 0.58683 0.64561 -2.30116
TYR_65 -7.76971 1.07723 3.6575 -0.70881 0.02978 0.07372 1.81303 -2.21179 -0.02053 -0.13295 -1.0875 -0.33593 0 0 0 0 0 -0.0031 0.00095 0 2.63945 -0.15027 0.04622 1.2797 0.64672 1.23205 0.07577
PRO_66 -2.77271 0.48848 1.70453 -0.12055 0.00216 0.08867 0.87676 -0.82117 -0 -0 -0.04778 0.24447 0 0 0 0 0 -0.06268 0.03437 0.10748 0 -1.04979 0 -2.4119 -0.01214 1.1578 -2.594
LEU_67 -1.96978 0.17404 0.83254 -0.59004 0.21026 0.1529 0.18389 -0.65168 -0 -0 0.01935 0.32109 0 0 0 0 0 -0.06792 0.03037 0.3536 0 -0.16767 0 0.18072 -0.39207 0.35252 -1.02788
LEU_68 -4.01596 0.28169 1.97217 -0.5438 0.11649 0.12202 0.5172 -1.30906 -0 -0 0.30531 0.2519 0 0 0 0 0 0.02752 0.03051 0.89936 0 -0.23136 0 0.18072 -0.13216 0.34658 -1.18087
MET_69 -2.78183 0.21861 1.14956 -0.65261 0.17067 0.22889 0.19003 -0.92869 -0.00318 -0.05308 -0.03142 -0.1642 0 0 0 0 0 -0.03419 0.02547 2.92347 0 -0.00336 0 0.60916 -0.23005 0.20386 0.83712
ASN_70 -1.38604 0.06114 1.4805 -0.18959 0.00899 0.29675 0.16518 -0.67019 -0 -0 -0.52226 -0.54201 0 0 0 0 0 -0.0894 0.0105 0 2.80524 -0.43419 0 -0.93687 -0.25325 0.08316 -0.11235
ALA:CtermProteinFull_71 -0.5736 0.02514 0.60495 -0.03527 0.00475 0 0.04459 -0.33333 -0.00318 -0.05308 -0.36406 -0.41351 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.08732 0.10471 0.76019
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 114277 DOMAINID 110982 MODEL 4 2021-08-21_00000149_1_11
MODEL     4
REMARK    Rerank model04.pdb score: 44.246
REMARK    CLUSTER 0004 t000_.out.valid.rescored.best_scoring.binary cluster_size: 7 cluster_threshold: 2.900464
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE          fa_sol:         237.525
REMARK    SCORE     rama_prepro:           6.751
REMARK    SCORE     hbond_sr_bb:         -44.761
REMARK    SCORE          fa_rep:          46.975
REMARK    SCORE     hbond_bb_sc:          -6.064
REMARK    SCORE          fa_atr:        -400.887
REMARK    SCORE         fa_elec:        -117.119
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE        hbond_sc:          -6.524
REMARK    SCORE     total_score:        -294.637
REMARK    SCORE     description: cluster0004_0001
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE atom_pair_constraint:        -196.120
REMARK    SCORE     hbond_lr_bb:          -3.650
REMARK    SCORE fa_intra_sol_xover4:          15.001
REMARK    SCORE     lk_ball_wtd:         -14.270
REMARK    SCORE           omega:           0.584
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE    fa_intra_rep:           0.693
REMARK    SCORE          fa_dun:          98.664
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE            time:           0.000
REMARK    SCORE     cart_bonded:          68.653
REMARK    SCORE             ref:          27.225
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE         p_aa_pp:          -7.313
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE           score:        -294.637
ATOM      1  N   CYS A   1       0.720   1.077   1.057  1.00  3.290          N  
ATOM      2  CA  CYS A   1       2.004   1.375   0.447  1.00  2.810          C  
ATOM      3  C   CYS A   1       2.218   2.882   0.260  1.00  1.920          C  
ATOM      4  O   CYS A   1       2.504   3.608   1.215  1.00  2.260          O  
ATOM      5  CB  CYS A   1       2.138   0.703  -0.930  1.00  4.130          C  
ATOM      6  SG  CYS A   1       2.231  -1.083  -0.954  1.00  4.130          S  
ATOM      7 1H   CYS A   1       0.455   0.126   0.852  1.00  3.950          H  
ATOM      8 2H   CYS A   1       0.794   1.202   2.058  1.00  3.950          H  
ATOM      9 3H   CYS A   1       0.028   1.707   0.673  1.00  3.950          H  
ATOM     10  HA  CYS A   1       2.787   0.985   1.100  1.00  3.370          H  
ATOM     11 1HB  CYS A   1       1.278   0.964  -1.546  1.00  4.950          H  
ATOM     12 2HB  CYS A   1       3.040   1.076  -1.414  1.00  4.950          H  
ATOM     13  HG  CYS A   1       3.398  -1.211  -0.248  1.00  4.950          H  
ATOM     14  N   VAL A   2       1.982   3.334  -0.974  1.00  1.390          N  
ATOM     15  CA  VAL A   2       2.181   4.693  -1.467  1.00  1.670          C  
ATOM     16  C   VAL A   2       1.531   5.828  -0.679  1.00  1.870          C  
ATOM     17  O   VAL A   2       2.061   6.931  -0.662  1.00  2.380          O  
ATOM     18  CB  VAL A   2       1.711   4.708  -2.928  1.00  2.230          C  
ATOM     19  CG1 VAL A   2       0.191   4.485  -3.008  1.00  2.230          C  
ATOM     20  CG2 VAL A   2       2.104   6.007  -3.582  1.00  2.230          C  
ATOM     21  H   VAL A   2       1.706   2.666  -1.671  1.00  1.670          H  
ATOM     22  HA  VAL A   2       3.252   4.882  -1.480  1.00  2.000          H  
ATOM     23  HB  VAL A   2       2.197   3.898  -3.445  1.00  2.670          H  
ATOM     24 1HG1 VAL A   2      -0.117   4.479  -4.029  1.00  2.670          H  
ATOM     25 2HG1 VAL A   2      -0.081   3.539  -2.555  1.00  2.670          H  
ATOM     26 3HG1 VAL A   2      -0.333   5.280  -2.506  1.00  2.670          H  
ATOM     27 1HG2 VAL A   2       1.800   5.991  -4.627  1.00  2.670          H  
ATOM     28 2HG2 VAL A   2       1.624   6.848  -3.089  1.00  2.670          H  
ATOM     29 3HG2 VAL A   2       3.176   6.124  -3.512  1.00  2.670          H  
ATOM     30  N   PHE A   3       0.412   5.589  -0.006  1.00  2.010          N  
ATOM     31  CA  PHE A   3      -0.215   6.655   0.764  1.00  2.600          C  
ATOM     32  C   PHE A   3       0.562   6.974   2.047  1.00  2.360          C  
ATOM     33  O   PHE A   3       0.228   7.924   2.759  1.00  3.170          O  
ATOM     34  CB  PHE A   3      -1.662   6.307   1.099  1.00  3.400          C  
ATOM     35  CG  PHE A   3      -1.842   5.026   1.828  1.00  3.400          C  
ATOM     36  CD1 PHE A   3      -1.656   4.943   3.203  1.00  3.400          C  
ATOM     37  CD2 PHE A   3      -2.230   3.888   1.136  1.00  3.400          C  
ATOM     38  CE1 PHE A   3      -1.843   3.752   3.867  1.00  3.400          C  
ATOM     39  CE2 PHE A   3      -2.423   2.698   1.802  1.00  3.400          C  
ATOM     40  CZ  PHE A   3      -2.227   2.629   3.171  1.00  3.400          C  
ATOM     41  H   PHE A   3      -0.040   4.689  -0.043  1.00  2.410          H  
ATOM     42  HA  PHE A   3      -0.227   7.553   0.145  1.00  3.120          H  
ATOM     43 1HB  PHE A   3      -2.095   7.105   1.701  1.00  4.080          H  
ATOM     44 2HB  PHE A   3      -2.232   6.250   0.189  1.00  4.080          H  
ATOM     45  HD1 PHE A   3      -1.359   5.835   3.762  1.00  4.080          H  
ATOM     46  HD2 PHE A   3      -2.397   3.947   0.056  1.00  4.080          H  
ATOM     47  HE1 PHE A   3      -1.693   3.702   4.947  1.00  4.080          H  
ATOM     48  HE2 PHE A   3      -2.740   1.809   1.255  1.00  4.080          H  
ATOM     49  HZ  PHE A   3      -2.383   1.688   3.699  1.00  4.080          H  
ATOM     50  N   GLY A   4       1.585   6.171   2.340  1.00  1.580          N  
ATOM     51  CA  GLY A   4       2.438   6.323   3.499  1.00  1.750          C  
ATOM     52  C   GLY A   4       3.591   7.286   3.212  1.00  1.740          C  
ATOM     53  O   GLY A   4       3.606   8.417   3.696  1.00  2.090          O  
ATOM     54  H   GLY A   4       1.794   5.388   1.719  1.00  1.900          H  
ATOM     55 1HA  GLY A   4       1.850   6.685   4.341  1.00  2.100          H  
ATOM     56 2HA  GLY A   4       2.834   5.346   3.776  1.00  2.100          H  
ATOM     57  N   CYS A   5       4.590   6.819   2.472  1.00  1.680          N  
ATOM     58  CA  CYS A   5       5.771   7.625   2.182  1.00  1.680          C  
ATOM     59  C   CYS A   5       6.496   7.260   0.892  1.00  1.540          C  
ATOM     60  O   CYS A   5       7.557   6.652   0.980  1.00  1.570          O  
ATOM     61  CB  CYS A   5       6.782   7.463   3.317  1.00  2.350          C  
ATOM     62  SG  CYS A   5       8.279   8.412   3.074  1.00  2.350          S  
ATOM     63  H   CYS A   5       4.506   5.879   2.101  1.00  2.020          H  
ATOM     64  HA  CYS A   5       5.466   8.670   2.151  1.00  2.020          H  
ATOM     65 1HB  CYS A   5       6.327   7.782   4.258  1.00  2.820          H  
ATOM     66 2HB  CYS A   5       7.059   6.415   3.419  1.00  2.820          H  
ATOM     67  HG  CYS A   5       8.570   7.798   1.913  1.00  2.820          H  
ATOM     68  N   PRO A   6       6.039   7.701  -0.297  1.00  1.660          N  
ATOM     69  CA  PRO A   6       6.500   7.282  -1.631  1.00  1.780          C  
ATOM     70  C   PRO A   6       8.026   7.236  -1.823  1.00  1.870          C  
ATOM     71  O   PRO A   6       8.530   6.366  -2.532  1.00  2.210          O  
ATOM     72  CB  PRO A   6       5.873   8.357  -2.524  1.00  2.670          C  
ATOM     73  CG  PRO A   6       4.610   8.755  -1.800  1.00  2.670          C  
ATOM     74  CD  PRO A   6       4.971   8.721  -0.326  1.00  2.670          C  
ATOM     75  HA  PRO A   6       6.058   6.303  -1.868  1.00  2.140          H  
ATOM     76 1HB  PRO A   6       6.575   9.192  -2.671  1.00  3.200          H  
ATOM     77 2HB  PRO A   6       5.663   7.943  -3.517  1.00  3.200          H  
ATOM     78 1HG  PRO A   6       4.275   9.751  -2.134  1.00  3.200          H  
ATOM     79 2HG  PRO A   6       3.799   8.059  -2.045  1.00  3.200          H  
ATOM     80 1HD  PRO A   6       5.344   9.700   0.009  1.00  3.200          H  
ATOM     81 2HD  PRO A   6       4.083   8.390   0.248  1.00  3.200          H  
ATOM     82  N   SER A   7       8.784   8.123  -1.171  1.00  1.760          N  
ATOM     83  CA  SER A   7      10.248   8.117  -1.289  1.00  1.890          C  
ATOM     84  C   SER A   7      10.899   6.836  -0.728  1.00  1.800          C  
ATOM     85  O   SER A   7      12.089   6.580  -0.935  1.00  1.980          O  
ATOM     86  CB  SER A   7      10.824   9.326  -0.587  1.00  2.590          C  
ATOM     87  OG  SER A   7      10.592   9.262   0.789  1.00  2.590          O  
ATOM     88  H   SER A   7       8.376   8.857  -0.608  1.00  2.110          H  
ATOM     89  HA  SER A   7      10.500   8.183  -2.349  1.00  2.270          H  
ATOM     90 1HB  SER A   7      11.897   9.375  -0.775  1.00  3.110          H  
ATOM     91 2HB  SER A   7      10.377  10.230  -0.991  1.00  3.110          H  
ATOM     92  HG  SER A   7      11.067  10.004   1.176  1.00  3.110          H  
ATOM     93  N   ALA A   8      10.100   6.024  -0.037  1.00  1.750          N  
ATOM     94  CA  ALA A   8      10.485   4.761   0.564  1.00  2.030          C  
ATOM     95  C   ALA A   8       9.849   3.595  -0.177  1.00  1.820          C  
ATOM     96  O   ALA A   8       9.765   2.491   0.374  1.00  1.690          O  
ATOM     97  CB  ALA A   8      10.057   4.725   2.024  1.00  2.730          C  
ATOM     98  H   ALA A   8       9.137   6.325   0.089  1.00  2.100          H  
ATOM     99  HA  ALA A   8      11.569   4.666   0.496  1.00  2.440          H  
ATOM    100 1HB  ALA A   8      10.362   3.783   2.473  1.00  3.280          H  
ATOM    101 2HB  ALA A   8      10.522   5.552   2.557  1.00  3.280          H  
ATOM    102 3HB  ALA A   8       8.972   4.820   2.080  1.00  3.280          H  
ATOM    103  N   ALA A   9       9.495   3.818  -1.443  1.00  1.960          N  
ATOM    104  CA  ALA A   9       8.817   2.870  -2.321  1.00  1.950          C  
ATOM    105  C   ALA A   9       9.345   1.442  -2.290  1.00  1.780          C  
ATOM    106  O   ALA A   9       8.551   0.490  -2.254  1.00  1.680          O  
ATOM    107  CB  ALA A   9       8.946   3.396  -3.732  1.00  2.730          C  
ATOM    108  H   ALA A   9       9.592   4.770  -1.812  1.00  2.350          H  
ATOM    109  HA  ALA A   9       7.783   2.836  -2.042  1.00  2.340          H  
ATOM    110 1HB  ALA A   9       8.453   2.775  -4.413  1.00  3.280          H  
ATOM    111 2HB  ALA A   9       8.525   4.380  -3.805  1.00  3.280          H  
ATOM    112 3HB  ALA A   9       9.996   3.437  -3.999  1.00  3.280          H  
ATOM    113  N   ASP A  10      10.659   1.238  -2.229  1.00  1.860          N  
ATOM    114  CA  ASP A  10      11.120  -0.150  -2.237  1.00  1.810          C  
ATOM    115  C   ASP A  10      10.556  -0.907  -1.026  1.00  1.520          C  
ATOM    116  O   ASP A  10      10.192  -2.092  -1.112  1.00  1.560          O  
ATOM    117  CB  ASP A  10      12.647  -0.247  -2.124  1.00  2.550          C  
ATOM    118  CG  ASP A  10      13.445   0.234  -3.328  1.00  2.550          C  
ATOM    119  OD1 ASP A  10      12.901   0.527  -4.357  1.00  2.550          O  
ATOM    120  OD2 ASP A  10      14.649   0.254  -3.225  1.00  2.550          O  
ATOM    121  H   ASP A  10      11.306   2.016  -2.235  1.00  2.230          H  
ATOM    122  HA  ASP A  10      10.778  -0.635  -3.154  1.00  2.170          H  
ATOM    123 1HB  ASP A  10      12.971   0.320  -1.251  1.00  3.060          H  
ATOM    124 2HB  ASP A  10      12.912  -1.289  -1.938  1.00  3.060          H  
ATOM    125  N   LYS A  11      10.489  -0.207   0.113  1.00  1.390          N  
ATOM    126  CA  LYS A  11      10.053  -0.796   1.357  1.00  1.310          C  
ATOM    127  C   LYS A  11       8.554  -0.795   1.450  1.00  1.020          C  
ATOM    128  O   LYS A  11       7.978  -1.718   2.014  1.00  0.970          O  
ATOM    129  CB  LYS A  11      10.653  -0.059   2.552  1.00  1.870          C  
ATOM    130  CG  LYS A  11      12.159  -0.247   2.712  1.00  1.870          C  
ATOM    131  CD  LYS A  11      12.691   0.508   3.930  1.00  1.870          C  
ATOM    132  CE  LYS A  11      14.197   0.314   4.098  1.00  1.870          C  
ATOM    133  NZ  LYS A  11      14.731   1.074   5.267  1.00  1.870          N  
ATOM    134  H   LYS A  11      10.721   0.786   0.110  1.00  1.670          H  
ATOM    135  HA  LYS A  11      10.390  -1.833   1.384  1.00  1.570          H  
ATOM    136 1HB  LYS A  11      10.452   1.009   2.451  1.00  2.240          H  
ATOM    137 2HB  LYS A  11      10.168  -0.398   3.467  1.00  2.240          H  
ATOM    138 1HG  LYS A  11      12.377  -1.309   2.824  1.00  2.240          H  
ATOM    139 2HG  LYS A  11      12.661   0.113   1.814  1.00  2.240          H  
ATOM    140 1HD  LYS A  11      12.482   1.573   3.816  1.00  2.240          H  
ATOM    141 2HD  LYS A  11      12.187   0.151   4.827  1.00  2.240          H  
ATOM    142 1HE  LYS A  11      14.405  -0.745   4.241  1.00  2.240          H  
ATOM    143 2HE  LYS A  11      14.703   0.654   3.195  1.00  2.240          H  
ATOM    144 1HZ  LYS A  11      15.727   0.919   5.343  1.00  2.240          H  
ATOM    145 2HZ  LYS A  11      14.554   2.061   5.139  1.00  2.240          H  
ATOM    146 3HZ  LYS A  11      14.277   0.758   6.112  1.00  2.240          H  
ATOM    147  N   LEU A  12       7.911   0.220   0.879  1.00  0.950          N  
ATOM    148  CA  LEU A  12       6.460   0.305   0.982  1.00  0.860          C  
ATOM    149  C   LEU A  12       5.837  -0.906   0.317  1.00  0.790          C  
ATOM    150  O   LEU A  12       4.821  -1.443   0.790  1.00  0.930          O  
ATOM    151  CB  LEU A  12       5.937   1.546   0.277  1.00  1.240          C  
ATOM    152  CG  LEU A  12       6.310   2.896   0.863  1.00  1.240          C  
ATOM    153  CD1 LEU A  12       5.793   3.938  -0.052  1.00  1.240          C  
ATOM    154  CD2 LEU A  12       5.771   3.086   2.261  1.00  1.240          C  
ATOM    155  H   LEU A  12       8.468   0.963   0.450  1.00  1.140          H  
ATOM    156  HA  LEU A  12       6.174   0.299   2.030  1.00  1.030          H  
ATOM    157 1HB  LEU A  12       6.303   1.520  -0.737  1.00  1.490          H  
ATOM    158 2HB  LEU A  12       4.878   1.489   0.244  1.00  1.490          H  
ATOM    159  HG  LEU A  12       7.375   2.983   0.899  1.00  1.490          H  
ATOM    160 1HD1 LEU A  12       6.064   4.841   0.325  1.00  1.490          H  
ATOM    161 2HD1 LEU A  12       6.196   3.841  -1.027  1.00  1.490          H  
ATOM    162 3HD1 LEU A  12       4.740   3.879  -0.100  1.00  1.490          H  
ATOM    163 1HD2 LEU A  12       6.068   4.071   2.623  1.00  1.490          H  
ATOM    164 2HD2 LEU A  12       4.690   3.014   2.258  1.00  1.490          H  
ATOM    165 3HD2 LEU A  12       6.176   2.333   2.932  1.00  1.490          H  
ATOM    166  N   TRP A  13       6.407  -1.327  -0.818  1.00  0.890          N  
ATOM    167  CA  TRP A  13       5.852  -2.503  -1.449  1.00  1.000          C  
ATOM    168  C   TRP A  13       6.084  -3.709  -0.563  1.00  0.970          C  
ATOM    169  O   TRP A  13       5.126  -4.381  -0.195  1.00  1.280          O  
ATOM    170  CB  TRP A  13       6.404  -2.774  -2.837  1.00  1.360          C  
ATOM    171  CG  TRP A  13       5.792  -4.027  -3.454  1.00  1.360          C  
ATOM    172  CD1 TRP A  13       4.488  -4.425  -3.354  1.00  1.360          C  
ATOM    173  CD2 TRP A  13       6.445  -5.035  -4.262  1.00  1.360          C  
ATOM    174  NE1 TRP A  13       4.297  -5.593  -4.034  1.00  1.360          N  
ATOM    175  CE2 TRP A  13       5.472  -5.985  -4.590  1.00  1.360          C  
ATOM    176  CE3 TRP A  13       7.753  -5.209  -4.732  1.00  1.360          C  
ATOM    177  CZ2 TRP A  13       5.763  -7.097  -5.359  1.00  1.360          C  
ATOM    178  CZ3 TRP A  13       8.038  -6.321  -5.510  1.00  1.360          C  
ATOM    179  CH2 TRP A  13       7.071  -7.242  -5.812  1.00  1.360          C  
ATOM    180  H   TRP A  13       7.206  -0.820  -1.221  1.00  1.070          H  
ATOM    181  HA  TRP A  13       4.784  -2.358  -1.550  1.00  1.200          H  
ATOM    182 1HB  TRP A  13       6.159  -1.945  -3.468  1.00  1.630          H  
ATOM    183 2HB  TRP A  13       7.492  -2.870  -2.804  1.00  1.630          H  
ATOM    184  HD1 TRP A  13       3.710  -3.896  -2.816  1.00  1.630          H  
ATOM    185  HE1 TRP A  13       3.423  -6.092  -4.114  1.00  1.630          H  
ATOM    186  HE3 TRP A  13       8.534  -4.479  -4.500  1.00  1.630          H  
ATOM    187  HZ2 TRP A  13       5.005  -7.839  -5.610  1.00  1.630          H  
ATOM    188  HZ3 TRP A  13       9.062  -6.438  -5.874  1.00  1.630          H  
ATOM    189  HH2 TRP A  13       7.332  -8.104  -6.422  1.00  1.630          H  
ATOM    190  N   ASP A  14       7.333  -3.982  -0.153  1.00  0.970          N  
ATOM    191  CA  ASP A  14       7.527  -5.176   0.672  1.00  1.280          C  
ATOM    192  C   ASP A  14       6.717  -5.168   1.972  1.00  1.470          C  
ATOM    193  O   ASP A  14       6.255  -6.220   2.421  1.00  1.870          O  
ATOM    194  CB  ASP A  14       9.003  -5.397   1.013  1.00  1.670          C  
ATOM    195  CG  ASP A  14       9.862  -5.967  -0.149  1.00  1.670          C  
ATOM    196  OD1 ASP A  14       9.317  -6.453  -1.141  1.00  1.670          O  
ATOM    197  OD2 ASP A  14      11.056  -5.945  -0.013  1.00  1.670          O  
ATOM    198  H   ASP A  14       8.137  -3.416  -0.459  1.00  1.160          H  
ATOM    199  HA  ASP A  14       7.200  -6.030   0.086  1.00  1.540          H  
ATOM    200 1HB  ASP A  14       9.436  -4.439   1.318  1.00  2.000          H  
ATOM    201 2HB  ASP A  14       9.078  -6.069   1.866  1.00  2.000          H  
ATOM    202  N   GLU A  15       6.537  -3.996   2.576  1.00  1.320          N  
ATOM    203  CA  GLU A  15       5.798  -3.852   3.820  1.00  1.580          C  
ATOM    204  C   GLU A  15       4.365  -4.355   3.717  1.00  1.650          C  
ATOM    205  O   GLU A  15       3.882  -5.032   4.624  1.00  1.960          O  
ATOM    206  CB  GLU A  15       5.762  -2.381   4.248  1.00  2.110          C  
ATOM    207  CG  GLU A  15       5.040  -2.099   5.574  1.00  2.110          C  
ATOM    208  CD  GLU A  15       4.980  -0.619   5.900  1.00  2.110          C  
ATOM    209  OE1 GLU A  15       5.634  -0.215   6.828  1.00  2.110          O  
ATOM    210  OE2 GLU A  15       4.251   0.103   5.231  1.00  2.110          O  
ATOM    211  H   GLU A  15       6.957  -3.163   2.174  1.00  1.580          H  
ATOM    212  HA  GLU A  15       6.308  -4.431   4.588  1.00  1.900          H  
ATOM    213 1HB  GLU A  15       6.782  -2.015   4.348  1.00  2.530          H  
ATOM    214 2HB  GLU A  15       5.290  -1.791   3.468  1.00  2.530          H  
ATOM    215 1HG  GLU A  15       4.022  -2.482   5.525  1.00  2.530          H  
ATOM    216 2HG  GLU A  15       5.558  -2.625   6.374  1.00  2.530          H  
ATOM    217  N   ASN A  16       3.676  -4.021   2.616  1.00  1.470          N  
ATOM    218  CA  ASN A  16       2.283  -4.418   2.480  1.00  1.720          C  
ATOM    219  C   ASN A  16       2.040  -5.488   1.403  1.00  1.480          C  
ATOM    220  O   ASN A  16       0.924  -5.996   1.265  1.00  1.380          O  
ATOM    221  CB  ASN A  16       1.485  -3.175   2.194  1.00  2.310          C  
ATOM    222  CG  ASN A  16       1.602  -2.197   3.335  1.00  2.310          C  
ATOM    223  OD1 ASN A  16       0.905  -2.281   4.354  1.00  2.310          O  
ATOM    224  ND2 ASN A  16       2.537  -1.276   3.182  1.00  2.310          N  
ATOM    225  H   ASN A  16       4.120  -3.424   1.904  1.00  1.760          H  
ATOM    226  HA  ASN A  16       1.954  -4.839   3.431  1.00  2.060          H  
ATOM    227 1HB  ASN A  16       1.858  -2.724   1.300  1.00  2.770          H  
ATOM    228 2HB  ASN A  16       0.440  -3.433   2.037  1.00  2.770          H  
ATOM    229 1HD2 ASN A  16       2.759  -0.605   3.924  1.00  2.770          H  
ATOM    230 2HD2 ASN A  16       3.109  -1.275   2.353  1.00  2.770          H  
ATOM    231  N   LYS A  17       3.089  -5.901   0.694  1.00  1.440          N  
ATOM    232  CA  LYS A  17       3.012  -6.906  -0.361  1.00  1.310          C  
ATOM    233  C   LYS A  17       2.192  -8.120   0.043  1.00  1.140          C  
ATOM    234  O   LYS A  17       1.306  -8.546  -0.707  1.00  1.110          O  
ATOM    235  CB  LYS A  17       4.446  -7.325  -0.724  1.00  1.890          C  
ATOM    236  CG  LYS A  17       4.650  -8.409  -1.755  1.00  1.890          C  
ATOM    237  CD  LYS A  17       6.166  -8.507  -2.139  1.00  1.890          C  
ATOM    238  CE  LYS A  17       7.033  -9.169  -1.051  1.00  1.890          C  
ATOM    239  NZ  LYS A  17       8.484  -9.199  -1.437  1.00  1.890          N  
ATOM    240  H   LYS A  17       3.995  -5.447   0.818  1.00  1.730          H  
ATOM    241  HA  LYS A  17       2.543  -6.449  -1.232  1.00  1.570          H  
ATOM    242 1HB  LYS A  17       4.959  -6.486  -1.141  1.00  2.260          H  
ATOM    243 2HB  LYS A  17       4.965  -7.595   0.189  1.00  2.260          H  
ATOM    244 1HG  LYS A  17       4.348  -9.349  -1.332  1.00  2.260          H  
ATOM    245 2HG  LYS A  17       4.052  -8.206  -2.640  1.00  2.260          H  
ATOM    246 1HD  LYS A  17       6.269  -9.071  -3.064  1.00  2.260          H  
ATOM    247 2HD  LYS A  17       6.562  -7.501  -2.305  1.00  2.260          H  
ATOM    248 1HE  LYS A  17       6.946  -8.619  -0.119  1.00  2.260          H  
ATOM    249 2HE  LYS A  17       6.687 -10.190  -0.896  1.00  2.260          H  
ATOM    250 1HZ  LYS A  17       9.023  -9.633  -0.707  1.00  2.260          H  
ATOM    251 2HZ  LYS A  17       8.610  -9.706  -2.295  1.00  2.260          H  
ATOM    252 3HZ  LYS A  17       8.818  -8.216  -1.561  1.00  2.260          H  
ATOM    253  N   SER A  18       2.468  -8.661   1.232  1.00  1.170          N  
ATOM    254  CA  SER A  18       1.815  -9.861   1.725  1.00  1.160          C  
ATOM    255  C   SER A  18       0.356  -9.659   2.117  1.00  1.080          C  
ATOM    256  O   SER A  18      -0.378 -10.638   2.261  1.00  1.060          O  
ATOM    257  CB  SER A  18       2.574 -10.413   2.917  1.00  1.630          C  
ATOM    258  OG  SER A  18       2.464  -9.563   4.026  1.00  1.630          O  
ATOM    259  H   SER A  18       3.181  -8.228   1.805  1.00  1.400          H  
ATOM    260  HA  SER A  18       1.855 -10.605   0.934  1.00  1.390          H  
ATOM    261 1HB  SER A  18       2.182 -11.399   3.171  1.00  1.950          H  
ATOM    262 2HB  SER A  18       3.623 -10.535   2.652  1.00  1.950          H  
ATOM    263  HG  SER A  18       2.946  -9.990   4.741  1.00  1.950          H  
ATOM    264  N   HIS A  19      -0.083  -8.407   2.288  1.00  1.090          N  
ATOM    265  CA  HIS A  19      -1.464  -8.139   2.668  1.00  1.070          C  
ATOM    266  C   HIS A  19      -2.318  -8.339   1.432  1.00  0.950          C  
ATOM    267  O   HIS A  19      -3.407  -8.932   1.474  1.00  0.920          O  
ATOM    268  CB  HIS A  19      -1.622  -6.695   3.155  1.00  1.510          C  
ATOM    269  CG  HIS A  19      -0.837  -6.390   4.380  1.00  1.510          C  
ATOM    270  ND1 HIS A  19      -0.641  -5.102   4.832  1.00  1.510          N  
ATOM    271  CD2 HIS A  19      -0.169  -7.196   5.237  1.00  1.510          C  
ATOM    272  CE1 HIS A  19       0.109  -5.131   5.918  1.00  1.510          C  
ATOM    273  NE2 HIS A  19       0.405  -6.390   6.187  1.00  1.510          N  
ATOM    274  H   HIS A  19       0.545  -7.623   2.122  1.00  1.310          H  
ATOM    275  HA  HIS A  19      -1.795  -8.829   3.444  1.00  1.280          H  
ATOM    276 1HB  HIS A  19      -1.317  -6.006   2.371  1.00  1.810          H  
ATOM    277 2HB  HIS A  19      -2.671  -6.499   3.365  1.00  1.810          H  
ATOM    278  HD1 HIS A  19      -1.084  -4.273   4.484  1.00  1.810          H  
ATOM    279  HD2 HIS A  19      -0.027  -8.278   5.281  1.00  1.810          H  
ATOM    280  HE1 HIS A  19       0.381  -4.204   6.425  1.00  1.810          H  
ATOM    281  N   PHE A  20      -1.781  -7.849   0.319  1.00  0.970          N  
ATOM    282  CA  PHE A  20      -2.448  -7.931  -0.965  1.00  0.970          C  
ATOM    283  C   PHE A  20      -2.432  -9.373  -1.457  1.00  0.860          C  
ATOM    284  O   PHE A  20      -3.455  -9.890  -1.916  1.00  0.890          O  
ATOM    285  CB  PHE A  20      -1.766  -6.987  -1.948  1.00  1.360          C  
ATOM    286  CG  PHE A  20      -2.103  -5.519  -1.718  1.00  1.360          C  
ATOM    287  CD1 PHE A  20      -1.464  -4.778  -0.730  1.00  1.360          C  
ATOM    288  CD2 PHE A  20      -3.015  -4.870  -2.519  1.00  1.360          C  
ATOM    289  CE1 PHE A  20      -1.736  -3.444  -0.544  1.00  1.360          C  
ATOM    290  CE2 PHE A  20      -3.295  -3.521  -2.339  1.00  1.360          C  
ATOM    291  CZ  PHE A  20      -2.652  -2.812  -1.350  1.00  1.360          C  
ATOM    292  H   PHE A  20      -0.887  -7.356   0.412  1.00  1.160          H  
ATOM    293  HA  PHE A  20      -3.486  -7.619  -0.842  1.00  1.160          H  
ATOM    294 1HB  PHE A  20      -0.682  -7.104  -1.869  1.00  1.630          H  
ATOM    295 2HB  PHE A  20      -2.052  -7.246  -2.965  1.00  1.630          H  
ATOM    296  HD1 PHE A  20      -0.740  -5.255  -0.106  1.00  1.630          H  
ATOM    297  HD2 PHE A  20      -3.511  -5.429  -3.297  1.00  1.630          H  
ATOM    298  HE1 PHE A  20      -1.218  -2.893   0.237  1.00  1.630          H  
ATOM    299  HE2 PHE A  20      -4.016  -3.016  -2.976  1.00  1.630          H  
ATOM    300  HZ  PHE A  20      -2.869  -1.756  -1.211  1.00  1.630          H  
ATOM    301  N   ILE A  21      -1.295 -10.052  -1.284  1.00  0.810          N  
ATOM    302  CA  ILE A  21      -1.189 -11.429  -1.731  1.00  0.810          C  
ATOM    303  C   ILE A  21      -2.148 -12.306  -0.948  1.00  0.780          C  
ATOM    304  O   ILE A  21      -2.837 -13.130  -1.556  1.00  0.790          O  
ATOM    305  CB  ILE A  21       0.244 -11.962  -1.610  1.00  1.130          C  
ATOM    306  CG1 ILE A  21       1.110 -11.207  -2.587  1.00  1.130          C  
ATOM    307  CG2 ILE A  21       0.265 -13.457  -1.941  1.00  1.130          C  
ATOM    308  CD1 ILE A  21       2.585 -11.396  -2.407  1.00  1.130          C  
ATOM    309  H   ILE A  21      -0.475  -9.574  -0.897  1.00  0.970          H  
ATOM    310  HA  ILE A  21      -1.474 -11.480  -2.779  1.00  0.970          H  
ATOM    311  HB  ILE A  21       0.620 -11.796  -0.612  1.00  1.360          H  
ATOM    312 1HG1 ILE A  21       0.827 -11.499  -3.567  1.00  1.360          H  
ATOM    313 2HG1 ILE A  21       0.903 -10.155  -2.485  1.00  1.360          H  
ATOM    314 1HG2 ILE A  21       1.269 -13.856  -1.881  1.00  1.360          H  
ATOM    315 2HG2 ILE A  21      -0.348 -13.991  -1.246  1.00  1.360          H  
ATOM    316 3HG2 ILE A  21      -0.114 -13.591  -2.947  1.00  1.360          H  
ATOM    317 1HD1 ILE A  21       3.111 -10.799  -3.151  1.00  1.360          H  
ATOM    318 2HD1 ILE A  21       2.861 -11.067  -1.410  1.00  1.360          H  
ATOM    319 3HD1 ILE A  21       2.861 -12.429  -2.528  1.00  1.360          H  
ATOM    320  N   GLU A  22      -2.190 -12.172   0.391  1.00  0.800          N  
ATOM    321  CA  GLU A  22      -3.112 -12.980   1.177  1.00  0.800          C  
ATOM    322  C   GLU A  22      -4.555 -12.765   0.742  1.00  0.750          C  
ATOM    323  O   GLU A  22      -5.312 -13.731   0.599  1.00  0.770          O  
ATOM    324  CB  GLU A  22      -2.994 -12.708   2.676  1.00  1.120          C  
ATOM    325  CG  GLU A  22      -3.970 -13.563   3.495  1.00  1.120          C  
ATOM    326  CD  GLU A  22      -3.868 -13.444   4.991  1.00  1.120          C  
ATOM    327  OE1 GLU A  22      -3.016 -12.738   5.464  1.00  1.120          O  
ATOM    328  OE2 GLU A  22      -4.675 -14.067   5.669  1.00  1.120          O  
ATOM    329  H   GLU A  22      -1.581 -11.512   0.884  1.00  0.960          H  
ATOM    330  HA  GLU A  22      -2.861 -14.024   1.021  1.00  0.960          H  
ATOM    331 1HB  GLU A  22      -1.979 -12.919   3.008  1.00  1.340          H  
ATOM    332 2HB  GLU A  22      -3.194 -11.651   2.873  1.00  1.340          H  
ATOM    333 1HG  GLU A  22      -4.956 -13.234   3.232  1.00  1.340          H  
ATOM    334 2HG  GLU A  22      -3.874 -14.608   3.199  1.00  1.340          H  
ATOM    335  N   ASP A  23      -4.957 -11.518   0.478  1.00  0.730          N  
ATOM    336  CA  ASP A  23      -6.331 -11.299   0.053  1.00  0.740          C  
ATOM    337  C   ASP A  23      -6.622 -12.093  -1.235  1.00  0.700          C  
ATOM    338  O   ASP A  23      -7.671 -12.748  -1.350  1.00  0.710          O  
ATOM    339  CB  ASP A  23      -6.585  -9.801  -0.156  1.00  1.030          C  
ATOM    340  CG  ASP A  23      -8.060  -9.454  -0.386  1.00  1.030          C  
ATOM    341  OD1 ASP A  23      -8.843  -9.634   0.509  1.00  1.030          O  
ATOM    342  OD2 ASP A  23      -8.415  -9.027  -1.471  1.00  1.030          O  
ATOM    343  H   ASP A  23      -4.337 -10.712   0.635  1.00  0.880          H  
ATOM    344  HA  ASP A  23      -6.995 -11.658   0.838  1.00  0.890          H  
ATOM    345 1HB  ASP A  23      -6.216  -9.250   0.713  1.00  1.240          H  
ATOM    346 2HB  ASP A  23      -6.001  -9.460  -1.018  1.00  1.240          H  
ATOM    347  N   PHE A  24      -5.671 -12.091  -2.183  1.00  0.700          N  
ATOM    348  CA  PHE A  24      -5.878 -12.861  -3.403  1.00  0.730          C  
ATOM    349  C   PHE A  24      -5.805 -14.358  -3.158  1.00  0.690          C  
ATOM    350  O   PHE A  24      -6.521 -15.114  -3.819  1.00  0.760          O  
ATOM    351  CB  PHE A  24      -4.899 -12.472  -4.504  1.00  1.010          C  
ATOM    352  CG  PHE A  24      -5.268 -11.195  -5.138  1.00  1.010          C  
ATOM    353  CD1 PHE A  24      -4.547 -10.053  -4.904  1.00  1.010          C  
ATOM    354  CD2 PHE A  24      -6.384 -11.128  -5.967  1.00  1.010          C  
ATOM    355  CE1 PHE A  24      -4.920  -8.868  -5.472  1.00  1.010          C  
ATOM    356  CE2 PHE A  24      -6.758  -9.938  -6.541  1.00  1.010          C  
ATOM    357  CZ  PHE A  24      -6.024  -8.805  -6.291  1.00  1.010          C  
ATOM    358  H   PHE A  24      -4.843 -11.492  -2.066  1.00  0.840          H  
ATOM    359  HA  PHE A  24      -6.879 -12.634  -3.764  1.00  0.880          H  
ATOM    360 1HB  PHE A  24      -3.889 -12.378  -4.086  1.00  1.210          H  
ATOM    361 2HB  PHE A  24      -4.881 -13.242  -5.265  1.00  1.210          H  
ATOM    362  HD1 PHE A  24      -3.676 -10.095  -4.259  1.00  1.210          H  
ATOM    363  HD2 PHE A  24      -6.968 -12.032  -6.161  1.00  1.210          H  
ATOM    364  HE1 PHE A  24      -4.349  -7.978  -5.272  1.00  1.210          H  
ATOM    365  HE2 PHE A  24      -7.632  -9.888  -7.192  1.00  1.210          H  
ATOM    366  HZ  PHE A  24      -6.319  -7.853  -6.742  1.00  1.210          H  
ATOM    367  N   CYS A  25      -4.980 -14.791  -2.198  1.00  0.710          N  
ATOM    368  CA  CYS A  25      -4.867 -16.213  -1.903  1.00  0.770          C  
ATOM    369  C   CYS A  25      -6.214 -16.731  -1.446  1.00  0.700          C  
ATOM    370  O   CYS A  25      -6.643 -17.809  -1.863  1.00  0.730          O  
ATOM    371  CB  CYS A  25      -3.898 -16.483  -0.751  1.00  1.050          C  
ATOM    372  SG  CYS A  25      -2.197 -16.156  -1.094  1.00  1.050          S  
ATOM    373  H   CYS A  25      -4.387 -14.110  -1.720  1.00  0.850          H  
ATOM    374  HA  CYS A  25      -4.555 -16.746  -2.799  1.00  0.920          H  
ATOM    375 1HB  CYS A  25      -4.188 -15.893   0.110  1.00  1.260          H  
ATOM    376 2HB  CYS A  25      -3.982 -17.528  -0.460  1.00  1.260          H  
ATOM    377  HG  CYS A  25      -2.366 -14.824  -1.307  1.00  1.260          H  
ATOM    378  N   TRP A  26      -6.892 -15.956  -0.594  1.00  0.700          N  
ATOM    379  CA  TRP A  26      -8.191 -16.362  -0.090  1.00  0.780          C  
ATOM    380  C   TRP A  26      -9.248 -16.419  -1.163  1.00  0.770          C  
ATOM    381  O   TRP A  26     -10.070 -17.342  -1.179  1.00  0.850          O  
ATOM    382  CB  TRP A  26      -8.678 -15.435   1.007  1.00  1.060          C  
ATOM    383  CG  TRP A  26      -8.098 -15.730   2.315  1.00  1.060          C  
ATOM    384  CD1 TRP A  26      -7.268 -14.945   3.034  1.00  1.060          C  
ATOM    385  CD2 TRP A  26      -8.293 -16.935   3.087  1.00  1.060          C  
ATOM    386  NE1 TRP A  26      -6.927 -15.565   4.211  1.00  1.060          N  
ATOM    387  CE2 TRP A  26      -7.553 -16.790   4.257  1.00  1.060          C  
ATOM    388  CE3 TRP A  26      -9.034 -18.114   2.878  1.00  1.060          C  
ATOM    389  CZ2 TRP A  26      -7.522 -17.773   5.225  1.00  1.060          C  
ATOM    390  CZ3 TRP A  26      -9.005 -19.097   3.844  1.00  1.060          C  
ATOM    391  CH2 TRP A  26      -8.271 -18.932   4.990  1.00  1.060          C  
ATOM    392  H   TRP A  26      -6.446 -15.095  -0.255  1.00  0.840          H  
ATOM    393  HA  TRP A  26      -8.080 -17.357   0.326  1.00  0.940          H  
ATOM    394 1HB  TRP A  26      -8.410 -14.406   0.744  1.00  1.270          H  
ATOM    395 2HB  TRP A  26      -9.748 -15.483   1.070  1.00  1.270          H  
ATOM    396  HD1 TRP A  26      -6.928 -13.966   2.718  1.00  1.270          H  
ATOM    397  HE1 TRP A  26      -6.286 -15.155   4.937  1.00  1.270          H  
ATOM    398  HE3 TRP A  26      -9.621 -18.250   1.970  1.00  1.270          H  
ATOM    399  HZ2 TRP A  26      -6.944 -17.663   6.142  1.00  1.270          H  
ATOM    400  HZ3 TRP A  26      -9.582 -20.005   3.675  1.00  1.270          H  
ATOM    401  HH2 TRP A  26      -8.270 -19.727   5.735  1.00  1.270          H  
ATOM    402  N   LYS A  27      -9.246 -15.439  -2.067  1.00  0.760          N  
ATOM    403  CA  LYS A  27     -10.238 -15.439  -3.124  1.00  0.910          C  
ATOM    404  C   LYS A  27     -10.058 -16.635  -4.049  1.00  0.880          C  
ATOM    405  O   LYS A  27     -11.033 -17.332  -4.361  1.00  1.020          O  
ATOM    406  CB  LYS A  27     -10.159 -14.135  -3.915  1.00  1.210          C  
ATOM    407  CG  LYS A  27     -10.683 -12.920  -3.159  1.00  1.210          C  
ATOM    408  CD  LYS A  27     -10.642 -11.647  -4.012  1.00  1.210          C  
ATOM    409  CE  LYS A  27     -11.351 -10.473  -3.310  1.00  1.210          C  
ATOM    410  NZ  LYS A  27     -10.594  -9.979  -2.131  1.00  1.210          N  
ATOM    411  H   LYS A  27      -8.578 -14.665  -1.976  1.00  0.910          H  
ATOM    412  HA  LYS A  27     -11.225 -15.516  -2.669  1.00  1.090          H  
ATOM    413 1HB  LYS A  27      -9.115 -13.939  -4.172  1.00  1.460          H  
ATOM    414 2HB  LYS A  27     -10.707 -14.238  -4.837  1.00  1.460          H  
ATOM    415 1HG  LYS A  27     -11.711 -13.113  -2.849  1.00  1.460          H  
ATOM    416 2HG  LYS A  27     -10.078 -12.773  -2.267  1.00  1.460          H  
ATOM    417 1HD  LYS A  27      -9.596 -11.368  -4.183  1.00  1.460          H  
ATOM    418 2HD  LYS A  27     -11.114 -11.827  -4.975  1.00  1.460          H  
ATOM    419 1HE  LYS A  27     -11.476  -9.655  -4.015  1.00  1.460          H  
ATOM    420 2HE  LYS A  27     -12.332 -10.807  -2.977  1.00  1.460          H  
ATOM    421 1HZ  LYS A  27     -11.069  -9.217  -1.685  1.00  1.460          H  
ATOM    422 2HZ  LYS A  27     -10.462 -10.711  -1.448  1.00  1.460          H  
ATOM    423 3HZ  LYS A  27      -9.666  -9.637  -2.426  1.00  1.460          H  
ATOM    424  N   LEU A  28      -8.806 -16.895  -4.454  1.00  0.770          N  
ATOM    425  CA  LEU A  28      -8.507 -17.999  -5.353  1.00  0.880          C  
ATOM    426  C   LEU A  28      -8.797 -19.324  -4.677  1.00  0.840          C  
ATOM    427  O   LEU A  28      -9.341 -20.245  -5.296  1.00  0.990          O  
ATOM    428  CB  LEU A  28      -7.031 -17.956  -5.749  1.00  1.190          C  
ATOM    429  CG  LEU A  28      -6.574 -16.778  -6.627  1.00  1.190          C  
ATOM    430  CD1 LEU A  28      -5.081 -16.805  -6.688  1.00  1.190          C  
ATOM    431  CD2 LEU A  28      -7.145 -16.884  -8.009  1.00  1.190          C  
ATOM    432  H   LEU A  28      -8.042 -16.284  -4.148  1.00  0.920          H  
ATOM    433  HA  LEU A  28      -9.135 -17.915  -6.231  1.00  1.060          H  
ATOM    434 1HB  LEU A  28      -6.438 -17.930  -4.832  1.00  1.430          H  
ATOM    435 2HB  LEU A  28      -6.795 -18.874  -6.281  1.00  1.430          H  
ATOM    436  HG  LEU A  28      -6.887 -15.841  -6.176  1.00  1.430          H  
ATOM    437 1HD1 LEU A  28      -4.725 -15.982  -7.277  1.00  1.430          H  
ATOM    438 2HD1 LEU A  28      -4.711 -16.728  -5.687  1.00  1.430          H  
ATOM    439 3HD1 LEU A  28      -4.741 -17.726  -7.128  1.00  1.430          H  
ATOM    440 1HD2 LEU A  28      -6.788 -16.049  -8.611  1.00  1.430          H  
ATOM    441 2HD2 LEU A  28      -6.817 -17.800  -8.443  1.00  1.430          H  
ATOM    442 3HD2 LEU A  28      -8.230 -16.860  -7.985  1.00  1.430          H  
ATOM    443  N   HIS A  29      -8.460 -19.430  -3.390  1.00  0.850          N  
ATOM    444  CA  HIS A  29      -8.690 -20.648  -2.643  1.00  1.110          C  
ATOM    445  C   HIS A  29     -10.169 -20.973  -2.543  1.00  1.190          C  
ATOM    446  O   HIS A  29     -10.612 -22.043  -2.969  1.00  1.340          O  
ATOM    447  CB  HIS A  29      -8.100 -20.496  -1.235  1.00  1.450          C  
ATOM    448  CG  HIS A  29      -8.333 -21.645  -0.318  1.00  1.450          C  
ATOM    449  ND1 HIS A  29      -7.650 -22.839  -0.421  1.00  1.450          N  
ATOM    450  CD2 HIS A  29      -9.177 -21.782   0.734  1.00  1.450          C  
ATOM    451  CE1 HIS A  29      -8.065 -23.662   0.526  1.00  1.450          C  
ATOM    452  NE2 HIS A  29      -8.990 -23.044   1.241  1.00  1.450          N  
ATOM    453  H   HIS A  29      -7.981 -18.667  -2.908  1.00  1.020          H  
ATOM    454  HA  HIS A  29      -8.193 -21.480  -3.138  1.00  1.330          H  
ATOM    455 1HB  HIS A  29      -7.025 -20.342  -1.316  1.00  1.740          H  
ATOM    456 2HB  HIS A  29      -8.514 -19.605  -0.768  1.00  1.740          H  
ATOM    457  HD2 HIS A  29      -9.873 -21.028   1.104  1.00  1.740          H  
ATOM    458  HE1 HIS A  29      -7.706 -24.678   0.691  1.00  1.740          H  
ATOM    459  HE2 HIS A  29      -9.483 -23.437   2.032  1.00  1.740          H  
ATOM    460  N   ARG A  30     -10.967 -20.034  -2.033  1.00  1.220          N  
ATOM    461  CA  ARG A  30     -12.381 -20.308  -1.831  1.00  1.530          C  
ATOM    462  C   ARG A  30     -13.140 -20.641  -3.113  1.00  1.590          C  
ATOM    463  O   ARG A  30     -14.027 -21.494  -3.097  1.00  1.830          O  
ATOM    464  CB  ARG A  30     -13.055 -19.168  -1.085  1.00  2.020          C  
ATOM    465  CG  ARG A  30     -12.640 -19.066   0.397  1.00  2.020          C  
ATOM    466  CD  ARG A  30     -13.514 -18.143   1.171  1.00  2.020          C  
ATOM    467  NE  ARG A  30     -13.120 -18.074   2.594  1.00  2.020          N  
ATOM    468  CZ  ARG A  30     -12.382 -17.098   3.182  1.00  2.020          C  
ATOM    469  NH1 ARG A  30     -11.957 -16.062   2.501  1.00  2.020          N  
ATOM    470  NH2 ARG A  30     -12.097 -17.189   4.471  1.00  2.020          N  
ATOM    471  H   ARG A  30     -10.577 -19.136  -1.736  1.00  1.460          H  
ATOM    472  HA  ARG A  30     -12.446 -21.180  -1.183  1.00  1.840          H  
ATOM    473 1HB  ARG A  30     -12.795 -18.221  -1.566  1.00  2.420          H  
ATOM    474 2HB  ARG A  30     -14.136 -19.280  -1.135  1.00  2.420          H  
ATOM    475 1HG  ARG A  30     -12.691 -20.052   0.856  1.00  2.420          H  
ATOM    476 2HG  ARG A  30     -11.616 -18.697   0.457  1.00  2.420          H  
ATOM    477 1HD  ARG A  30     -13.472 -17.149   0.738  1.00  2.420          H  
ATOM    478 2HD  ARG A  30     -14.541 -18.507   1.124  1.00  2.420          H  
ATOM    479  HE  ARG A  30     -13.420 -18.841   3.183  1.00  2.420          H  
ATOM    480 1HH1 ARG A  30     -12.167 -15.973   1.521  1.00  2.420          H  
ATOM    481 2HH1 ARG A  30     -11.420 -15.342   2.968  1.00  2.420          H  
ATOM    482 1HH2 ARG A  30     -12.421 -17.982   5.008  1.00  2.420          H  
ATOM    483 2HH2 ARG A  30     -11.546 -16.470   4.920  1.00  2.420          H  
ATOM    484  N   ARG A  31     -12.804 -19.992  -4.229  1.00  1.480          N  
ATOM    485  CA  ARG A  31     -13.504 -20.265  -5.483  1.00  1.690          C  
ATOM    486  C   ARG A  31     -12.886 -21.419  -6.283  1.00  1.630          C  
ATOM    487  O   ARG A  31     -13.360 -21.704  -7.384  1.00  1.830          O  
ATOM    488  CB  ARG A  31     -13.510 -19.043  -6.404  1.00  2.280          C  
ATOM    489  CG  ARG A  31     -12.159 -18.756  -7.035  1.00  2.280          C  
ATOM    490  CD  ARG A  31     -12.086 -17.566  -7.900  1.00  2.280          C  
ATOM    491  NE  ARG A  31     -12.292 -16.321  -7.211  1.00  2.280          N  
ATOM    492  CZ  ARG A  31     -12.037 -15.112  -7.753  1.00  2.280          C  
ATOM    493  NH1 ARG A  31     -11.506 -15.006  -8.971  1.00  2.280          N  
ATOM    494  NH2 ARG A  31     -12.327 -14.019  -7.065  1.00  2.280          N  
ATOM    495  H   ARG A  31     -12.084 -19.261  -4.205  1.00  1.780          H  
ATOM    496  HA  ARG A  31     -14.535 -20.526  -5.246  1.00  2.030          H  
ATOM    497 1HB  ARG A  31     -14.231 -19.184  -7.205  1.00  2.740          H  
ATOM    498 2HB  ARG A  31     -13.804 -18.164  -5.837  1.00  2.740          H  
ATOM    499 1HG  ARG A  31     -11.389 -18.725  -6.296  1.00  2.740          H  
ATOM    500 2HG  ARG A  31     -11.960 -19.559  -7.715  1.00  2.740          H  
ATOM    501 1HD  ARG A  31     -11.096 -17.543  -8.347  1.00  2.740          H  
ATOM    502 2HD  ARG A  31     -12.834 -17.652  -8.688  1.00  2.740          H  
ATOM    503  HE  ARG A  31     -12.702 -16.349  -6.286  1.00  2.740          H  
ATOM    504 1HH1 ARG A  31     -11.251 -15.843  -9.540  1.00  2.740          H  
ATOM    505 2HH1 ARG A  31     -11.325 -14.098  -9.364  1.00  2.740          H  
ATOM    506 1HH2 ARG A  31     -12.745 -14.100  -6.147  1.00  2.740          H  
ATOM    507 2HH2 ARG A  31     -12.148 -13.107  -7.460  1.00  2.740          H  
ATOM    508  N   GLU A  32     -11.801 -22.038  -5.783  1.00  1.450          N  
ATOM    509  CA  GLU A  32     -11.055 -23.063  -6.526  1.00  1.500          C  
ATOM    510  C   GLU A  32     -10.634 -22.518  -7.901  1.00  1.590          C  
ATOM    511  O   GLU A  32     -10.855 -23.158  -8.934  1.00  1.860          O  
ATOM    512  CB  GLU A  32     -11.869 -24.365  -6.692  1.00  2.080          C  
ATOM    513  CG  GLU A  32     -12.254 -25.053  -5.374  1.00  2.080          C  
ATOM    514  CD  GLU A  32     -12.924 -26.422  -5.547  1.00  2.080          C  
ATOM    515  OE1 GLU A  32     -13.200 -26.810  -6.659  1.00  2.080          O  
ATOM    516  OE2 GLU A  32     -13.148 -27.072  -4.551  1.00  2.080          O  
ATOM    517  H   GLU A  32     -11.479 -21.812  -4.836  1.00  1.740          H  
ATOM    518  HA  GLU A  32     -10.147 -23.293  -5.963  1.00  1.800          H  
ATOM    519 1HB  GLU A  32     -12.784 -24.166  -7.244  1.00  2.500          H  
ATOM    520 2HB  GLU A  32     -11.289 -25.079  -7.276  1.00  2.500          H  
ATOM    521 1HG  GLU A  32     -11.355 -25.173  -4.772  1.00  2.500          H  
ATOM    522 2HG  GLU A  32     -12.930 -24.392  -4.829  1.00  2.500          H  
ATOM    523  N   GLY A  33     -10.024 -21.327  -7.892  1.00  1.460          N  
ATOM    524  CA  GLY A  33      -9.605 -20.605  -9.089  1.00  1.680          C  
ATOM    525  C   GLY A  33      -8.157 -20.840  -9.460  1.00  1.780          C  
ATOM    526  O   GLY A  33      -7.589 -21.908  -9.203  1.00  1.730          O  
ATOM    527  H   GLY A  33      -9.853 -20.897  -6.979  1.00  1.750          H  
ATOM    528 1HA  GLY A  33     -10.249 -20.888  -9.921  1.00  2.020          H  
ATOM    529 2HA  GLY A  33      -9.758 -19.539  -8.932  1.00  2.020          H  
ATOM    530  N   ALA A  34      -7.521 -19.815 -10.043  1.00  2.040          N  
ATOM    531  CA  ALA A  34      -6.133 -19.918 -10.507  1.00  2.280          C  
ATOM    532  C   ALA A  34      -5.129 -19.862  -9.350  1.00  2.010          C  
ATOM    533  O   ALA A  34      -4.296 -18.956  -9.245  1.00  1.700          O  
ATOM    534  CB  ALA A  34      -5.831 -18.782 -11.472  1.00  3.100          C  
ATOM    535  H   ALA A  34      -8.044 -18.961 -10.221  1.00  2.450          H  
ATOM    536  HA  ALA A  34      -6.015 -20.874 -11.016  1.00  2.740          H  
ATOM    537 1HB  ALA A  34      -4.820 -18.880 -11.831  1.00  3.720          H  
ATOM    538 2HB  ALA A  34      -6.513 -18.814 -12.310  1.00  3.720          H  
ATOM    539 3HB  ALA A  34      -5.945 -17.829 -10.958  1.00  3.720          H  
ATOM    540  N   CYS A  35      -5.221 -20.847  -8.482  1.00  2.210          N  
ATOM    541  CA  CYS A  35      -4.398 -20.918  -7.300  1.00  2.060          C  
ATOM    542  C   CYS A  35      -2.978 -21.075  -7.774  1.00  1.580          C  
ATOM    543  O   CYS A  35      -2.725 -21.838  -8.705  1.00  1.340          O  
ATOM    544  CB  CYS A  35      -4.836 -22.093  -6.435  1.00  2.940          C  
ATOM    545  SG  CYS A  35      -6.550 -21.926  -5.817  1.00  2.940          S  
ATOM    546  H   CYS A  35      -5.918 -21.560  -8.671  1.00  2.650          H  
ATOM    547  HA  CYS A  35      -4.492 -19.998  -6.729  1.00  2.470          H  
ATOM    548 1HB  CYS A  35      -4.768 -23.015  -7.011  1.00  3.530          H  
ATOM    549 2HB  CYS A  35      -4.170 -22.183  -5.579  1.00  3.530          H  
ATOM    550  HG  CYS A  35      -7.143 -21.935  -7.027  1.00  3.530          H  
ATOM    551  N   VAL A  36      -2.046 -20.336  -7.180  1.00  1.590          N  
ATOM    552  CA  VAL A  36      -0.666 -19.911  -7.025  1.00  1.440          C  
ATOM    553  C   VAL A  36      -0.420 -18.545  -7.679  1.00  1.090          C  
ATOM    554  O   VAL A  36       0.642 -17.950  -7.502  1.00  1.310          O  
ATOM    555  CB  VAL A  36       0.277 -21.018  -7.586  1.00  2.080          C  
ATOM    556  CG1 VAL A  36       1.760 -20.596  -7.575  1.00  2.080          C  
ATOM    557  CG2 VAL A  36       0.118 -22.279  -6.708  1.00  2.080          C  
ATOM    558  H   VAL A  36      -1.563 -20.837  -7.912  1.00  1.910          H  
ATOM    559  HA  VAL A  36      -0.460 -19.814  -5.959  1.00  1.730          H  
ATOM    560  HB  VAL A  36      -0.000 -21.246  -8.620  1.00  2.490          H  
ATOM    561 1HG1 VAL A  36       2.362 -21.417  -7.957  1.00  2.490          H  
ATOM    562 2HG1 VAL A  36       1.932 -19.735  -8.205  1.00  2.490          H  
ATOM    563 3HG1 VAL A  36       2.069 -20.366  -6.555  1.00  2.490          H  
ATOM    564 1HG2 VAL A  36       0.761 -23.070  -7.093  1.00  2.490          H  
ATOM    565 2HG2 VAL A  36       0.408 -22.044  -5.684  1.00  2.490          H  
ATOM    566 3HG2 VAL A  36      -0.909 -22.630  -6.714  1.00  2.490          H  
ATOM    567  N   ASN A  37      -1.402 -18.018  -8.414  1.00  0.970          N  
ATOM    568  CA  ASN A  37      -1.192 -16.767  -9.137  1.00  1.120          C  
ATOM    569  C   ASN A  37      -1.554 -15.517  -8.331  1.00  1.050          C  
ATOM    570  O   ASN A  37      -1.611 -14.408  -8.876  1.00  1.190          O  
ATOM    571  CB  ASN A  37      -1.914 -16.821 -10.458  1.00  1.510          C  
ATOM    572  CG  ASN A  37      -1.250 -17.804 -11.400  1.00  1.510          C  
ATOM    573  OD1 ASN A  37      -0.017 -17.929 -11.425  1.00  1.510          O  
ATOM    574  ND2 ASN A  37      -2.031 -18.505 -12.175  1.00  1.510          N  
ATOM    575  H   ASN A  37      -2.308 -18.495  -8.519  1.00  1.160          H  
ATOM    576  HA  ASN A  37      -0.128 -16.690  -9.358  1.00  1.340          H  
ATOM    577 1HB  ASN A  37      -2.957 -17.096 -10.311  1.00  1.810          H  
ATOM    578 2HB  ASN A  37      -1.888 -15.848 -10.899  1.00  1.810          H  
ATOM    579 1HD2 ASN A  37      -1.637 -19.171 -12.810  1.00  1.810          H  
ATOM    580 2HD2 ASN A  37      -3.019 -18.376 -12.131  1.00  1.810          H  
ATOM    581  N   CYS A  38      -1.754 -15.697  -7.027  1.00  0.940          N  
ATOM    582  CA  CYS A  38      -2.051 -14.623  -6.088  1.00  0.980          C  
ATOM    583  C   CYS A  38      -0.947 -13.573  -6.033  1.00  0.960          C  
ATOM    584  O   CYS A  38      -1.225 -12.390  -5.839  1.00  1.050          O  
ATOM    585  CB  CYS A  38      -2.174 -15.226  -4.703  1.00  1.360          C  
ATOM    586  SG  CYS A  38      -0.675 -16.130  -4.240  1.00  1.360          S  
ATOM    587  H   CYS A  38      -1.724 -16.650  -6.697  1.00  1.130          H  
ATOM    588  HA  CYS A  38      -2.986 -14.151  -6.383  1.00  1.180          H  
ATOM    589 1HB  CYS A  38      -2.337 -14.434  -3.966  1.00  1.630          H  
ATOM    590 2HB  CYS A  38      -3.003 -15.897  -4.644  1.00  1.630          H  
ATOM    591  HG  CYS A  38      -1.053 -16.416  -2.993  1.00  1.630          H  
ATOM    592  N   GLU A  39       0.304 -13.992  -6.255  1.00  0.960          N  
ATOM    593  CA  GLU A  39       1.426 -13.068  -6.248  1.00  0.990          C  
ATOM    594  C   GLU A  39       1.320 -12.090  -7.399  1.00  1.000          C  
ATOM    595  O   GLU A  39       1.700 -10.921  -7.276  1.00  1.050          O  
ATOM    596  CB  GLU A  39       2.752 -13.819  -6.339  1.00  1.370          C  
ATOM    597  CG  GLU A  39       3.098 -14.626  -5.104  1.00  1.370          C  
ATOM    598  CD  GLU A  39       4.398 -15.357  -5.235  1.00  1.370          C  
ATOM    599  OE1 GLU A  39       4.974 -15.316  -6.298  1.00  1.370          O  
ATOM    600  OE2 GLU A  39       4.821 -15.956  -4.275  1.00  1.370          O  
ATOM    601  H   GLU A  39       0.489 -14.982  -6.375  1.00  1.150          H  
ATOM    602  HA  GLU A  39       1.415 -12.513  -5.327  1.00  1.190          H  
ATOM    603 1HB  GLU A  39       2.727 -14.496  -7.192  1.00  1.650          H  
ATOM    604 2HB  GLU A  39       3.559 -13.105  -6.509  1.00  1.650          H  
ATOM    605 1HG  GLU A  39       3.152 -13.960  -4.254  1.00  1.650          H  
ATOM    606 2HG  GLU A  39       2.302 -15.342  -4.916  1.00  1.650          H  
ATOM    607  N   MET A  40       0.827 -12.586  -8.530  1.00  1.050          N  
ATOM    608  CA  MET A  40       0.749 -11.787  -9.729  1.00  1.140          C  
ATOM    609  C   MET A  40      -0.480 -10.898  -9.666  1.00  1.100          C  
ATOM    610  O   MET A  40      -0.428  -9.721 -10.038  1.00  1.210          O  
ATOM    611  CB  MET A  40       0.739 -12.719 -10.923  1.00  1.560          C  
ATOM    612  CG  MET A  40       2.026 -13.551 -11.113  1.00  1.560          C  
ATOM    613  SD  MET A  40       3.532 -12.579 -11.370  1.00  1.560          S  
ATOM    614  CE  MET A  40       4.303 -12.557  -9.736  1.00  1.560          C  
ATOM    615  H   MET A  40       0.518 -13.554  -8.556  1.00  1.260          H  
ATOM    616  HA  MET A  40       1.620 -11.145  -9.784  1.00  1.370          H  
ATOM    617 1HB  MET A  40      -0.063 -13.441 -10.784  1.00  1.870          H  
ATOM    618 2HB  MET A  40       0.538 -12.161 -11.826  1.00  1.870          H  
ATOM    619 1HG  MET A  40       2.173 -14.177 -10.232  1.00  1.870          H  
ATOM    620 2HG  MET A  40       1.896 -14.213 -11.972  1.00  1.870          H  
ATOM    621 1HE  MET A  40       5.243 -12.008  -9.785  1.00  1.870          H  
ATOM    622 2HE  MET A  40       3.653 -12.075  -9.022  1.00  1.870          H  
ATOM    623 3HE  MET A  40       4.502 -13.580  -9.410  1.00  1.870          H  
ATOM    624  N   HIS A  41      -1.572 -11.409  -9.105  1.00  1.010          N  
ATOM    625  CA  HIS A  41      -2.754 -10.575  -8.999  1.00  1.050          C  
ATOM    626  C   HIS A  41      -2.440  -9.409  -8.072  1.00  1.020          C  
ATOM    627  O   HIS A  41      -2.913  -8.290  -8.303  1.00  1.030          O  
ATOM    628  CB  HIS A  41      -3.963 -11.349  -8.517  1.00  1.450          C  
ATOM    629  CG  HIS A  41      -4.566 -12.287  -9.520  1.00  1.450          C  
ATOM    630  ND1 HIS A  41      -5.151 -11.851 -10.717  1.00  1.450          N  
ATOM    631  CD2 HIS A  41      -4.710 -13.628  -9.502  1.00  1.450          C  
ATOM    632  CE1 HIS A  41      -5.630 -12.902 -11.365  1.00  1.450          C  
ATOM    633  NE2 HIS A  41      -5.370 -13.983 -10.656  1.00  1.450          N  
ATOM    634  H   HIS A  41      -1.596 -12.391  -8.821  1.00  1.210          H  
ATOM    635  HA  HIS A  41      -3.008 -10.155  -9.964  1.00  1.260          H  
ATOM    636 1HB  HIS A  41      -3.697 -11.915  -7.626  1.00  1.740          H  
ATOM    637 2HB  HIS A  41      -4.717 -10.644  -8.247  1.00  1.740          H  
ATOM    638  HD2 HIS A  41      -4.372 -14.295  -8.722  1.00  1.740          H  
ATOM    639  HE1 HIS A  41      -6.142 -12.880 -12.328  1.00  1.740          H  
ATOM    640  HE2 HIS A  41      -5.621 -14.925 -10.925  1.00  1.740          H  
ATOM    641  N   ALA A  42      -1.649  -9.669  -7.013  1.00  1.040          N  
ATOM    642  CA  ALA A  42      -1.247  -8.611  -6.108  1.00  1.050          C  
ATOM    643  C   ALA A  42      -0.439  -7.557  -6.864  1.00  1.040          C  
ATOM    644  O   ALA A  42      -0.699  -6.373  -6.708  1.00  1.020          O  
ATOM    645  CB  ALA A  42      -0.457  -9.173  -4.953  1.00  1.470          C  
ATOM    646  H   ALA A  42      -1.341 -10.626  -6.827  1.00  1.250          H  
ATOM    647  HA  ALA A  42      -2.137  -8.133  -5.718  1.00  1.260          H  
ATOM    648 1HB  ALA A  42      -0.178  -8.375  -4.271  1.00  1.760          H  
ATOM    649 2HB  ALA A  42      -1.069  -9.900  -4.436  1.00  1.760          H  
ATOM    650 3HB  ALA A  42       0.441  -9.659  -5.331  1.00  1.760          H  
ATOM    651  N   LEU A  43       0.429  -7.946  -7.811  1.00  1.110          N  
ATOM    652  CA  LEU A  43       1.203  -6.927  -8.537  1.00  1.210          C  
ATOM    653  C   LEU A  43       0.265  -5.931  -9.221  1.00  1.180          C  
ATOM    654  O   LEU A  43       0.568  -4.734  -9.302  1.00  1.260          O  
ATOM    655  CB  LEU A  43       2.028  -7.539  -9.678  1.00  1.650          C  
ATOM    656  CG  LEU A  43       3.161  -8.484  -9.349  1.00  1.650          C  
ATOM    657  CD1 LEU A  43       3.637  -9.052 -10.641  1.00  1.650          C  
ATOM    658  CD2 LEU A  43       4.291  -7.794  -8.650  1.00  1.650          C  
ATOM    659  H   LEU A  43       0.656  -8.944  -7.907  1.00  1.330          H  
ATOM    660  HA  LEU A  43       1.833  -6.391  -7.830  1.00  1.450          H  
ATOM    661 1HB  LEU A  43       1.351  -8.066 -10.338  1.00  1.980          H  
ATOM    662 2HB  LEU A  43       2.466  -6.719 -10.250  1.00  1.980          H  
ATOM    663  HG  LEU A  43       2.792  -9.282  -8.726  1.00  1.980          H  
ATOM    664 1HD1 LEU A  43       4.437  -9.748 -10.454  1.00  1.980          H  
ATOM    665 2HD1 LEU A  43       2.822  -9.563 -11.149  1.00  1.980          H  
ATOM    666 3HD1 LEU A  43       3.998  -8.250 -11.269  1.00  1.980          H  
ATOM    667 1HD2 LEU A  43       5.070  -8.523  -8.452  1.00  1.980          H  
ATOM    668 2HD2 LEU A  43       4.679  -7.008  -9.294  1.00  1.980          H  
ATOM    669 3HD2 LEU A  43       3.947  -7.372  -7.714  1.00  1.980          H  
ATOM    670  N   ASN A  44      -0.862  -6.435  -9.733  1.00  1.100          N  
ATOM    671  CA  ASN A  44      -1.824  -5.589 -10.431  1.00  1.170          C  
ATOM    672  C   ASN A  44      -2.559  -4.670  -9.453  1.00  1.110          C  
ATOM    673  O   ASN A  44      -2.718  -3.474  -9.721  1.00  1.260          O  
ATOM    674  CB  ASN A  44      -2.811  -6.441 -11.192  1.00  1.610          C  
ATOM    675  CG  ASN A  44      -3.698  -5.679 -12.127  1.00  1.610          C  
ATOM    676  OD1 ASN A  44      -3.234  -4.956 -13.016  1.00  1.610          O  
ATOM    677  ND2 ASN A  44      -4.979  -5.836 -11.946  1.00  1.610          N  
ATOM    678  H   ASN A  44      -1.015  -7.450  -9.658  1.00  1.320          H  
ATOM    679  HA  ASN A  44      -1.284  -4.959 -11.137  1.00  1.400          H  
ATOM    680 1HB  ASN A  44      -2.277  -7.158 -11.735  1.00  1.930          H  
ATOM    681 2HB  ASN A  44      -3.437  -6.984 -10.487  1.00  1.930          H  
ATOM    682 1HD2 ASN A  44      -5.635  -5.362 -12.534  1.00  1.930          H  
ATOM    683 2HD2 ASN A  44      -5.293  -6.434 -11.213  1.00  1.930          H  
ATOM    684  N   GLU A  45      -3.005  -5.225  -8.322  1.00  0.990          N  
ATOM    685  CA  GLU A  45      -3.734  -4.435  -7.327  1.00  0.970          C  
ATOM    686  C   GLU A  45      -2.803  -3.363  -6.741  1.00  0.890          C  
ATOM    687  O   GLU A  45      -3.220  -2.233  -6.449  1.00  0.820          O  
ATOM    688  CB  GLU A  45      -4.279  -5.347  -6.243  1.00  1.370          C  
ATOM    689  CG  GLU A  45      -5.286  -4.713  -5.289  1.00  1.370          C  
ATOM    690  CD  GLU A  45      -6.582  -4.353  -5.943  1.00  1.370          C  
ATOM    691  OE1 GLU A  45      -6.841  -4.835  -7.021  1.00  1.370          O  
ATOM    692  OE2 GLU A  45      -7.324  -3.605  -5.360  1.00  1.370          O  
ATOM    693  H   GLU A  45      -2.872  -6.235  -8.186  1.00  1.190          H  
ATOM    694  HA  GLU A  45      -4.570  -3.937  -7.821  1.00  1.160          H  
ATOM    695 1HB  GLU A  45      -4.752  -6.185  -6.725  1.00  1.640          H  
ATOM    696 2HB  GLU A  45      -3.446  -5.737  -5.656  1.00  1.640          H  
ATOM    697 1HG  GLU A  45      -5.491  -5.400  -4.470  1.00  1.640          H  
ATOM    698 2HG  GLU A  45      -4.852  -3.813  -4.882  1.00  1.640          H  
ATOM    699  N   ILE A  46      -1.533  -3.731  -6.576  1.00  0.920          N  
ATOM    700  CA  ILE A  46      -0.505  -2.828  -6.106  1.00  0.890          C  
ATOM    701  C   ILE A  46      -0.339  -1.682  -7.128  1.00  0.850          C  
ATOM    702  O   ILE A  46      -0.365  -0.510  -6.751  1.00  0.760          O  
ATOM    703  CB  ILE A  46       0.811  -3.589  -5.820  1.00  1.260          C  
ATOM    704  CG1 ILE A  46       0.715  -4.592  -4.613  1.00  1.260          C  
ATOM    705  CG2 ILE A  46       1.828  -2.634  -5.556  1.00  1.260          C  
ATOM    706  CD1 ILE A  46       0.593  -3.981  -3.254  1.00  1.260          C  
ATOM    707  H   ILE A  46      -1.276  -4.688  -6.808  1.00  1.100          H  
ATOM    708  HA  ILE A  46      -0.841  -2.400  -5.170  1.00  1.070          H  
ATOM    709  HB  ILE A  46       1.091  -4.179  -6.690  1.00  1.510          H  
ATOM    710 1HG1 ILE A  46      -0.166  -5.202  -4.738  1.00  1.510          H  
ATOM    711 2HG1 ILE A  46       1.584  -5.230  -4.630  1.00  1.510          H  
ATOM    712 1HG2 ILE A  46       2.764  -3.119  -5.359  1.00  1.510          H  
ATOM    713 2HG2 ILE A  46       1.918  -2.027  -6.421  1.00  1.510          H  
ATOM    714 3HG2 ILE A  46       1.555  -2.021  -4.707  1.00  1.510          H  
ATOM    715 1HD1 ILE A  46       0.538  -4.784  -2.540  1.00  1.510          H  
ATOM    716 2HD1 ILE A  46       1.450  -3.377  -3.012  1.00  1.510          H  
ATOM    717 3HD1 ILE A  46      -0.300  -3.373  -3.195  1.00  1.510          H  
ATOM    718  N   GLN A  47      -0.251  -1.993  -8.430  1.00  0.980          N  
ATOM    719  CA  GLN A  47      -0.162  -0.916  -9.410  1.00  1.040          C  
ATOM    720  C   GLN A  47      -1.378   0.000  -9.359  1.00  0.970          C  
ATOM    721  O   GLN A  47      -1.233   1.206  -9.576  1.00  1.020          O  
ATOM    722  CB  GLN A  47       0.039  -1.451 -10.833  1.00  1.430          C  
ATOM    723  CG  GLN A  47       0.057  -0.351 -11.967  1.00  1.430          C  
ATOM    724  CD  GLN A  47       1.162   0.715 -11.885  1.00  1.430          C  
ATOM    725  OE1 GLN A  47       2.355   0.418 -11.766  1.00  1.430          O  
ATOM    726  NE2 GLN A  47       0.745   1.971 -11.978  1.00  1.430          N  
ATOM    727  H   GLN A  47      -0.194  -2.971  -8.731  1.00  1.180          H  
ATOM    728  HA  GLN A  47       0.713  -0.318  -9.165  1.00  1.250          H  
ATOM    729 1HB  GLN A  47       0.978  -2.004 -10.879  1.00  1.720          H  
ATOM    730 2HB  GLN A  47      -0.763  -2.155 -11.063  1.00  1.720          H  
ATOM    731 1HG  GLN A  47       0.181  -0.869 -12.916  1.00  1.720          H  
ATOM    732 2HG  GLN A  47      -0.905   0.166 -11.972  1.00  1.720          H  
ATOM    733 1HE2 GLN A  47       1.384   2.738 -11.945  1.00  1.720          H  
ATOM    734 2HE2 GLN A  47      -0.243   2.169 -12.096  1.00  1.720          H  
ATOM    735  N   GLU A  48      -2.572  -0.536  -9.090  1.00  0.950          N  
ATOM    736  CA  GLU A  48      -3.738   0.339  -9.025  1.00  1.030          C  
ATOM    737  C   GLU A  48      -3.602   1.334  -7.868  1.00  0.930          C  
ATOM    738  O   GLU A  48      -3.820   2.536  -8.061  1.00  1.070          O  
ATOM    739  CB  GLU A  48      -5.022  -0.487  -8.852  1.00  1.410          C  
ATOM    740  CG  GLU A  48      -6.356   0.309  -8.816  1.00  1.410          C  
ATOM    741  CD  GLU A  48      -6.709   0.983 -10.123  1.00  1.410          C  
ATOM    742  OE1 GLU A  48      -6.061   0.705 -11.103  1.00  1.410          O  
ATOM    743  OE2 GLU A  48      -7.667   1.722 -10.157  1.00  1.410          O  
ATOM    744  H   GLU A  48      -2.657  -1.556  -9.005  1.00  1.140          H  
ATOM    745  HA  GLU A  48      -3.806   0.897  -9.959  1.00  1.240          H  
ATOM    746 1HB  GLU A  48      -5.087  -1.221  -9.655  1.00  1.690          H  
ATOM    747 2HB  GLU A  48      -4.959  -1.046  -7.919  1.00  1.690          H  
ATOM    748 1HG  GLU A  48      -7.157  -0.378  -8.546  1.00  1.690          H  
ATOM    749 2HG  GLU A  48      -6.290   1.063  -8.034  1.00  1.690          H  
ATOM    750  N   VAL A  49      -3.152   0.879  -6.687  1.00  0.770          N  
ATOM    751  CA  VAL A  49      -3.046   1.851  -5.595  1.00  0.840          C  
ATOM    752  C   VAL A  49      -1.954   2.882  -5.895  1.00  0.840          C  
ATOM    753  O   VAL A  49      -2.078   4.048  -5.518  1.00  1.000          O  
ATOM    754  CB  VAL A  49      -2.856   1.193  -4.190  1.00  1.150          C  
ATOM    755  CG1 VAL A  49      -4.054   0.285  -3.901  1.00  1.150          C  
ATOM    756  CG2 VAL A  49      -1.569   0.392  -4.083  1.00  1.150          C  
ATOM    757  H   VAL A  49      -2.986  -0.129  -6.568  1.00  0.920          H  
ATOM    758  HA  VAL A  49      -3.993   2.385  -5.543  1.00  1.010          H  
ATOM    759  HB  VAL A  49      -2.847   1.986  -3.444  1.00  1.380          H  
ATOM    760 1HG1 VAL A  49      -3.955  -0.149  -2.908  1.00  1.380          H  
ATOM    761 2HG1 VAL A  49      -4.972   0.868  -3.953  1.00  1.380          H  
ATOM    762 3HG1 VAL A  49      -4.093  -0.516  -4.642  1.00  1.380          H  
ATOM    763 1HG2 VAL A  49      -1.482  -0.042  -3.090  1.00  1.380          H  
ATOM    764 2HG2 VAL A  49      -1.621  -0.381  -4.795  1.00  1.380          H  
ATOM    765 3HG2 VAL A  49      -0.703   1.014  -4.272  1.00  1.380          H  
ATOM    766  N   PHE A  50      -0.888   2.478  -6.587  1.00  0.760          N  
ATOM    767  CA  PHE A  50       0.164   3.427  -6.944  1.00  0.860          C  
ATOM    768  C   PHE A  50      -0.347   4.456  -7.944  1.00  0.900          C  
ATOM    769  O   PHE A  50      -0.192   5.672  -7.759  1.00  1.000          O  
ATOM    770  CB  PHE A  50       1.336   2.708  -7.595  1.00  1.160          C  
ATOM    771  CG  PHE A  50       2.066   1.753  -6.743  1.00  1.160          C  
ATOM    772  CD1 PHE A  50       1.963   1.728  -5.370  1.00  1.160          C  
ATOM    773  CD2 PHE A  50       2.875   0.857  -7.336  1.00  1.160          C  
ATOM    774  CE1 PHE A  50       2.662   0.826  -4.645  1.00  1.160          C  
ATOM    775  CE2 PHE A  50       3.582  -0.035  -6.606  1.00  1.160          C  
ATOM    776  CZ  PHE A  50       3.476  -0.049  -5.256  1.00  1.160          C  
ATOM    777  H   PHE A  50      -0.792   1.481  -6.825  1.00  0.910          H  
ATOM    778  HA  PHE A  50       0.494   3.963  -6.066  1.00  1.030          H  
ATOM    779 1HB  PHE A  50       0.980   2.172  -8.474  1.00  1.400          H  
ATOM    780 2HB  PHE A  50       2.047   3.438  -7.948  1.00  1.400          H  
ATOM    781  HD1 PHE A  50       1.321   2.413  -4.860  1.00  1.400          H  
ATOM    782  HD2 PHE A  50       2.948   0.871  -8.413  1.00  1.400          H  
ATOM    783  HE1 PHE A  50       2.575   0.808  -3.592  1.00  1.400          H  
ATOM    784  HE2 PHE A  50       4.217  -0.741  -7.089  1.00  1.400          H  
ATOM    785  HZ  PHE A  50       4.043  -0.773  -4.673  1.00  1.400          H  
ATOM    786  N   THR A  51      -1.080   3.987  -8.950  1.00  0.910          N  
ATOM    787  CA  THR A  51      -1.581   4.843 -10.017  1.00  1.060          C  
ATOM    788  C   THR A  51      -2.408   5.981  -9.440  1.00  1.140          C  
ATOM    789  O   THR A  51      -2.235   7.156  -9.792  1.00  1.310          O  
ATOM    790  CB  THR A  51      -2.471   4.032 -10.993  1.00  1.420          C  
ATOM    791  OG1 THR A  51      -1.708   2.949 -11.550  1.00  1.420          O  
ATOM    792  CG2 THR A  51      -2.967   4.928 -12.124  1.00  1.420          C  
ATOM    793  H   THR A  51      -1.223   2.980  -9.036  1.00  1.090          H  
ATOM    794  HA  THR A  51      -0.729   5.260 -10.557  1.00  1.270          H  
ATOM    795  HB  THR A  51      -3.328   3.620 -10.453  1.00  1.710          H  
ATOM    796  HG1 THR A  51      -1.622   2.265 -10.850  1.00  1.710          H  
ATOM    797 1HG2 THR A  51      -3.583   4.340 -12.800  1.00  1.710          H  
ATOM    798 2HG2 THR A  51      -3.560   5.750 -11.723  1.00  1.710          H  
ATOM    799 3HG2 THR A  51      -2.112   5.330 -12.665  1.00  1.710          H  
ATOM    800  N   LEU A  52      -3.273   5.631  -8.495  1.00  1.120          N  
ATOM    801  CA  LEU A  52      -4.207   6.552  -7.868  1.00  1.310          C  
ATOM    802  C   LEU A  52      -3.537   7.602  -6.981  1.00  1.390          C  
ATOM    803  O   LEU A  52      -4.190   8.552  -6.543  1.00  1.540          O  
ATOM    804  CB  LEU A  52      -5.201   5.736  -7.036  1.00  1.760          C  
ATOM    805  CG  LEU A  52      -6.155   4.775  -7.827  1.00  1.760          C  
ATOM    806  CD1 LEU A  52      -6.912   3.908  -6.830  1.00  1.760          C  
ATOM    807  CD2 LEU A  52      -7.131   5.561  -8.696  1.00  1.760          C  
ATOM    808  H   LEU A  52      -3.334   4.635  -8.251  1.00  1.340          H  
ATOM    809  HA  LEU A  52      -4.731   7.084  -8.655  1.00  1.570          H  
ATOM    810 1HB  LEU A  52      -4.622   5.121  -6.341  1.00  2.110          H  
ATOM    811 2HB  LEU A  52      -5.813   6.422  -6.453  1.00  2.110          H  
ATOM    812  HG  LEU A  52      -5.572   4.125  -8.468  1.00  2.110          H  
ATOM    813 1HD1 LEU A  52      -7.562   3.221  -7.377  1.00  2.110          H  
ATOM    814 2HD1 LEU A  52      -6.200   3.336  -6.238  1.00  2.110          H  
ATOM    815 3HD1 LEU A  52      -7.511   4.537  -6.177  1.00  2.110          H  
ATOM    816 1HD2 LEU A  52      -7.775   4.853  -9.225  1.00  2.110          H  
ATOM    817 2HD2 LEU A  52      -7.739   6.211  -8.069  1.00  2.110          H  
ATOM    818 3HD2 LEU A  52      -6.596   6.159  -9.424  1.00  2.110          H  
ATOM    819  N   HIS A  53      -2.249   7.419  -6.684  1.00  1.390          N  
ATOM    820  CA  HIS A  53      -1.487   8.339  -5.866  1.00  1.620          C  
ATOM    821  C   HIS A  53      -0.333   8.984  -6.647  1.00  1.660          C  
ATOM    822  O   HIS A  53       0.555   9.597  -6.051  1.00  1.880          O  
ATOM    823  CB  HIS A  53      -0.970   7.633  -4.617  1.00  2.180          C  
ATOM    824  CG  HIS A  53      -2.055   7.220  -3.654  1.00  2.180          C  
ATOM    825  ND1 HIS A  53      -2.837   6.093  -3.827  1.00  2.180          N  
ATOM    826  CD2 HIS A  53      -2.467   7.790  -2.504  1.00  2.180          C  
ATOM    827  CE1 HIS A  53      -3.687   5.996  -2.827  1.00  2.180          C  
ATOM    828  NE2 HIS A  53      -3.485   7.014  -2.006  1.00  2.180          N  
ATOM    829  H   HIS A  53      -1.736   6.636  -7.092  1.00  1.670          H  
ATOM    830  HA  HIS A  53      -2.139   9.144  -5.533  1.00  1.940          H  
ATOM    831 1HB  HIS A  53      -0.450   6.735  -4.934  1.00  2.610          H  
ATOM    832 2HB  HIS A  53      -0.259   8.267  -4.095  1.00  2.610          H  
ATOM    833  HD1 HIS A  53      -2.641   5.326  -4.469  1.00  2.610          H  
ATOM    834  HD2 HIS A  53      -2.147   8.682  -1.967  1.00  2.610          H  
ATOM    835  HE1 HIS A  53      -4.393   5.169  -2.786  1.00  2.610          H  
ATOM    836  N   GLY A  54      -0.358   8.873  -7.985  1.00  1.520          N  
ATOM    837  CA  GLY A  54       0.665   9.496  -8.828  1.00  1.640          C  
ATOM    838  C   GLY A  54       2.001   8.749  -8.985  1.00  1.570          C  
ATOM    839  O   GLY A  54       2.997   9.363  -9.377  1.00  1.740          O  
ATOM    840  H   GLY A  54      -1.107   8.342  -8.445  1.00  1.820          H  
ATOM    841 1HA  GLY A  54       0.237   9.642  -9.820  1.00  1.970          H  
ATOM    842 2HA  GLY A  54       0.867  10.492  -8.441  1.00  1.970          H  
ATOM    843  N   MET A  55       2.040   7.450  -8.689  1.00  1.370          N  
ATOM    844  CA  MET A  55       3.265   6.663  -8.781  1.00  1.320          C  
ATOM    845  C   MET A  55       3.110   5.470  -9.705  1.00  1.190          C  
ATOM    846  O   MET A  55       2.000   5.030  -9.985  1.00  1.120          O  
ATOM    847  CB  MET A  55       3.686   6.161  -7.411  1.00  1.870          C  
ATOM    848  CG  MET A  55       4.086   7.211  -6.379  1.00  1.870          C  
ATOM    849  SD  MET A  55       5.667   8.009  -6.716  1.00  1.870          S  
ATOM    850  CE  MET A  55       6.864   6.716  -6.241  1.00  1.870          C  
ATOM    851  H   MET A  55       1.193   6.953  -8.396  1.00  1.640          H  
ATOM    852  HA  MET A  55       4.054   7.294  -9.189  1.00  1.580          H  
ATOM    853 1HB  MET A  55       2.889   5.551  -6.983  1.00  2.240          H  
ATOM    854 2HB  MET A  55       4.520   5.541  -7.570  1.00  2.240          H  
ATOM    855 1HG  MET A  55       3.311   7.981  -6.320  1.00  2.240          H  
ATOM    856 2HG  MET A  55       4.166   6.740  -5.422  1.00  2.240          H  
ATOM    857 1HE  MET A  55       7.879   7.087  -6.393  1.00  2.240          H  
ATOM    858 2HE  MET A  55       6.734   6.455  -5.186  1.00  2.240          H  
ATOM    859 3HE  MET A  55       6.721   5.832  -6.848  1.00  2.240          H  
ATOM    860  N   LYS A  56       4.229   4.951 -10.190  1.00  1.380          N  
ATOM    861  CA  LYS A  56       4.225   3.732 -10.990  1.00  1.600          C  
ATOM    862  C   LYS A  56       4.975   2.649 -10.235  1.00  1.470          C  
ATOM    863  O   LYS A  56       5.898   2.958  -9.477  1.00  1.230          O  
ATOM    864  CB  LYS A  56       4.854   3.985 -12.357  1.00  2.150          C  
ATOM    865  CG  LYS A  56       4.081   4.982 -13.211  1.00  2.150          C  
ATOM    866  CD  LYS A  56       4.727   5.169 -14.577  1.00  2.150          C  
ATOM    867  CE  LYS A  56       3.950   6.168 -15.428  1.00  2.150          C  
ATOM    868  NZ  LYS A  56       4.575   6.364 -16.769  1.00  2.150          N  
ATOM    869  H   LYS A  56       5.111   5.392  -9.969  1.00  1.660          H  
ATOM    870  HA  LYS A  56       3.199   3.394 -11.126  1.00  1.920          H  
ATOM    871 1HB  LYS A  56       5.872   4.358 -12.229  1.00  2.580          H  
ATOM    872 2HB  LYS A  56       4.918   3.045 -12.905  1.00  2.580          H  
ATOM    873 1HG  LYS A  56       3.058   4.625 -13.338  1.00  2.580          H  
ATOM    874 2HG  LYS A  56       4.047   5.943 -12.698  1.00  2.580          H  
ATOM    875 1HD  LYS A  56       5.748   5.531 -14.447  1.00  2.580          H  
ATOM    876 2HD  LYS A  56       4.762   4.213 -15.100  1.00  2.580          H  
ATOM    877 1HE  LYS A  56       2.932   5.805 -15.563  1.00  2.580          H  
ATOM    878 2HE  LYS A  56       3.916   7.127 -14.910  1.00  2.580          H  
ATOM    879 1HZ  LYS A  56       4.031   7.031 -17.300  1.00  2.580          H  
ATOM    880 2HZ  LYS A  56       5.517   6.713 -16.657  1.00  2.580          H  
ATOM    881 3HZ  LYS A  56       4.600   5.484 -17.264  1.00  2.580          H  
ATOM    882  N   CYS A  57       4.659   1.380 -10.505  1.00  1.840          N  
ATOM    883  CA  CYS A  57       5.294   0.254  -9.815  1.00  1.970          C  
ATOM    884  C   CYS A  57       6.771   0.103 -10.120  1.00  1.790          C  
ATOM    885  O   CYS A  57       7.527  -0.507  -9.353  1.00  1.830          O  
ATOM    886  CB  CYS A  57       4.590  -1.045 -10.167  1.00  2.710          C  
ATOM    887  SG  CYS A  57       4.881  -1.641 -11.846  1.00  2.710          S  
ATOM    888  H   CYS A  57       3.888   1.177 -11.150  1.00  2.210          H  
ATOM    889  HA  CYS A  57       5.214   0.423  -8.752  1.00  2.360          H  
ATOM    890 1HB  CYS A  57       4.884  -1.763  -9.507  1.00  3.250          H  
ATOM    891 2HB  CYS A  57       3.518  -0.931 -10.032  1.00  3.250          H  
ATOM    892  HG  CYS A  57       4.157  -2.764 -11.754  1.00  3.250          H  
ATOM    893  N   SER A  58       7.208   0.753 -11.182  1.00  1.780          N  
ATOM    894  CA  SER A  58       8.595   0.756 -11.599  1.00  1.710          C  
ATOM    895  C   SER A  58       9.489   1.420 -10.546  1.00  1.240          C  
ATOM    896  O   SER A  58      10.697   1.183 -10.510  1.00  1.280          O  
ATOM    897  CB  SER A  58       8.732   1.481 -12.920  1.00  2.420          C  
ATOM    898  OG  SER A  58       8.433   2.839 -12.771  1.00  2.420          O  
ATOM    899  H   SER A  58       6.526   1.253 -11.733  1.00  2.140          H  
ATOM    900  HA  SER A  58       8.918  -0.277 -11.726  1.00  2.050          H  
ATOM    901 1HB  SER A  58       9.750   1.367 -13.291  1.00  2.910          H  
ATOM    902 2HB  SER A  58       8.061   1.034 -13.651  1.00  2.910          H  
ATOM    903  HG  SER A  58       8.630   3.251 -13.619  1.00  2.910          H  
ATOM    904  N   HIS A  59       8.893   2.215  -9.644  1.00  1.090          N  
ATOM    905  CA  HIS A  59       9.652   2.893  -8.605  1.00  1.340          C  
ATOM    906  C   HIS A  59       9.630   2.141  -7.281  1.00  1.560          C  
ATOM    907  O   HIS A  59      10.239   2.587  -6.316  1.00  2.040          O  
ATOM    908  CB  HIS A  59       9.089   4.297  -8.367  1.00  1.780          C  
ATOM    909  CG  HIS A  59       9.257   5.233  -9.522  1.00  1.780          C  
ATOM    910  ND1 HIS A  59      10.483   5.762  -9.882  1.00  1.780          N  
ATOM    911  CD2 HIS A  59       8.360   5.734 -10.397  1.00  1.780          C  
ATOM    912  CE1 HIS A  59      10.325   6.553 -10.929  1.00  1.780          C  
ATOM    913  NE2 HIS A  59       9.049   6.556 -11.261  1.00  1.780          N  
ATOM    914  H   HIS A  59       7.884   2.374  -9.699  1.00  1.310          H  
ATOM    915  HA  HIS A  59      10.689   2.989  -8.918  1.00  1.610          H  
ATOM    916 1HB  HIS A  59       8.022   4.213  -8.158  1.00  2.130          H  
ATOM    917 2HB  HIS A  59       9.560   4.739  -7.489  1.00  2.130          H  
ATOM    918  HD1 HIS A  59      11.377   5.431  -9.575  1.00  2.130          H  
ATOM    919  HD2 HIS A  59       7.286   5.599 -10.508  1.00  2.130          H  
ATOM    920  HE1 HIS A  59      11.178   7.070 -11.367  1.00  2.130          H  
ATOM    921  N   PHE A  60       8.918   1.008  -7.239  1.00  1.600          N  
ATOM    922  CA  PHE A  60       8.775   0.169  -6.046  1.00  2.180          C  
ATOM    923  C   PHE A  60       9.413  -1.195  -6.285  1.00  2.130          C  
ATOM    924  O   PHE A  60       9.283  -2.109  -5.467  1.00  2.510          O  
ATOM    925  CB  PHE A  60       7.293  -0.017  -5.729  1.00  2.820          C  
ATOM    926  CG  PHE A  60       6.539   1.194  -5.299  1.00  2.820          C  
ATOM    927  CD1 PHE A  60       6.167   2.129  -6.219  1.00  2.820          C  
ATOM    928  CD2 PHE A  60       6.127   1.379  -3.970  1.00  2.820          C  
ATOM    929  CE1 PHE A  60       5.460   3.216  -5.859  1.00  2.820          C  
ATOM    930  CE2 PHE A  60       5.395   2.498  -3.608  1.00  2.820          C  
ATOM    931  CZ  PHE A  60       5.071   3.423  -4.562  1.00  2.820          C  
ATOM    932  H   PHE A  60       8.450   0.680  -8.086  1.00  1.920          H  
ATOM    933  HA  PHE A  60       9.280   0.644  -5.207  1.00  2.620          H  
ATOM    934 1HB  PHE A  60       6.819  -0.370  -6.614  1.00  3.380          H  
ATOM    935 2HB  PHE A  60       7.195  -0.766  -4.976  1.00  3.380          H  
ATOM    936  HD1 PHE A  60       6.444   2.001  -7.255  1.00  3.380          H  
ATOM    937  HD2 PHE A  60       6.384   0.634  -3.224  1.00  3.380          H  
ATOM    938  HE1 PHE A  60       5.207   3.898  -6.610  1.00  3.380          H  
ATOM    939  HE2 PHE A  60       5.077   2.637  -2.584  1.00  3.380          H  
ATOM    940  HZ  PHE A  60       4.502   4.303  -4.305  1.00  3.380          H  
ATOM    941  N   LYS A  61      10.103  -1.300  -7.423  1.00  2.220          N  
ATOM    942  CA  LYS A  61      10.759  -2.506  -7.921  1.00  2.310          C  
ATOM    943  C   LYS A  61       9.843  -3.719  -8.138  1.00  2.210          C  
ATOM    944  O   LYS A  61      10.191  -4.838  -7.756  1.00  2.410          O  
ATOM    945  CB  LYS A  61      11.943  -2.885  -7.022  1.00  3.200          C  
ATOM    946  CG  LYS A  61      13.060  -1.831  -7.001  1.00  3.200          C  
ATOM    947  CD  LYS A  61      14.276  -2.295  -6.184  1.00  3.200          C  
ATOM    948  CE  LYS A  61      15.528  -1.419  -6.454  1.00  3.200          C  
ATOM    949  NZ  LYS A  61      15.420  -0.014  -5.907  1.00  3.200          N  
ATOM    950  H   LYS A  61      10.166  -0.462  -7.985  1.00  2.660          H  
ATOM    951  HA  LYS A  61      11.171  -2.260  -8.900  1.00  2.770          H  
ATOM    952 1HB  LYS A  61      11.600  -3.041  -5.998  1.00  3.840          H  
ATOM    953 2HB  LYS A  61      12.375  -3.822  -7.369  1.00  3.840          H  
ATOM    954 1HG  LYS A  61      13.364  -1.608  -8.022  1.00  3.840          H  
ATOM    955 2HG  LYS A  61      12.665  -0.917  -6.548  1.00  3.840          H  
ATOM    956 1HD  LYS A  61      14.031  -2.229  -5.121  1.00  3.840          H  
ATOM    957 2HD  LYS A  61      14.505  -3.331  -6.423  1.00  3.840          H  
ATOM    958 1HE  LYS A  61      16.397  -1.901  -6.011  1.00  3.840          H  
ATOM    959 2HE  LYS A  61      15.672  -1.359  -7.532  1.00  3.840          H  
ATOM    960 1HZ  LYS A  61      16.252   0.499  -6.123  1.00  3.840          H  
ATOM    961 2HZ  LYS A  61      14.621   0.459  -6.309  1.00  3.840          H  
ATOM    962 3HZ  LYS A  61      15.301  -0.020  -4.879  1.00  3.840          H  
ATOM    963  N   LEU A  62       8.707  -3.518  -8.819  1.00  2.090          N  
ATOM    964  CA  LEU A  62       7.814  -4.645  -9.093  1.00  2.320          C  
ATOM    965  C   LEU A  62       7.949  -5.208 -10.511  1.00  2.140          C  
ATOM    966  O   LEU A  62       8.270  -4.471 -11.444  1.00  1.750          O  
ATOM    967  CB  LEU A  62       6.345  -4.229  -9.036  1.00  3.160          C  
ATOM    968  CG  LEU A  62       5.641  -4.190  -7.719  1.00  3.160          C  
ATOM    969  CD1 LEU A  62       6.071  -3.000  -6.942  1.00  3.160          C  
ATOM    970  CD2 LEU A  62       4.127  -4.185  -7.931  1.00  3.160          C  
ATOM    971  H   LEU A  62       8.444  -2.568  -9.102  1.00  2.510          H  
ATOM    972  HA  LEU A  62       8.002  -5.384  -8.333  1.00  2.780          H  
ATOM    973 1HB  LEU A  62       6.328  -3.259  -9.447  1.00  3.790          H  
ATOM    974 2HB  LEU A  62       5.775  -4.878  -9.694  1.00  3.790          H  
ATOM    975  HG  LEU A  62       5.894  -5.056  -7.183  1.00  3.790          H  
ATOM    976 1HD1 LEU A  62       5.557  -2.973  -5.999  1.00  3.790          H  
ATOM    977 2HD1 LEU A  62       7.134  -3.035  -6.762  1.00  3.790          H  
ATOM    978 3HD1 LEU A  62       5.834  -2.129  -7.499  1.00  3.790          H  
ATOM    979 1HD2 LEU A  62       3.659  -4.213  -6.979  1.00  3.790          H  
ATOM    980 2HD2 LEU A  62       3.798  -3.317  -8.463  1.00  3.790          H  
ATOM    981 3HD2 LEU A  62       3.828  -5.048  -8.486  1.00  3.790          H  
ATOM    982  N   PRO A  63       7.759  -6.528 -10.685  1.00  2.750          N  
ATOM    983  CA  PRO A  63       7.548  -7.217 -11.948  1.00  3.060          C  
ATOM    984  C   PRO A  63       6.251  -6.686 -12.545  1.00  3.000          C  
ATOM    985  O   PRO A  63       5.397  -6.211 -11.796  1.00  2.810          O  
ATOM    986  CB  PRO A  63       7.426  -8.688 -11.537  1.00  4.590          C  
ATOM    987  CG  PRO A  63       8.135  -8.782 -10.204  1.00  4.590          C  
ATOM    988  CD  PRO A  63       7.925  -7.439  -9.536  1.00  4.590          C  
ATOM    989  HA  PRO A  63       8.400  -7.040 -12.621  1.00  3.670          H  
ATOM    990 1HB  PRO A  63       6.373  -8.968 -11.496  1.00  5.510          H  
ATOM    991 2HB  PRO A  63       7.885  -9.326 -12.305  1.00  5.510          H  
ATOM    992 1HG  PRO A  63       7.713  -9.615  -9.617  1.00  5.510          H  
ATOM    993 2HG  PRO A  63       9.200  -9.012 -10.357  1.00  5.510          H  
ATOM    994 1HD  PRO A  63       7.050  -7.430  -8.899  1.00  5.510          H  
ATOM    995 2HD  PRO A  63       8.856  -7.210  -8.983  1.00  5.510          H  
ATOM    996  N   ASP A  64       6.088  -6.734 -13.862  1.00  3.350          N  
ATOM    997  CA  ASP A  64       4.816  -6.288 -14.419  1.00  3.610          C  
ATOM    998  C   ASP A  64       3.790  -7.415 -14.269  1.00  3.590          C  
ATOM    999  O   ASP A  64       4.130  -8.510 -13.820  1.00  4.280          O  
ATOM   1000  CB  ASP A  64       5.002  -5.880 -15.891  1.00  4.950          C  
ATOM   1001  CG  ASP A  64       3.949  -4.880 -16.426  1.00  4.950          C  
ATOM   1002  OD1 ASP A  64       2.863  -4.831 -15.881  1.00  4.950          O  
ATOM   1003  OD2 ASP A  64       4.246  -4.190 -17.366  1.00  4.950          O  
ATOM   1004  H   ASP A  64       6.812  -7.097 -14.465  1.00  4.020          H  
ATOM   1005  HA  ASP A  64       4.467  -5.421 -13.855  1.00  4.330          H  
ATOM   1006 1HB  ASP A  64       5.991  -5.437 -16.016  1.00  5.940          H  
ATOM   1007 2HB  ASP A  64       4.967  -6.776 -16.513  1.00  5.940          H  
ATOM   1008  N   TYR A  65       2.560  -7.177 -14.697  1.00  3.120          N  
ATOM   1009  CA  TYR A  65       1.492  -8.158 -14.541  1.00  3.180          C  
ATOM   1010  C   TYR A  65       1.230  -9.016 -15.794  1.00  2.940          C  
ATOM   1011  O   TYR A  65       0.900  -8.467 -16.846  1.00  2.970          O  
ATOM   1012  CB  TYR A  65       0.228  -7.412 -14.125  1.00  4.430          C  
ATOM   1013  CG  TYR A  65      -1.015  -8.240 -13.931  1.00  4.430          C  
ATOM   1014  CD1 TYR A  65      -1.061  -9.215 -12.962  1.00  4.430          C  
ATOM   1015  CD2 TYR A  65      -2.144  -7.965 -14.684  1.00  4.430          C  
ATOM   1016  CE1 TYR A  65      -2.227  -9.915 -12.733  1.00  4.430          C  
ATOM   1017  CE2 TYR A  65      -3.309  -8.661 -14.456  1.00  4.430          C  
ATOM   1018  CZ  TYR A  65      -3.364  -9.628 -13.475  1.00  4.430          C  
ATOM   1019  OH  TYR A  65      -4.567 -10.300 -13.259  1.00  4.430          O  
ATOM   1020  H   TYR A  65       2.369  -6.255 -15.096  1.00  3.740          H  
ATOM   1021  HA  TYR A  65       1.779  -8.774 -13.702  1.00  3.820          H  
ATOM   1022 1HB  TYR A  65       0.425  -6.888 -13.186  1.00  5.310          H  
ATOM   1023 2HB  TYR A  65       0.009  -6.648 -14.872  1.00  5.310          H  
ATOM   1024  HD1 TYR A  65      -0.179  -9.422 -12.371  1.00  5.310          H  
ATOM   1025  HD2 TYR A  65      -2.116  -7.187 -15.446  1.00  5.310          H  
ATOM   1026  HE1 TYR A  65      -2.253 -10.671 -11.969  1.00  5.310          H  
ATOM   1027  HE2 TYR A  65      -4.198  -8.434 -15.044  1.00  5.310          H  
ATOM   1028  HH  TYR A  65      -4.567 -10.777 -12.391  1.00  5.310          H  
ATOM   1029  N   PRO A  66       1.405 -10.354 -15.727  1.00  3.120          N  
ATOM   1030  CA  PRO A  66       1.194 -11.304 -16.806  1.00  3.430          C  
ATOM   1031  C   PRO A  66      -0.288 -11.560 -17.004  1.00  3.590          C  
ATOM   1032  O   PRO A  66      -1.068 -11.388 -16.072  1.00  3.950          O  
ATOM   1033  CB  PRO A  66       1.908 -12.554 -16.297  1.00  5.150          C  
ATOM   1034  CG  PRO A  66       1.780 -12.466 -14.805  1.00  5.150          C  
ATOM   1035  CD  PRO A  66       1.869 -10.996 -14.476  1.00  5.150          C  
ATOM   1036  HA  PRO A  66       1.655 -10.920 -17.727  1.00  4.120          H  
ATOM   1037 1HB  PRO A  66       1.420 -13.455 -16.711  1.00  6.170          H  
ATOM   1038 2HB  PRO A  66       2.953 -12.561 -16.642  1.00  6.170          H  
ATOM   1039 1HG  PRO A  66       0.819 -12.874 -14.503  1.00  6.170          H  
ATOM   1040 2HG  PRO A  66       2.557 -13.067 -14.312  1.00  6.170          H  
ATOM   1041 1HD  PRO A  66       1.178 -10.818 -13.660  1.00  6.170          H  
ATOM   1042 2HD  PRO A  66       2.910 -10.709 -14.233  1.00  6.170          H  
ATOM   1043  N   LEU A  67      -0.664 -12.068 -18.171  1.00  3.760          N  
ATOM   1044  CA  LEU A  67      -2.039 -12.507 -18.362  1.00  4.120          C  
ATOM   1045  C   LEU A  67      -2.284 -13.816 -17.617  1.00  4.560          C  
ATOM   1046  O   LEU A  67      -1.561 -14.796 -17.804  1.00  4.970          O  
ATOM   1047  CB  LEU A  67      -2.348 -12.689 -19.856  1.00  5.620          C  
ATOM   1048  CG  LEU A  67      -3.798 -13.153 -20.230  1.00  5.620          C  
ATOM   1049  CD1 LEU A  67      -4.826 -12.079 -19.844  1.00  5.620          C  
ATOM   1050  CD2 LEU A  67      -3.851 -13.429 -21.731  1.00  5.620          C  
ATOM   1051  H   LEU A  67       0.005 -12.169 -18.922  1.00  4.510          H  
ATOM   1052  HA  LEU A  67      -2.695 -11.745 -17.945  1.00  4.940          H  
ATOM   1053 1HB  LEU A  67      -2.164 -11.742 -20.360  1.00  6.750          H  
ATOM   1054 2HB  LEU A  67      -1.655 -13.428 -20.258  1.00  6.750          H  
ATOM   1055  HG  LEU A  67      -4.045 -14.069 -19.685  1.00  6.750          H  
ATOM   1056 1HD1 LEU A  67      -5.824 -12.426 -20.117  1.00  6.750          H  
ATOM   1057 2HD1 LEU A  67      -4.803 -11.895 -18.777  1.00  6.750          H  
ATOM   1058 3HD1 LEU A  67      -4.607 -11.155 -20.376  1.00  6.750          H  
ATOM   1059 1HD2 LEU A  67      -4.853 -13.764 -22.004  1.00  6.750          H  
ATOM   1060 2HD2 LEU A  67      -3.612 -12.518 -22.282  1.00  6.750          H  
ATOM   1061 3HD2 LEU A  67      -3.128 -14.205 -21.983  1.00  6.750          H  
ATOM   1062  N   LEU A  68      -3.297 -13.812 -16.764  1.00  4.870          N  
ATOM   1063  CA  LEU A  68      -3.665 -14.951 -15.938  1.00  5.600          C  
ATOM   1064  C   LEU A  68      -5.032 -15.495 -16.304  1.00  5.320          C  
ATOM   1065  O   LEU A  68      -5.854 -14.787 -16.884  1.00  5.550          O  
ATOM   1066  CB  LEU A  68      -3.640 -14.520 -14.481  1.00  7.550          C  
ATOM   1067  CG  LEU A  68      -2.300 -13.940 -13.996  1.00  7.550          C  
ATOM   1068  CD1 LEU A  68      -2.488 -13.414 -12.653  1.00  7.550          C  
ATOM   1069  CD2 LEU A  68      -1.212 -15.011 -14.003  1.00  7.550          C  
ATOM   1070  H   LEU A  68      -3.835 -12.962 -16.670  1.00  5.840          H  
ATOM   1071  HA  LEU A  68      -2.948 -15.749 -16.102  1.00  6.720          H  
ATOM   1072 1HB  LEU A  68      -4.404 -13.757 -14.335  1.00  9.060          H  
ATOM   1073 2HB  LEU A  68      -3.888 -15.376 -13.854  1.00  9.060          H  
ATOM   1074  HG  LEU A  68      -2.002 -13.118 -14.632  1.00  9.060          H  
ATOM   1075 1HD1 LEU A  68      -1.588 -12.984 -12.318  1.00  9.060          H  
ATOM   1076 2HD1 LEU A  68      -3.242 -12.654 -12.691  1.00  9.060          H  
ATOM   1077 3HD1 LEU A  68      -2.796 -14.189 -11.982  1.00  9.060          H  
ATOM   1078 1HD2 LEU A  68      -0.286 -14.593 -13.634  1.00  9.060          H  
ATOM   1079 2HD2 LEU A  68      -1.507 -15.820 -13.367  1.00  9.060          H  
ATOM   1080 3HD2 LEU A  68      -1.050 -15.384 -15.010  1.00  9.060          H  
ATOM   1081  N   MET A  69      -5.285 -16.751 -15.944  1.00  5.080          N  
ATOM   1082  CA  MET A  69      -6.586 -17.355 -16.198  1.00  5.010          C  
ATOM   1083  C   MET A  69      -7.693 -16.627 -15.463  1.00  4.690          C  
ATOM   1084  O   MET A  69      -7.571 -16.313 -14.272  1.00  4.540          O  
ATOM   1085  CB  MET A  69      -6.615 -18.803 -15.715  1.00  7.040          C  
ATOM   1086  CG  MET A  69      -5.708 -19.765 -16.442  1.00  7.040          C  
ATOM   1087  SD  MET A  69      -5.907 -21.482 -15.861  1.00  7.040          S  
ATOM   1088  CE  MET A  69      -5.206 -21.457 -14.201  1.00  7.040          C  
ATOM   1089  H   MET A  69      -4.562 -17.283 -15.484  1.00  6.100          H  
ATOM   1090  HA  MET A  69      -6.794 -17.307 -17.266  1.00  6.010          H  
ATOM   1091 1HB  MET A  69      -6.346 -18.817 -14.674  1.00  8.450          H  
ATOM   1092 2HB  MET A  69      -7.636 -19.183 -15.789  1.00  8.450          H  
ATOM   1093 1HG  MET A  69      -5.928 -19.732 -17.509  1.00  8.450          H  
ATOM   1094 2HG  MET A  69      -4.670 -19.472 -16.302  1.00  8.450          H  
ATOM   1095 1HE  MET A  69      -5.270 -22.457 -13.768  1.00  8.450          H  
ATOM   1096 2HE  MET A  69      -4.161 -21.150 -14.251  1.00  8.450          H  
ATOM   1097 3HE  MET A  69      -5.758 -20.772 -13.582  1.00  8.450          H  
ATOM   1098  N   ASN A  70      -8.835 -16.463 -16.129  1.00  5.030          N  
ATOM   1099  CA  ASN A  70      -9.999 -15.855 -15.494  1.00  5.140          C  
ATOM   1100  C   ASN A  70     -10.755 -16.932 -14.729  1.00  5.220          C  
ATOM   1101  O   ASN A  70     -11.838 -17.361 -15.132  1.00  5.880          O  
ATOM   1102  CB  ASN A  70     -10.895 -15.177 -16.517  1.00  7.150          C  
ATOM   1103  CG  ASN A  70     -11.958 -14.320 -15.875  1.00  7.150          C  
ATOM   1104  OD1 ASN A  70     -11.837 -13.956 -14.698  1.00  7.150          O  
ATOM   1105  ND2 ASN A  70     -12.987 -13.990 -16.621  1.00  7.150          N  
ATOM   1106  H   ASN A  70      -8.884 -16.741 -17.098  1.00  6.040          H  
ATOM   1107  HA  ASN A  70      -9.661 -15.113 -14.769  1.00  6.170          H  
ATOM   1108 1HB  ASN A  70     -10.287 -14.552 -17.171  1.00  8.580          H  
ATOM   1109 2HB  ASN A  70     -11.377 -15.931 -17.139  1.00  8.580          H  
ATOM   1110 1HD2 ASN A  70     -13.719 -13.422 -16.243  1.00  8.580          H  
ATOM   1111 2HD2 ASN A  70     -13.041 -14.310 -17.566  1.00  8.580          H  
ATOM   1112  N   ALA A  71     -10.133 -17.389 -13.657  1.00  4.890          N  
ATOM   1113  CA  ALA A  71     -10.636 -18.476 -12.843  1.00  5.420          C  
ATOM   1114  C   ALA A  71     -10.808 -18.032 -11.394  1.00  6.410          C  
ATOM   1115  O   ALA A  71     -11.412 -18.742 -10.598  1.00  7.220          O  
ATOM   1116  OXT ALA A  71     -10.398 -16.932 -11.024  1.00  8.130          O  
ATOM   1117  CB  ALA A  71      -9.688 -19.667 -12.946  1.00  7.000          C  
ATOM   1118  H   ALA A  71      -9.234 -16.947 -13.448  1.00  5.870          H  
ATOM   1119  HA  ALA A  71     -11.615 -18.768 -13.222  1.00  6.500          H  
ATOM   1120 1HB  ALA A  71     -10.074 -20.496 -12.356  1.00  8.400          H  
ATOM   1121 2HB  ALA A  71      -9.605 -19.973 -13.989  1.00  8.400          H  
ATOM   1122 3HB  ALA A  71      -8.719 -19.386 -12.581  1.00  8.400          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 -400.806 46.9637 288.763 -24.6815 7.31951 17.4906 144.186 -159.715 -0.61697 -4.29153 -131.144 -16.8405 -50.7153 -4.1362 -6.38463 -6.38477 0 0.70772 5.55394 31.7795 73.913 -7.44261 4.26882 0.75494 7.50154 68.6102 -115.346
CYS:NtermProteinFull_1 -6.92555 0.86508 3.21231 -0.03818 0.00014 0.00901 1.80345 -1.99841 -0.07722 -0.36507 -0.99016 0.72097 0 0 0 0 0 0.12093 0.00156 0.29482 0 0 0 3.6196 0 0.34677 0.60005
VAL_2 -7.3094 1.30109 1.31273 -0.36998 0.31677 0.08763 0.9435 -1.69205 -0 -0 0.55573 -0.02444 0 0 0 0 0 -0.15965 0.03114 0.59439 0 0.36746 0 1.9342 0.05761 0.85674 -1.19654
PHE_3 -3.21694 0.31029 2.64121 -0.93301 0.16458 0.45454 0.62215 -1.50662 -0.05121 -0.16461 0.35403 -0.61238 0 0 0 0 0 -0.0418 0.0918 0 2.74112 0.20388 0 1.0402 0.01179 0.5944 2.70341
GLY_4 -2.01853 0.28808 1.87119 -7e-05 0 0 0.89338 -1.0157 -0 -0 -0.30382 -0.31824 0 0 0 0 0 -0.08868 0 0 0 -0.4132 0 0.83697 1.37131 0.14319 1.24587
CYS_5 -4.07979 0.75986 3.09589 -0.17088 0.22122 0.08248 2.04614 -1.77433 -0.00659 -0.03069 -0.64166 -1.69227 0 0 0 0 0 0.21132 0.18907 0.19969 0 -0.37306 0 3.6196 2.55543 0.80785 5.01928
PRO_6 -4.64192 0.82952 2.0076 -0.06651 0 0.04166 1.43587 -1.24737 -0 -0 -1.0541 0.59112 0 0 0 0 0 -0.10897 0.02702 0.17628 0 -0.75142 0 -2.4119 1.38157 1.05635 -2.7352
SER_7 -1.90241 0.16137 1.89792 -0.03055 0.0009 0.05067 0.8842 -0.96815 -0 -0 0.18577 -0.96688 0 0 0 0 0 -0.09502 0.00565 0.1399 0 -0.42104 0.62266 -0.77834 0.20359 0.4585 -0.55127
ALA_8 -4.39219 0.6433 3.65793 -0.02953 0.01452 0 2.94995 -2.19701 -0.00686 -0.03451 -3.03489 -0.4627 0 0 0 0 0 0.03831 0 0 0 0.49551 0 1.8394 0.16614 0.41438 0.06177
ALA_9 -6.27454 1.35694 3.35983 -0.0218 1e-05 0 2.80047 -2.73182 -0.01615 -0.09961 -2.1424 -0.3241 0 0 0 0 0 -0.07763 0 0 0 -0.11898 0 1.8394 0.40302 0.83752 -1.20982
ASP_10 -3.98922 0.28017 6.43686 -0.10508 0.00168 0.3111 2.50363 -2.66882 -0 -0 -3.63213 -0.49787 0 0 0 -0.59794 0 -0.03956 0.04574 0 1.78462 0.14816 0 -2.3716 0.02874 0.90961 -1.45191
LYS_11 -3.92992 0.37958 4.70155 -0.30214 0.02787 0.14173 2.39857 -2.23092 -0 -0 -2.14285 -0.12428 0 0 0 0 0 -0.04817 0.00066 1.99921 0 -0.161 0 -1.5107 -0.25696 0.46813 -0.58964
LEU_12 -10.138 1.32765 5.07282 -0.50809 0.21385 0.11594 2.85107 -3.55756 -0.01585 -0.1519 -2.00722 0.22343 0 0 0 0 0 0.05912 0.08619 0.32833 0 -0.27475 0 0.18072 -0.25604 0.64168 -5.80855
TRP_13 -11.8566 1.5515 6.08327 -1.00375 0.19413 0.58936 2.94007 -3.64208 -0.00035 -0.00485 -2.57247 -0.5465 0 0 0 0 0 -0.00099 0.00012 0 3.3423 -0.29846 0 1.6906 0.07872 0.93327 -2.52266
ASP_14 -4.32128 0.14507 6.02009 -0.1096 0.01357 0.33988 2.33374 -2.62887 -0.00276 -0.0293 -2.47656 -0.36176 0 0 0 -0.3555 0 -0.06601 0.11887 0 1.70096 0.04903 0 -2.3716 0.05785 0.61546 -1.32873
GLU_15 -4.13855 0.27568 5.26166 -0.33501 0.08372 0.36725 2.09924 -2.34491 -0.01585 -0.1519 -1.3171 -0.57309 0 0 0 -0.76902 0 -0.03178 0.07628 0 4.1035 -0.13612 0 -2.7348 -0.38298 0.31533 -0.34845
ASN_16 -7.21662 0.67217 7.52032 -0.22872 0.06464 0.32099 3.53436 -3.5768 -0.02619 -0.20329 -3.71951 -0.46494 0 0 0 -0.76902 0 -0.02394 0.12076 0 2.44751 -0.24689 0 -0.93687 -0.26407 0.52393 -2.47217
LYS_17 -7.51249 0.75551 7.44052 -0.52813 0.187 0.23071 3.9 -3.32342 -0 -0 -4.89334 0.05251 0 0 0 -0.3555 0 -0.02598 0.22419 2.42297 0 -0.06151 0 -1.5107 0.12753 0.77728 -2.09286
SER_18 -3.4844 0.19055 3.85362 -0.03052 0.00071 0.05108 1.21207 -1.89057 -7e-05 -0.00105 -0.35999 -1.01601 0 0 0 0 0 -0.0408 0.00391 0.1864 0 -0.2979 0.60139 -0.77834 -0.14011 0.48524 -1.45477
HIS_D_19 -5.23622 0.23875 5.3197 -0.40715 0.07783 0.43372 2.61636 -2.64729 -0 -0 -1.72249 -0.53248 0 0 0 0 0 -0.00188 0.16853 0 2.77949 -0.07922 0 -0.45461 -0.32197 0.32038 0.55145
PHE_20 -8.04807 0.94109 3.57384 -0.55576 0.06676 0.25166 2.19214 -2.52942 -0 -0 -1.54297 0.10703 0 0 0 0 0 -0.00569 0.01798 0 3.01986 -0.04271 0 1.0402 0.00368 0.4016 -1.10879
ILE_21 -8.79966 0.98739 4.89746 -0.52229 0.45132 0.10491 2.75968 -3.01053 -0.00018 -0.00283 -2.65607 0.00269 0 0 0 0 0 -0.03737 0.01212 0.51938 0 -0.4597 0 0.73287 0.00984 0.47278 -4.5382
GLU_22 -5.52242 0.44513 6.13155 -0.35651 0.12322 0.41536 3.01592 -2.87345 -0 -0 -2.74957 -0.58303 0 0 0 -0.84253 0 -0.00539 0.03647 0 3.24739 -0.17363 0 -2.7348 -0.21271 0.59496 -2.04406
ASP_23 -4.77592 0.54517 7.24848 -0.21098 0.00077 0.68836 3.19936 -3.15022 -0.01314 -0.03582 -5.81623 -0.12666 0 0 0 0 0 0.06587 0.03835 0 3.20803 0.23616 0 -2.3716 -0.30085 0.50536 -1.06552
PHE_24 -9.35114 0.89479 5.82198 -0.64964 0.06978 0.2965 2.80894 -3.37074 -0 -0 -2.26092 -0.01869 0 0 0 0 0 0.01757 0.03861 0 2.30414 0.07517 0 1.0402 -0.13747 0.41757 -2.00335
CYS_25 -6.41578 0.64088 5.23858 -0.05042 0 0.01678 2.82564 -2.58348 -0 -0 -3.60107 0.00183 0 0 0 0 0 -0.01748 0.02103 0.30383 0 0.25836 0 3.6196 0.11481 0.45137 0.82449
TRP_26 -7.13808 0.44256 6.66405 -1.04655 0.16679 0.33266 2.9957 -3.24284 -0 -0 -3.64453 -0.48197 0 0 0 -0.84253 0 -0.00536 0.19302 0 1.92195 -0.00364 0 1.6906 0.09093 0.46607 -1.44116
LYS_27 -5.7725 0.6148 7.98621 -0.34945 0.03862 0.19182 3.25581 -3.3704 -0.01314 -0.03582 -5.93313 0.33503 0 0 0 0 0 -0.01584 0.05285 2.3682 0 0.04231 0 -1.5107 -0.18483 0.36592 -1.93423
LEU_28 -9.45144 0.67221 5.75395 -0.49273 0.20433 0.11025 2.6075 -3.66764 -0 -0 -2.43214 0.24435 0 0 0 0 0 -0.00667 0.05224 0.36429 0 -0.27741 0 0.18072 -0.23224 0.31162 -6.05882
HIS_29 -4.72892 0.241 4.81414 -0.64455 0.01074 0.62681 1.94973 -2.33554 -0 -0 -1.67263 -0.38281 0 0 0 0 0 0.03936 0.05733 0 1.50949 -0.34751 0 -0.45461 0.09309 0.31853 -0.90634
ARG_30 -4.45253 0.24582 4.36993 -0.54028 0.10879 0.29211 1.36357 -2.0663 -0 -0 -0.97007 0.29213 0 0 0 0 0 -0.0455 0.21143 1.92372 0 -0.16001 0 -1.2888 -0.03119 0.38644 -0.36075
ARG_31 -5.75897 0.63803 6.5748 -0.75524 0.25703 0.56459 2.32408 -2.76325 -0 -0 -2.35064 0.52824 0 0 -0.75309 0 0 0.14551 0.42549 3.12836 0 -0.03938 0 -1.2888 -0.55938 0.77853 1.0959
GLU_32 -2.52161 0.13961 2.95447 -0.22684 0.03229 0.36885 1.23963 -1.37319 -0 -0 -0.84407 -0.51042 0 0 0 0 0 0.04348 0.0166 0 2.676 -0.01 0 -2.7348 -0.25606 0.68142 -0.32463
GLY_33 -3.76709 0.58255 3.04816 -0.00022 0 0 1.311 -1.71429 -0.00883 -0.09673 -2.76541 -0.17015 0 0 0 0 0 -0.10829 0 0 0 -1.27159 0 0.83697 0.23122 0.2454 -3.64729
ALA_34 -4.30442 0.46488 2.11055 -0.03063 0.01259 0 1.61918 -1.82057 -0.01239 -0.07359 -1.61596 -0.49298 0 0 0 0 0 -0.01107 0 0 0 -0.11191 0 1.8394 0.48376 0.20458 -1.73858
CYS_35 -4.06014 0.42041 2.37973 -0.0563 0.0001 0.01704 0.87924 -1.37868 -0.00883 -0.09673 -1.03222 0.05166 0 0 0 0 0 -0.04298 0.04226 0.45571 0 0.09616 0 3.6196 -0.03486 9.29462 10.5458
VAL_36 -2.19243 0.18743 1.91537 -0.33197 0.55334 0.07588 0.70111 -1.05914 -0 -0 0.02758 -0.2468 0 0 0 0 0 0.12381 0.00775 0.17985 0 4.39719 0 1.9342 5.21427 14.8839 26.3713
ASN_37 -5.76977 0.46274 4.34168 -0.19744 0.06201 0.31376 2.62886 -2.49635 -0 -0 -2.74419 -0.45016 0 0 0 0 0 -0.02243 0.00032 0 2.08692 -0.57956 0 -0.93687 5.27743 5.90929 7.88623
CYS_38 -7.40505 0.7498 3.87726 -0.06002 0.00083 0.0341 1.93899 -2.23101 -0.01239 -0.07359 -0.95798 -0.32869 0 0 0 0 0 -0.01349 0.20446 0.80851 0 0.32684 0 3.6196 -0.3119 0.4131 0.57937
GLU_39 -4.98021 0.56751 3.29561 -0.22253 0.02995 0.31247 1.42544 -1.89801 -0 -0 -0.67212 -0.61968 0 0 0 0 0 -0.03264 0.00715 0 3.02876 -0.33103 0 -2.7348 -0.33315 0.24445 -2.91281
MET_40 -7.98587 1.01637 4.61476 -0.69852 0.19743 0.32636 2.18968 -2.49834 -0 -0 -1.23814 -0.17028 0 0 0 0 0 0.12141 0.02952 2.18208 0 0.05298 0 0.60916 -0.1561 0.32597 -1.08155
HIS_41 -8.6256 0.78575 5.85132 -0.3741 0.00915 0.42665 2.87044 -3.41326 -0.01982 -0.19164 -2.89787 -0.39657 0 0 0 -0.6274 0 0.14491 0.02256 0 2.36217 0.1157 0 -0.45461 -0.01229 0.52485 -3.89965
ALA_42 -6.649 0.82564 4.67934 -0.0209 0 0 2.82581 -3.07446 -4e-05 -0.00023 -2.19388 -0.35401 0 0 0 0 0 -0.02234 0 0 0 -0.29352 0 1.8394 -0.40556 0.69832 -2.14543
LEU_43 -9.2258 1.0051 4.30349 -0.49185 0.13793 0.1125 2.87038 -2.90145 -0 -0 -2.0603 0.23836 0 0 0 0 0 -0.06834 0.08465 0.35577 0 -0.24481 0 0.18072 -0.40333 0.88643 -5.22054
ASN_44 -5.59412 0.57867 5.44673 -0.30689 0.0056 0.58423 2.46979 -2.71984 -0.00722 -0.06808 -1.83468 -0.13352 0 0 0 0 0 -0.01147 0.05181 0 2.72234 0.46714 0 -0.93687 0.08569 0.55668 1.356
GLU_45 -5.75121 0.47188 5.20967 -0.55415 0.10515 1.00463 2.51211 -2.57039 -0 -0 -2.28019 -0.77001 0 0 0 0 0 0.20907 0.26597 0 3.56423 -0.32976 0 -2.7348 -0.07645 0.25132 -1.47294
ILE_46 -9.85512 2.20016 3.966 -0.64957 0.72793 0.13179 3.04995 -3.15185 -0 -0 -2.19455 0.43671 0 0 0 0 0 0.07254 0.4043 0.59126 0 -0.44527 0 0.73287 -0.27217 0.80905 -3.44596
GLN_47 -7.57155 0.34977 7.73068 -0.89833 0.11481 1.03487 4.40066 -3.68161 -0.00983 -0.11692 -5.16425 -0.96497 0 0 -0.98308 0 0 -0.01496 0.44549 0 2.83694 -0.23099 0 -0.18838 -0.15897 1.0822 -1.98842
GLU_48 -5.38187 0.40946 6.04329 -0.57308 0.10675 1.02511 2.60374 -2.81538 -0 -0 -2.31557 -0.70747 0 0 0 0 0 -0.02189 0.00567 0 3.57946 -0.15643 0 -2.7348 -0.3651 0.72205 -0.57606
VAL_49 -6.65079 0.63948 3.75563 -0.26053 0.09159 0.04272 2.68856 -2.72684 -0 -0 -1.99391 0.23752 0 0 -0.62693 0 0 0.00012 0.0048 0.80067 0 0.04715 0 1.9342 -0.2984 0.81362 -1.50135
PHE_50 -13.6135 2.49009 4.28335 -0.60464 0.34445 0.28678 3.35549 -3.85587 -0 -0 -2.44151 -0.21072 0 0 0 0 0 -0.02957 0.23121 0 3.29372 -0.10274 0 1.0402 -0.15926 0.95613 -4.7364
THR_51 -4.85005 0.27948 6.35067 -0.19805 0.10754 0.07024 3.12955 -2.84936 -0.01107 -0.10891 -3.68089 0.0247 0 0 0 0 0 -0.00783 0.05336 0.0837 0 0.0557 2.27796 -1.0874 0.0122 0.67939 0.33093
LEU_52 -4.30018 0.26787 3.86448 -0.50764 0.21235 0.14098 1.20894 -1.90548 -0 -0 -1.01683 0.20081 0 0 0 0 0 -0.05585 0.05875 0.19513 0 -0.01143 0 0.18072 -0.02295 0.40849 -1.08183
HIS_D_53 -5.58342 0.50949 4.63075 -0.41226 0.03788 0.50408 2.04826 -2.44944 -0.03345 -0.14803 -1.94773 -0.41542 0 0 -0.62693 0 0 -0.00158 0.09626 0 2.31337 -0.42287 0 -0.45461 -0.24689 0.31772 -2.28483
GLY_54 -1.62819 0.05358 2.13925 -5e-05 0 0 0.81561 -0.98662 -0 -0 -0.83531 -0.35847 0 0 0 0 0 -0.16735 0 0 0 -1.3942 0 0.83697 -0.59146 0.39515 -1.72108
MET_55 -6.36851 0.5993 3.40527 -0.3806 0.1028 0.02859 1.39654 -1.87497 -0.04744 -0.29654 -0.85648 -0.13576 0 0 0 0 0 0.04604 0.32853 1.46238 0 0.03629 0 0.60916 -0.30945 0.49997 -1.7549
LYS_56 -4.38267 0.30661 3.59985 -0.29541 0.03736 0.14322 1.94655 -1.77319 -0 -0 -1.22188 -0.18479 0 0 0 0 0 0.12862 0.00344 2.00862 0 -7e-05 0 -1.5107 0.04309 0.37433 -0.77703
CYS_57 -6.56841 1.27663 4.16187 -0.0706 3e-05 0.04467 2.52387 -2.23121 -0.01145 -0.10697 -2.90432 -0.38185 0 0 -0.98308 0 0 -0.00535 0.10621 0.50113 0 0.22823 0 3.6196 -0.26425 0.40738 -0.65787
SER_58 -2.64986 0.27127 3.03042 -0.02911 1e-05 0.04715 1.25247 -1.44301 -0.00686 -0.07708 -0.00566 -1.03034 0 0 0 0 0 -0.08632 0.00382 0.16124 0 -0.25789 0.62025 -0.77834 -0.53264 0.31158 -1.19889
HIS_D_59 -4.38683 0.49542 3.24288 -0.39965 0.0185 0.51331 2.14595 -1.88937 -0 -0 -0.35121 -0.3387 0 0 0 0 0 -0.04655 0.00704 0 1.63749 -0.21298 0 -0.45461 -0.5925 0.1423 -0.4695
PHE_60 -12.1966 2.03976 1.45613 -0.57818 0.17752 0.30888 1.91171 -2.6582 -0.04116 -0.20318 -0.55807 -0.11483 0 0 0 0 0 -0.02021 0.08105 0 2.7838 -0.16095 0 1.0402 -0.35057 0.50014 -6.5828
LYS_61 -3.38991 0.22189 4.63122 -0.36511 0.07425 0.24325 2.23375 -1.929 -0 -0 -3.89655 -0.07192 0 0 0 -0.59794 0 -0.08486 0.23926 1.75208 0 -0.17961 0 -1.5107 -0.14587 0.73951 -2.03625
LEU_62 -8.76108 2.12414 0.72209 -0.50663 0.26199 0.10972 0.98364 -1.63067 -0.02778 -0.13285 -0.49996 0.17912 0 0 0 0 0 0.96957 0.23173 2.02661 0 -0.37538 0 0.18072 -0.192 1.53799 -2.79904
PRO_63 -3.49274 0.68845 1.5737 -0.1304 1e-05 0.09722 0.67709 -0.7989 -0.01145 -0.10697 -0.41232 0.22631 0 0 0 0 0 -0.0379 0.049 0.2621 0 -1.13815 0 -2.4119 -0.46847 1.52998 -3.90533
ASP_64 -2.0426 0.20758 2.29107 -0.10665 0.00641 0.31071 0.9769 -1.03401 -0 -0 -1.81393 -1.1228 0 0 -0.82922 0 0 0.02802 0.01417 0 2.34384 -0.30755 0 -2.3716 -0.46858 0.46703 -3.4512
TYR_65 -6.75381 1.2094 3.04578 -0.75987 0.0458 0.1753 1.36222 -1.90377 -0.01122 -0.12734 -1.83679 -0.35606 0 0 -0.82922 -0.6274 0 -0.01395 0.01216 0 2.73877 0.02642 0.14656 1.2797 0.56364 1.13571 -1.47794
PRO_66 -4.20206 0.67621 2.21834 -0.20585 0.00983 0.14925 0.67672 -0.89762 -0.00977 -0.10508 -0.20132 0.00555 0 0 0 0 0 0.08651 0.00207 0.32661 0 -0.78692 0 -2.4119 0.586 1.16515 -2.91828
LEU_67 -1.60922 0.05177 1.19063 -0.55896 0.18077 0.13447 0.10477 -0.65468 -0 -0 -0.13635 0.29652 0 0 0 0 0 -0.05924 0.01152 0.45168 0 -0.19305 0 0.18072 -0.2073 0.26164 -0.5543
LEU_68 -6.15321 0.94312 2.08991 -0.48731 0.26437 0.08914 0.65461 -1.59539 -0.00146 -0.02225 0.02513 0.15171 0 0 0 0 0 0.00294 0.05821 0.57181 0 -0.15724 0 0.18072 -0.11529 0.26872 -3.23178
MET_69 -2.51572 0.26212 1.17472 -0.37053 0.10004 0.10702 0.63364 -0.93165 -0.04016 -0.37294 -0.72279 0.10721 0 0 0 0 0 -0.00675 0.01962 1.65285 0 0.22289 0 0.60916 -0.35067 0.39478 -0.02715
ASN_70 -0.80828 0.0373 0.99434 -0.33494 0.06865 0.6561 0.16349 -0.47462 -0.01295 -0.22102 0.25958 -0.80279 0 0 0 0 0 0.01603 0.00483 0 1.83483 -0.54791 0 -0.93687 -0.3464 0.33966 -0.11097
ALA:CtermProteinFull_71 -3.45721 0.45402 3.30036 -0.03207 0.00024 0 1.69376 -1.81673 -0.02586 -0.23362 -3.7657 -0.14475 0 0 -0.75309 0 0 0 0 0 0 0 0 1.8394 -0.02173 0.25339 -2.7096
#END_POSE_ENERGIES_TABLE model01_0001.pdb

ENDMDL

REMARK ID 114277 DOMAINID 110982 MODEL 5 2021-08-21_00000149_1_11
MODEL     5
REMARK    Rerank model05.pdb score: 39.690
REMARK    S_0000_0014
REMARK    SCORE        hbond_sc:          -6.507
REMARK    SCORE          fa_atr:        -404.992
REMARK    SCORE         fa_elec:        -107.448
REMARK    SCORE       dslf_fa13:           0.000
REMARK    SCORE          fa_rep:          48.162
REMARK    SCORE     hbond_bb_sc:          -6.671
REMARK    SCORE     rama_prepro:          -0.290
REMARK    SCORE     hbond_sr_bb:         -42.086
REMARK    SCORE          fa_sol:         229.840
REMARK    SCORE linear_chainbreak:           0.000
REMARK    SCORE         p_aa_pp:         -11.271
REMARK    SCORE overlap_chainbreak:           0.000
REMARK    SCORE           score:        -339.026
REMARK    SCORE     cart_bonded:          45.946
REMARK    SCORE             ref:          27.225
REMARK    SCORE   yhh_planarity:           0.000
REMARK    SCORE angle_constraint:           0.000
REMARK    SCORE            time:           0.000
REMARK    SCORE          fa_dun:         100.274
REMARK    SCORE dihedral_constraint:           0.000
REMARK    SCORE    fa_intra_rep:           0.694
REMARK    SCORE fa_intra_sol_xover4:          14.016
REMARK    SCORE     lk_ball_wtd:         -12.163
REMARK    SCORE           omega:           0.568
REMARK    SCORE     description: best_scoring0001_0001_0001
REMARK    SCORE coordinate_constraint:           0.000
REMARK    SCORE     total_score:        -339.026
REMARK    SCORE atom_pair_constraint:        -211.023
REMARK    SCORE     hbond_lr_bb:          -3.301
ATOM      1  N   CYS A   1       0.119  -0.894   0.189  1.00  4.04           N  
ATOM      2  CA  CYS A   1       1.573  -0.776   0.202  1.00  3.30           C  
ATOM      3  C   CYS A   1       1.993   0.689   0.305  1.00  2.72           C  
ATOM      4  O   CYS A   1       1.717   1.348   1.305  1.00  3.02           O  
ATOM      5  CB  CYS A   1       2.169  -1.437  -1.062  1.00  4.92           C  
ATOM      6  SG  CYS A   1       4.021  -1.422  -1.218  1.00  4.92           S  
ATOM      7 1H   CYS A   1      -0.143  -1.840  -0.049  1.00  4.85           H  
ATOM      8 2H   CYS A   1      -0.241  -0.669   1.108  1.00  4.85           H  
ATOM      9 3H   CYS A   1      -0.269  -0.253  -0.488  1.00  4.85           H  
ATOM     10  HA  CYS A   1       1.950  -1.298   1.077  1.00  3.96           H  
ATOM     11 1HB  CYS A   1       1.851  -2.480  -1.090  1.00  5.90           H  
ATOM     12 2HB  CYS A   1       1.753  -0.963  -1.944  1.00  5.90           H  
ATOM     13  HG  CYS A   1       4.280  -2.289  -0.239  1.00  5.90           H  
ATOM     14  N   VAL A   2       2.661   1.187  -0.728  1.00  2.42           N  
ATOM     15  CA  VAL A   2       3.163   2.553  -0.754  1.00  2.57           C  
ATOM     16  C   VAL A   2       2.641   3.373  -1.944  1.00  2.62           C  
ATOM     17  O   VAL A   2       2.367   4.566  -1.815  1.00  3.08           O  
ATOM     18  CB  VAL A   2       4.702   2.538  -0.773  1.00  3.55           C  
ATOM     19  CG1 VAL A   2       5.236   3.953  -0.847  1.00  3.55           C  
ATOM     20  CG2 VAL A   2       5.246   1.828   0.460  1.00  3.55           C  
ATOM     21  H   VAL A   2       2.849   0.591  -1.515  1.00  2.90           H  
ATOM     22  HA  VAL A   2       2.841   3.048   0.162  1.00  3.08           H  
ATOM     23  HB  VAL A   2       5.032   2.015  -1.643  1.00  4.26           H  
ATOM     24 1HG1 VAL A   2       6.310   3.925  -0.856  1.00  4.26           H  
ATOM     25 2HG1 VAL A   2       4.891   4.463  -1.739  1.00  4.26           H  
ATOM     26 3HG1 VAL A   2       4.910   4.513   0.033  1.00  4.26           H  
ATOM     27 1HG2 VAL A   2       6.331   1.819   0.412  1.00  4.26           H  
ATOM     28 2HG2 VAL A   2       4.925   2.352   1.356  1.00  4.26           H  
ATOM     29 3HG2 VAL A   2       4.888   0.817   0.494  1.00  4.26           H  
ATOM     30  N   PHE A   3       2.630   2.757  -3.118  1.00  2.61           N  
ATOM     31  CA  PHE A   3       2.363   3.403  -4.397  1.00  3.04           C  
ATOM     32  C   PHE A   3       0.955   3.103  -4.936  1.00  2.83           C  
ATOM     33  O   PHE A   3       0.190   2.371  -4.310  1.00  3.38           O  
ATOM     34  CB  PHE A   3       3.480   2.990  -5.351  1.00  4.09           C  
ATOM     35  CG  PHE A   3       3.599   1.518  -5.536  1.00  4.09           C  
ATOM     36  CD1 PHE A   3       3.017   0.913  -6.566  1.00  4.09           C  
ATOM     37  CD2 PHE A   3       4.280   0.741  -4.638  1.00  4.09           C  
ATOM     38  CE1 PHE A   3       3.131  -0.421  -6.735  1.00  4.09           C  
ATOM     39  CE2 PHE A   3       4.392  -0.595  -4.798  1.00  4.09           C  
ATOM     40  CZ  PHE A   3       3.832  -1.171  -5.841  1.00  4.09           C  
ATOM     41  H   PHE A   3       2.829   1.774  -3.135  1.00  3.13           H  
ATOM     42  HA  PHE A   3       2.437   4.483  -4.252  1.00  3.65           H  
ATOM     43 1HB  PHE A   3       3.317   3.439  -6.327  1.00  4.91           H  
ATOM     44 2HB  PHE A   3       4.433   3.367  -4.982  1.00  4.91           H  
ATOM     45  HD1 PHE A   3       2.468   1.509  -7.253  1.00  4.91           H  
ATOM     46  HD2 PHE A   3       4.727   1.202  -3.791  1.00  4.91           H  
ATOM     47  HE1 PHE A   3       2.653  -0.890  -7.578  1.00  4.91           H  
ATOM     48  HE2 PHE A   3       4.930  -1.197  -4.080  1.00  4.91           H  
ATOM     49  HZ  PHE A   3       3.928  -2.237  -5.962  1.00  4.91           H  
ATOM     50  N   GLY A   4       0.606   3.687  -6.096  1.00  2.46           N  
ATOM     51  CA  GLY A   4      -0.749   3.601  -6.661  1.00  2.62           C  
ATOM     52  C   GLY A   4      -1.423   2.233  -6.816  1.00  2.50           C  
ATOM     53  O   GLY A   4      -2.562   2.053  -6.383  1.00  2.72           O  
ATOM     54  H   GLY A   4       1.278   4.273  -6.610  1.00  2.95           H  
ATOM     55 1HA  GLY A   4      -1.400   4.232  -6.055  1.00  3.14           H  
ATOM     56 2HA  GLY A   4      -0.730   4.072  -7.640  1.00  3.14           H  
ATOM     57  N   CYS A   5      -0.769   1.289  -7.468  1.00  2.51           N  
ATOM     58  CA  CYS A   5      -1.389  -0.009  -7.726  1.00  2.56           C  
ATOM     59  C   CYS A   5      -0.451  -1.213  -7.785  1.00  2.35           C  
ATOM     60  O   CYS A   5      -0.105  -1.644  -8.882  1.00  2.44           O  
ATOM     61  CB  CYS A   5      -2.164   0.045  -9.047  1.00  3.57           C  
ATOM     62  SG  CYS A   5      -2.931  -1.488  -9.483  1.00  3.57           S  
ATOM     63  H   CYS A   5       0.161   1.498  -7.797  1.00  3.01           H  
ATOM     64  HA  CYS A   5      -2.135  -0.168  -6.953  1.00  3.07           H  
ATOM     65 1HB  CYS A   5      -2.954   0.796  -8.962  1.00  4.28           H  
ATOM     66 2HB  CYS A   5      -1.542   0.334  -9.866  1.00  4.28           H  
ATOM     67  HG  CYS A   5      -1.763  -2.142  -9.658  1.00  4.28           H  
ATOM     68  N   PRO A   6      -0.138  -1.848  -6.639  1.00  2.50           N  
ATOM     69  CA  PRO A   6       0.751  -2.999  -6.458  1.00  2.69           C  
ATOM     70  C   PRO A   6       0.522  -4.162  -7.413  1.00  2.59           C  
ATOM     71  O   PRO A   6       1.488  -4.794  -7.851  1.00  2.71           O  
ATOM     72  CB  PRO A   6       0.467  -3.374  -5.009  1.00  4.03           C  
ATOM     73  CG  PRO A   6       0.122  -2.065  -4.351  1.00  4.03           C  
ATOM     74  CD  PRO A   6      -0.686  -1.325  -5.366  1.00  4.03           C  
ATOM     75  HA  PRO A   6       1.776  -2.687  -6.548  1.00  3.23           H  
ATOM     76 1HB  PRO A   6      -0.332  -4.126  -4.952  1.00  4.84           H  
ATOM     77 2HB  PRO A   6       1.345  -3.812  -4.585  1.00  4.84           H  
ATOM     78 1HG  PRO A   6      -0.414  -2.233  -3.407  1.00  4.84           H  
ATOM     79 2HG  PRO A   6       1.049  -1.527  -4.108  1.00  4.84           H  
ATOM     80 1HD  PRO A   6      -1.754  -1.575  -5.251  1.00  4.84           H  
ATOM     81 2HD  PRO A   6      -0.491  -0.241  -5.248  1.00  4.84           H  
ATOM     82  N   SER A   7      -0.728  -4.413  -7.816  1.00  2.61           N  
ATOM     83  CA  SER A   7      -0.997  -5.494  -8.772  1.00  2.67           C  
ATOM     84  C   SER A   7      -0.357  -5.214 -10.150  1.00  2.35           C  
ATOM     85  O   SER A   7      -0.354  -6.073 -11.035  1.00  2.49           O  
ATOM     86  CB  SER A   7      -2.488  -5.722  -8.916  1.00  3.71           C  
ATOM     87  OG  SER A   7      -3.117  -4.631  -9.505  1.00  3.71           O  
ATOM     88  H   SER A   7      -1.520  -3.916  -7.434  1.00  3.13           H  
ATOM     89  HA  SER A   7      -0.554  -6.410  -8.380  1.00  3.20           H  
ATOM     90 1HB  SER A   7      -2.660  -6.613  -9.518  1.00  4.45           H  
ATOM     91 2HB  SER A   7      -2.920  -5.904  -7.933  1.00  4.45           H  
ATOM     92  HG  SER A   7      -4.048  -4.858  -9.566  1.00  4.45           H  
ATOM     93  N   ALA A   8       0.188  -4.004 -10.316  1.00  2.18           N  
ATOM     94  CA  ALA A   8       0.883  -3.533 -11.490  1.00  2.18           C  
ATOM     95  C   ALA A   8       2.187  -2.856 -11.068  1.00  1.86           C  
ATOM     96  O   ALA A   8       2.608  -1.886 -11.697  1.00  1.61           O  
ATOM     97  CB  ALA A   8       0.013  -2.549 -12.257  1.00  3.05           C  
ATOM     98  H   ALA A   8       0.133  -3.345  -9.545  1.00  2.62           H  
ATOM     99  HA  ALA A   8       1.126  -4.388 -12.120  1.00  2.62           H  
ATOM    100 1HB  ALA A   8       0.539  -2.203 -13.137  1.00  3.66           H  
ATOM    101 2HB  ALA A   8      -0.912  -3.041 -12.555  1.00  3.66           H  
ATOM    102 3HB  ALA A   8      -0.217  -1.700 -11.609  1.00  3.66           H  
ATOM    103  N   ALA A   9       2.856  -3.394 -10.040  1.00  2.02           N  
ATOM    104  CA  ALA A   9       4.087  -2.808  -9.501  1.00  1.92           C  
ATOM    105  C   ALA A   9       5.226  -2.627 -10.505  1.00  1.63           C  
ATOM    106  O   ALA A   9       5.966  -1.643 -10.398  1.00  1.46           O  
ATOM    107  CB  ALA A   9       4.592  -3.673  -8.356  1.00  2.73           C  
ATOM    108  H   ALA A   9       2.449  -4.194  -9.546  1.00  2.42           H  
ATOM    109  HA  ALA A   9       3.838  -1.823  -9.130  1.00  2.30           H  
ATOM    110 1HB  ALA A   9       5.466  -3.233  -7.914  1.00  3.28           H  
ATOM    111 2HB  ALA A   9       3.819  -3.773  -7.606  1.00  3.28           H  
ATOM    112 3HB  ALA A   9       4.838  -4.652  -8.737  1.00  3.28           H  
ATOM    113  N   ASP A  10       5.393  -3.534 -11.476  1.00  1.71           N  
ATOM    114  CA  ASP A  10       6.496  -3.389 -12.417  1.00  1.61           C  
ATOM    115  C   ASP A  10       6.177  -2.301 -13.415  1.00  1.30           C  
ATOM    116  O   ASP A  10       6.987  -1.393 -13.653  1.00  1.25           O  
ATOM    117  CB  ASP A  10       6.797  -4.716 -13.107  1.00  2.29           C  
ATOM    118  CG  ASP A  10       5.565  -5.329 -13.731  1.00  2.29           C  
ATOM    119  OD1 ASP A  10       4.476  -4.942 -13.294  1.00  2.29           O  
ATOM    120  OD2 ASP A  10       5.665  -6.126 -14.647  1.00  2.29           O  
ATOM    121  H   ASP A  10       4.744  -4.316 -11.602  1.00  2.05           H  
ATOM    122  HA  ASP A  10       7.374  -3.080 -11.872  1.00  1.93           H  
ATOM    123 1HB  ASP A  10       7.533  -4.543 -13.890  1.00  2.75           H  
ATOM    124 2HB  ASP A  10       7.230  -5.408 -12.392  1.00  2.75           H  
ATOM    125  N   LYS A  11       4.977  -2.374 -13.968  1.00  1.28           N  
ATOM    126  CA  LYS A  11       4.520  -1.395 -14.926  1.00  1.23           C  
ATOM    127  C   LYS A  11       4.631  -0.003 -14.318  1.00  1.00           C  
ATOM    128  O   LYS A  11       5.143   0.913 -14.964  1.00  1.08           O  
ATOM    129  CB  LYS A  11       3.075  -1.679 -15.336  1.00  1.75           C  
ATOM    130  CG  LYS A  11       2.487  -0.714 -16.377  1.00  1.75           C  
ATOM    131  CD  LYS A  11       1.052  -1.111 -16.732  1.00  1.75           C  
ATOM    132  CE  LYS A  11       0.359  -0.076 -17.636  1.00  1.75           C  
ATOM    133  NZ  LYS A  11       0.920  -0.040 -19.040  1.00  1.75           N  
ATOM    134  H   LYS A  11       4.414  -3.191 -13.717  1.00  1.54           H  
ATOM    135  HA  LYS A  11       5.161  -1.438 -15.808  1.00  1.48           H  
ATOM    136 1HB  LYS A  11       3.007  -2.693 -15.729  1.00  2.10           H  
ATOM    137 2HB  LYS A  11       2.446  -1.632 -14.449  1.00  2.10           H  
ATOM    138 1HG  LYS A  11       2.486   0.305 -15.980  1.00  2.10           H  
ATOM    139 2HG  LYS A  11       3.104  -0.729 -17.276  1.00  2.10           H  
ATOM    140 1HD  LYS A  11       1.060  -2.076 -17.241  1.00  2.10           H  
ATOM    141 2HD  LYS A  11       0.474  -1.213 -15.813  1.00  2.10           H  
ATOM    142 1HE  LYS A  11      -0.699  -0.320 -17.691  1.00  2.10           H  
ATOM    143 2HE  LYS A  11       0.472   0.915 -17.194  1.00  2.10           H  
ATOM    144 1HZ  LYS A  11       0.420   0.655 -19.572  1.00  2.10           H  
ATOM    145 2HZ  LYS A  11       1.923   0.222 -19.046  1.00  2.10           H  
ATOM    146 3HZ  LYS A  11       0.814  -0.937 -19.477  1.00  2.10           H  
ATOM    147  N   LEU A  12       4.173   0.155 -13.070  1.00  0.98           N  
ATOM    148  CA  LEU A  12       4.234   1.449 -12.416  1.00  1.06           C  
ATOM    149  C   LEU A  12       5.650   1.909 -12.159  1.00  1.03           C  
ATOM    150  O   LEU A  12       5.969   3.069 -12.381  1.00  1.23           O  
ATOM    151  CB  LEU A  12       3.501   1.407 -11.088  1.00  1.46           C  
ATOM    152  CG  LEU A  12       1.989   1.256 -11.154  1.00  1.46           C  
ATOM    153  CD1 LEU A  12       1.530   1.008  -9.823  1.00  1.46           C  
ATOM    154  CD2 LEU A  12       1.316   2.506 -11.690  1.00  1.46           C  
ATOM    155  H   LEU A  12       3.757  -0.642 -12.576  1.00  1.18           H  
ATOM    156  HA  LEU A  12       3.768   2.175 -13.072  1.00  1.27           H  
ATOM    157 1HB  LEU A  12       3.892   0.560 -10.517  1.00  1.75           H  
ATOM    158 2HB  LEU A  12       3.725   2.323 -10.542  1.00  1.75           H  
ATOM    159  HG  LEU A  12       1.730   0.409 -11.782  1.00  1.75           H  
ATOM    160 1HD1 LEU A  12       0.492   0.883  -9.864  1.00  1.75           H  
ATOM    161 2HD1 LEU A  12       1.993   0.106  -9.450  1.00  1.75           H  
ATOM    162 3HD1 LEU A  12       1.784   1.857  -9.213  1.00  1.75           H  
ATOM    163 1HD2 LEU A  12       0.238   2.354 -11.696  1.00  1.75           H  
ATOM    164 2HD2 LEU A  12       1.559   3.362 -11.056  1.00  1.75           H  
ATOM    165 3HD2 LEU A  12       1.645   2.698 -12.696  1.00  1.75           H  
ATOM    166  N   TRP A  13       6.553   1.030 -11.757  1.00  1.01           N  
ATOM    167  CA  TRP A  13       7.899   1.518 -11.530  1.00  1.14           C  
ATOM    168  C   TRP A  13       8.444   2.120 -12.837  1.00  1.17           C  
ATOM    169  O   TRP A  13       9.058   3.185 -12.818  1.00  1.50           O  
ATOM    170  CB  TRP A  13       8.782   0.411 -10.991  1.00  1.55           C  
ATOM    171  CG  TRP A  13      10.103   0.894 -10.475  1.00  1.55           C  
ATOM    172  CD1 TRP A  13      10.330   1.337  -9.210  1.00  1.55           C  
ATOM    173  CD2 TRP A  13      11.368   0.975 -11.154  1.00  1.55           C  
ATOM    174  NE1 TRP A  13      11.633   1.688  -9.058  1.00  1.55           N  
ATOM    175  CE2 TRP A  13      12.290   1.474 -10.227  1.00  1.55           C  
ATOM    176  CE3 TRP A  13      11.792   0.670 -12.440  1.00  1.55           C  
ATOM    177  CZ2 TRP A  13      13.616   1.671 -10.547  1.00  1.55           C  
ATOM    178  CZ3 TRP A  13      13.123   0.870 -12.763  1.00  1.55           C  
ATOM    179  CH2 TRP A  13      14.013   1.354 -11.841  1.00  1.55           C  
ATOM    180  H   TRP A  13       6.310   0.059 -11.523  1.00  1.21           H  
ATOM    181  HA  TRP A  13       7.869   2.310 -10.791  1.00  1.37           H  
ATOM    182 1HB  TRP A  13       8.244  -0.085 -10.201  1.00  1.86           H  
ATOM    183 2HB  TRP A  13       8.958  -0.333 -11.773  1.00  1.86           H  
ATOM    184  HD1 TRP A  13       9.579   1.394  -8.439  1.00  1.86           H  
ATOM    185  HE1 TRP A  13      12.049   2.047  -8.212  1.00  1.86           H  
ATOM    186  HE3 TRP A  13      11.092   0.278 -13.184  1.00  1.86           H  
ATOM    187  HZ2 TRP A  13      14.337   2.053  -9.826  1.00  1.86           H  
ATOM    188  HZ3 TRP A  13      13.445   0.624 -13.772  1.00  1.86           H  
ATOM    189  HH2 TRP A  13      15.054   1.490 -12.130  1.00  1.86           H  
ATOM    190  N   ASP A  14       8.216   1.437 -13.973  1.00  1.09           N  
ATOM    191  CA  ASP A  14       8.682   1.929 -15.274  1.00  1.42           C  
ATOM    192  C   ASP A  14       7.941   3.170 -15.830  1.00  1.64           C  
ATOM    193  O   ASP A  14       8.574   4.049 -16.421  1.00  1.99           O  
ATOM    194  CB  ASP A  14       8.531   0.842 -16.349  1.00  1.86           C  
ATOM    195  CG  ASP A  14       9.500  -0.329 -16.276  1.00  1.86           C  
ATOM    196  OD1 ASP A  14      10.530  -0.271 -15.633  1.00  1.86           O  
ATOM    197  OD2 ASP A  14       9.208  -1.339 -16.891  1.00  1.86           O  
ATOM    198  H   ASP A  14       7.728   0.534 -13.910  1.00  1.31           H  
ATOM    199  HA  ASP A  14       9.737   2.183 -15.171  1.00  1.70           H  
ATOM    200 1HB  ASP A  14       7.514   0.438 -16.281  1.00  2.23           H  
ATOM    201 2HB  ASP A  14       8.619   1.305 -17.331  1.00  2.23           H  
ATOM    202  N   GLU A  15       6.609   3.245 -15.661  1.00  1.57           N  
ATOM    203  CA  GLU A  15       5.818   4.350 -16.239  1.00  1.93           C  
ATOM    204  C   GLU A  15       5.411   5.471 -15.260  1.00  2.05           C  
ATOM    205  O   GLU A  15       5.126   6.595 -15.678  1.00  2.40           O  
ATOM    206  CB  GLU A  15       4.541   3.794 -16.885  1.00  2.56           C  
ATOM    207  CG  GLU A  15       4.776   2.817 -18.047  1.00  2.56           C  
ATOM    208  CD  GLU A  15       3.483   2.324 -18.696  1.00  2.56           C  
ATOM    209  OE1 GLU A  15       2.495   3.033 -18.637  1.00  2.56           O  
ATOM    210  OE2 GLU A  15       3.481   1.220 -19.222  1.00  2.56           O  
ATOM    211  H   GLU A  15       6.121   2.475 -15.198  1.00  1.88           H  
ATOM    212  HA  GLU A  15       6.419   4.807 -17.023  1.00  2.32           H  
ATOM    213 1HB  GLU A  15       3.961   3.264 -16.126  1.00  3.07           H  
ATOM    214 2HB  GLU A  15       3.928   4.618 -17.248  1.00  3.07           H  
ATOM    215 1HG  GLU A  15       5.392   3.305 -18.800  1.00  3.07           H  
ATOM    216 2HG  GLU A  15       5.331   1.957 -17.665  1.00  3.07           H  
ATOM    217  N   ASN A  16       5.345   5.157 -13.973  1.00  1.91           N  
ATOM    218  CA  ASN A  16       4.909   6.024 -12.885  1.00  2.20           C  
ATOM    219  C   ASN A  16       5.969   6.060 -11.790  1.00  1.95           C  
ATOM    220  O   ASN A  16       5.665   6.082 -10.594  1.00  1.91           O  
ATOM    221  CB  ASN A  16       3.557   5.590 -12.354  1.00  2.97           C  
ATOM    222  CG  ASN A  16       2.425   5.907 -13.294  1.00  2.97           C  
ATOM    223  OD1 ASN A  16       1.904   7.029 -13.252  1.00  2.97           O  
ATOM    224  ND2 ASN A  16       2.045   4.993 -14.144  1.00  2.97           N  
ATOM    225  H   ASN A  16       5.625   4.229 -13.679  1.00  2.29           H  
ATOM    226  HA  ASN A  16       4.810   7.041 -13.270  1.00  2.64           H  
ATOM    227 1HB  ASN A  16       3.577   4.521 -12.173  1.00  3.56           H  
ATOM    228 2HB  ASN A  16       3.370   6.074 -11.404  1.00  3.56           H  
ATOM    229 1HD2 ASN A  16       1.303   5.189 -14.789  1.00  3.56           H  
ATOM    230 2HD2 ASN A  16       2.508   4.110 -14.179  1.00  3.56           H  
ATOM    231  N   LYS A  17       7.233   6.107 -12.221  1.00  1.88           N  
ATOM    232  CA  LYS A  17       8.405   6.120 -11.344  1.00  1.83           C  
ATOM    233  C   LYS A  17       8.260   7.146 -10.221  1.00  1.67           C  
ATOM    234  O   LYS A  17       8.661   6.877  -9.083  1.00  1.75           O  
ATOM    235  CB  LYS A  17       9.692   6.353 -12.170  1.00  2.58           C  
ATOM    236  CG  LYS A  17      11.022   6.340 -11.359  1.00  2.58           C  
ATOM    237  CD  LYS A  17      12.306   6.406 -12.276  1.00  2.58           C  
ATOM    238  CE  LYS A  17      13.592   6.531 -11.416  1.00  2.58           C  
ATOM    239  NZ  LYS A  17      14.878   6.471 -12.190  1.00  2.58           N  
ATOM    240  H   LYS A  17       7.394   6.109 -13.220  1.00  2.26           H  
ATOM    241  HA  LYS A  17       8.489   5.128 -10.890  1.00  2.20           H  
ATOM    242 1HB  LYS A  17       9.766   5.589 -12.944  1.00  3.10           H  
ATOM    243 2HB  LYS A  17       9.624   7.314 -12.673  1.00  3.10           H  
ATOM    244 1HG  LYS A  17      11.038   7.189 -10.696  1.00  3.10           H  
ATOM    245 2HG  LYS A  17      11.064   5.429 -10.755  1.00  3.10           H  
ATOM    246 1HD  LYS A  17      12.366   5.495 -12.881  1.00  3.10           H  
ATOM    247 2HD  LYS A  17      12.236   7.264 -12.943  1.00  3.10           H  
ATOM    248 1HE  LYS A  17      13.564   7.491 -10.937  1.00  3.10           H  
ATOM    249 2HE  LYS A  17      13.594   5.744 -10.661  1.00  3.10           H  
ATOM    250 1HZ  LYS A  17      15.683   6.596 -11.507  1.00  3.10           H  
ATOM    251 2HZ  LYS A  17      14.970   5.583 -12.660  1.00  3.10           H  
ATOM    252 3HZ  LYS A  17      14.905   7.212 -12.872  1.00  3.10           H  
ATOM    253  N   SER A  18       7.631   8.291 -10.512  1.00  1.63           N  
ATOM    254  CA  SER A  18       7.487   9.381  -9.562  1.00  1.68           C  
ATOM    255  C   SER A  18       6.776   8.997  -8.257  1.00  1.61           C  
ATOM    256  O   SER A  18       6.921   9.699  -7.252  1.00  1.72           O  
ATOM    257  CB  SER A  18       6.743  10.534 -10.212  1.00  2.33           C  
ATOM    258  OG  SER A  18       5.415  10.192 -10.505  1.00  2.33           O  
ATOM    259  H   SER A  18       7.295   8.456 -11.453  1.00  1.96           H  
ATOM    260  HA  SER A  18       8.483   9.732  -9.330  1.00  2.02           H  
ATOM    261 1HB  SER A  18       6.758  11.393  -9.540  1.00  2.80           H  
ATOM    262 2HB  SER A  18       7.255  10.827 -11.126  1.00  2.80           H  
ATOM    263  HG  SER A  18       5.000  10.997 -10.831  1.00  2.80           H  
ATOM    264  N   HIS A  19       6.024   7.884  -8.221  1.00  1.54           N  
ATOM    265  CA  HIS A  19       5.360   7.504  -6.967  1.00  1.56           C  
ATOM    266  C   HIS A  19       6.413   7.069  -5.951  1.00  1.43           C  
ATOM    267  O   HIS A  19       6.305   7.318  -4.740  1.00  1.48           O  
ATOM    268  CB  HIS A  19       4.411   6.297  -7.127  1.00  2.18           C  
ATOM    269  CG  HIS A  19       3.194   6.503  -7.965  1.00  2.18           C  
ATOM    270  ND1 HIS A  19       2.157   5.559  -8.031  1.00  2.18           N  
ATOM    271  CD2 HIS A  19       2.846   7.505  -8.814  1.00  2.18           C  
ATOM    272  CE1 HIS A  19       1.242   5.995  -8.899  1.00  2.18           C  
ATOM    273  NE2 HIS A  19       1.637   7.165  -9.372  1.00  2.18           N  
ATOM    274  H   HIS A  19       5.917   7.308  -9.065  1.00  1.85           H  
ATOM    275  HA  HIS A  19       4.808   8.351  -6.558  1.00  1.87           H  
ATOM    276 1HB  HIS A  19       4.969   5.472  -7.567  1.00  2.62           H  
ATOM    277 2HB  HIS A  19       4.088   5.973  -6.141  1.00  2.62           H  
ATOM    278  HD2 HIS A  19       3.417   8.409  -9.031  1.00  2.62           H  
ATOM    279  HE1 HIS A  19       0.324   5.488  -9.183  1.00  2.62           H  
ATOM    280  HE2 HIS A  19       1.140   7.727 -10.053  1.00  2.62           H  
ATOM    281  N   PHE A  20       7.431   6.397  -6.476  1.00  1.37           N  
ATOM    282  CA  PHE A  20       8.503   5.790  -5.733  1.00  1.36           C  
ATOM    283  C   PHE A  20       9.469   6.882  -5.302  1.00  1.19           C  
ATOM    284  O   PHE A  20      10.031   6.849  -4.196  1.00  1.19           O  
ATOM    285  CB  PHE A  20       9.153   4.766  -6.657  1.00  1.91           C  
ATOM    286  CG  PHE A  20       8.217   3.630  -7.013  1.00  1.91           C  
ATOM    287  CD1 PHE A  20       7.342   3.737  -8.103  1.00  1.91           C  
ATOM    288  CD2 PHE A  20       8.200   2.478  -6.293  1.00  1.91           C  
ATOM    289  CE1 PHE A  20       6.475   2.722  -8.420  1.00  1.91           C  
ATOM    290  CE2 PHE A  20       7.338   1.463  -6.611  1.00  1.91           C  
ATOM    291  CZ  PHE A  20       6.471   1.579  -7.675  1.00  1.91           C  
ATOM    292  H   PHE A  20       7.478   6.297  -7.488  1.00  1.64           H  
ATOM    293  HA  PHE A  20       8.097   5.297  -4.851  1.00  1.63           H  
ATOM    294 1HB  PHE A  20       9.506   5.232  -7.568  1.00  2.29           H  
ATOM    295 2HB  PHE A  20       9.975   4.361  -6.170  1.00  2.29           H  
ATOM    296  HD1 PHE A  20       7.336   4.641  -8.709  1.00  2.29           H  
ATOM    297  HD2 PHE A  20       8.883   2.367  -5.448  1.00  2.29           H  
ATOM    298  HE1 PHE A  20       5.797   2.835  -9.267  1.00  2.29           H  
ATOM    299  HE2 PHE A  20       7.340   0.565  -6.010  1.00  2.29           H  
ATOM    300  HZ  PHE A  20       5.787   0.767  -7.917  1.00  2.29           H  
ATOM    301  N   ILE A  21       9.640   7.854  -6.201  1.00  1.14           N  
ATOM    302  CA  ILE A  21      10.530   8.978  -5.972  1.00  1.09           C  
ATOM    303  C   ILE A  21       9.987   9.867  -4.877  1.00  1.03           C  
ATOM    304  O   ILE A  21      10.738  10.253  -3.976  1.00  1.01           O  
ATOM    305  CB  ILE A  21      10.714   9.820  -7.259  1.00  1.55           C  
ATOM    306  CG1 ILE A  21      11.382   8.948  -8.381  1.00  1.55           C  
ATOM    307  CG2 ILE A  21      11.480  11.154  -7.015  1.00  1.55           C  
ATOM    308  CD1 ILE A  21      12.747   8.376  -8.074  1.00  1.55           C  
ATOM    309  H   ILE A  21       9.150   7.754  -7.093  1.00  1.37           H  
ATOM    310  HA  ILE A  21      11.476   8.594  -5.635  1.00  1.31           H  
ATOM    311  HB  ILE A  21       9.742  10.086  -7.607  1.00  1.86           H  
ATOM    312 1HG1 ILE A  21      10.729   8.118  -8.576  1.00  1.86           H  
ATOM    313 2HG1 ILE A  21      11.466   9.548  -9.287  1.00  1.86           H  
ATOM    314 1HG2 ILE A  21      11.531  11.708  -7.950  1.00  1.86           H  
ATOM    315 2HG2 ILE A  21      10.957  11.757  -6.275  1.00  1.86           H  
ATOM    316 3HG2 ILE A  21      12.466  10.981  -6.678  1.00  1.86           H  
ATOM    317 1HD1 ILE A  21      13.076   7.797  -8.888  1.00  1.86           H  
ATOM    318 2HD1 ILE A  21      13.451   9.182  -7.909  1.00  1.86           H  
ATOM    319 3HD1 ILE A  21      12.711   7.732  -7.205  1.00  1.86           H  
ATOM    320  N   GLU A  22       8.696  10.205  -4.938  1.00  1.10           N  
ATOM    321  CA  GLU A  22       8.134  11.061  -3.917  1.00  1.13           C  
ATOM    322  C   GLU A  22       8.264  10.422  -2.537  1.00  1.06           C  
ATOM    323  O   GLU A  22       8.675  11.101  -1.594  1.00  1.09           O  
ATOM    324  CB  GLU A  22       6.676  11.393  -4.223  1.00  1.58           C  
ATOM    325  CG  GLU A  22       6.088  12.396  -3.257  1.00  1.58           C  
ATOM    326  CD  GLU A  22       4.672  12.808  -3.562  1.00  1.58           C  
ATOM    327  OE1 GLU A  22       4.050  12.198  -4.393  1.00  1.58           O  
ATOM    328  OE2 GLU A  22       4.218  13.759  -2.967  1.00  1.58           O  
ATOM    329  H   GLU A  22       8.104   9.896  -5.716  1.00  1.32           H  
ATOM    330  HA  GLU A  22       8.693  11.994  -3.910  1.00  1.36           H  
ATOM    331 1HB  GLU A  22       6.597  11.794  -5.234  1.00  1.90           H  
ATOM    332 2HB  GLU A  22       6.079  10.480  -4.184  1.00  1.90           H  
ATOM    333 1HG  GLU A  22       6.114  11.941  -2.286  1.00  1.90           H  
ATOM    334 2HG  GLU A  22       6.724  13.277  -3.226  1.00  1.90           H  
ATOM    335  N   ASP A  23       7.975   9.112  -2.420  1.00  1.08           N  
ATOM    336  CA  ASP A  23       8.079   8.444  -1.125  1.00  1.15           C  
ATOM    337  C   ASP A  23       9.515   8.470  -0.580  1.00  1.08           C  
ATOM    338  O   ASP A  23       9.744   8.735   0.609  1.00  1.17           O  
ATOM    339  CB  ASP A  23       7.588   7.004  -1.238  1.00  1.59           C  
ATOM    340  CG  ASP A  23       7.511   6.309   0.102  1.00  1.59           C  
ATOM    341  OD1 ASP A  23       6.655   6.642   0.893  1.00  1.59           O  
ATOM    342  OD2 ASP A  23       8.327   5.459   0.374  1.00  1.59           O  
ATOM    343  H   ASP A  23       7.617   8.584  -3.224  1.00  1.30           H  
ATOM    344  HA  ASP A  23       7.444   8.972  -0.427  1.00  1.38           H  
ATOM    345 1HB  ASP A  23       6.598   6.995  -1.705  1.00  1.91           H  
ATOM    346 2HB  ASP A  23       8.259   6.445  -1.897  1.00  1.91           H  
ATOM    347  N   PHE A  24      10.494   8.183  -1.443  1.00  1.01           N  
ATOM    348  CA  PHE A  24      11.889   8.226  -1.040  1.00  1.07           C  
ATOM    349  C   PHE A  24      12.220   9.602  -0.513  1.00  1.00           C  
ATOM    350  O   PHE A  24      12.789   9.759   0.563  1.00  1.13           O  
ATOM    351  CB  PHE A  24      12.786   7.965  -2.223  1.00  1.48           C  
ATOM    352  CG  PHE A  24      14.296   8.067  -1.978  1.00  1.48           C  
ATOM    353  CD1 PHE A  24      15.023   6.957  -1.722  1.00  1.48           C  
ATOM    354  CD2 PHE A  24      14.971   9.290  -2.019  1.00  1.48           C  
ATOM    355  CE1 PHE A  24      16.386   7.027  -1.544  1.00  1.48           C  
ATOM    356  CE2 PHE A  24      16.318   9.365  -1.853  1.00  1.48           C  
ATOM    357  CZ  PHE A  24      17.031   8.228  -1.625  1.00  1.48           C  
ATOM    358  H   PHE A  24      10.265   7.919  -2.409  1.00  1.21           H  
ATOM    359  HA  PHE A  24      12.060   7.486  -0.257  1.00  1.28           H  
ATOM    360 1HB  PHE A  24      12.571   6.971  -2.616  1.00  1.78           H  
ATOM    361 2HB  PHE A  24      12.509   8.659  -2.988  1.00  1.78           H  
ATOM    362  HD1 PHE A  24      14.513   6.009  -1.679  1.00  1.78           H  
ATOM    363  HD2 PHE A  24      14.415  10.208  -2.213  1.00  1.78           H  
ATOM    364  HE1 PHE A  24      16.960   6.122  -1.346  1.00  1.78           H  
ATOM    365  HE2 PHE A  24      16.821  10.329  -1.907  1.00  1.78           H  
ATOM    366  HZ  PHE A  24      18.111   8.276  -1.492  1.00  1.78           H  
ATOM    367  N   CYS A  25      11.863  10.628  -1.284  1.00  0.92           N  
ATOM    368  CA  CYS A  25      12.194  11.995  -0.929  1.00  1.00           C  
ATOM    369  C   CYS A  25      11.595  12.364   0.435  1.00  1.04           C  
ATOM    370  O   CYS A  25      12.274  12.941   1.297  1.00  1.14           O  
ATOM    371  CB  CYS A  25      11.671  12.922  -2.022  1.00  1.37           C  
ATOM    372  SG  CYS A  25      12.560  12.740  -3.623  1.00  1.37           S  
ATOM    373  H   CYS A  25      11.368  10.449  -2.162  1.00  1.10           H  
ATOM    374  HA  CYS A  25      13.276  12.089  -0.880  1.00  1.20           H  
ATOM    375 1HB  CYS A  25      10.619  12.717  -2.200  1.00  1.64           H  
ATOM    376 2HB  CYS A  25      11.752  13.950  -1.697  1.00  1.64           H  
ATOM    377  HG  CYS A  25      11.992  11.543  -3.948  1.00  1.64           H  
ATOM    378  N   TRP A  26      10.355  11.924   0.699  1.00  1.05           N  
ATOM    379  CA  TRP A  26       9.726  12.190   1.989  1.00  1.20           C  
ATOM    380  C   TRP A  26      10.569  11.635   3.135  1.00  1.25           C  
ATOM    381  O   TRP A  26      10.657  12.245   4.204  1.00  1.39           O  
ATOM    382  CB  TRP A  26       8.348  11.518   2.102  1.00  1.62           C  
ATOM    383  CG  TRP A  26       7.219  12.117   1.319  1.00  1.62           C  
ATOM    384  CD1 TRP A  26       7.098  13.380   0.829  1.00  1.62           C  
ATOM    385  CD2 TRP A  26       6.005  11.425   0.939  1.00  1.62           C  
ATOM    386  NE1 TRP A  26       5.897  13.516   0.182  1.00  1.62           N  
ATOM    387  CE2 TRP A  26       5.221  12.329   0.243  1.00  1.62           C  
ATOM    388  CE3 TRP A  26       5.531  10.121   1.135  1.00  1.62           C  
ATOM    389  CZ2 TRP A  26       3.985  11.982  -0.267  1.00  1.62           C  
ATOM    390  CZ3 TRP A  26       4.300   9.772   0.617  1.00  1.62           C  
ATOM    391  CH2 TRP A  26       3.545  10.681  -0.066  1.00  1.62           C  
ATOM    392  H   TRP A  26       9.815  11.466  -0.045  1.00  1.26           H  
ATOM    393  HA  TRP A  26       9.629  13.264   2.119  1.00  1.44           H  
ATOM    394 1HB  TRP A  26       8.441  10.483   1.791  1.00  1.94           H  
ATOM    395 2HB  TRP A  26       8.052  11.505   3.147  1.00  1.94           H  
ATOM    396  HD1 TRP A  26       7.838  14.169   0.932  1.00  1.94           H  
ATOM    397  HE1 TRP A  26       5.551  14.350  -0.284  1.00  1.94           H  
ATOM    398  HE3 TRP A  26       6.127   9.383   1.677  1.00  1.94           H  
ATOM    399  HZ2 TRP A  26       3.371  12.695  -0.822  1.00  1.94           H  
ATOM    400  HZ3 TRP A  26       3.950   8.749   0.768  1.00  1.94           H  
ATOM    401  HH2 TRP A  26       2.579  10.380  -0.466  1.00  1.94           H  
ATOM    402  N   LYS A  27      11.157  10.453   2.925  1.00  1.22           N  
ATOM    403  CA  LYS A  27      11.956   9.795   3.947  1.00  1.40           C  
ATOM    404  C   LYS A  27      13.430  10.233   4.040  1.00  1.37           C  
ATOM    405  O   LYS A  27      13.986  10.266   5.146  1.00  1.58           O  
ATOM    406  CB  LYS A  27      11.922   8.286   3.706  1.00  1.89           C  
ATOM    407  CG  LYS A  27      10.581   7.635   3.959  1.00  1.89           C  
ATOM    408  CD  LYS A  27      10.651   6.124   3.723  1.00  1.89           C  
ATOM    409  CE  LYS A  27       9.337   5.421   4.080  1.00  1.89           C  
ATOM    410  NZ  LYS A  27       8.245   5.746   3.119  1.00  1.89           N  
ATOM    411  H   LYS A  27      11.018   9.991   2.018  1.00  1.46           H  
ATOM    412  HA  LYS A  27      11.489  10.003   4.908  1.00  1.68           H  
ATOM    413 1HB  LYS A  27      12.184   8.091   2.660  1.00  2.27           H  
ATOM    414 2HB  LYS A  27      12.670   7.798   4.328  1.00  2.27           H  
ATOM    415 1HG  LYS A  27      10.270   7.834   4.986  1.00  2.27           H  
ATOM    416 2HG  LYS A  27       9.847   8.075   3.281  1.00  2.27           H  
ATOM    417 1HD  LYS A  27      10.856   5.943   2.662  1.00  2.27           H  
ATOM    418 2HD  LYS A  27      11.461   5.689   4.308  1.00  2.27           H  
ATOM    419 1HE  LYS A  27       9.499   4.348   4.080  1.00  2.27           H  
ATOM    420 2HE  LYS A  27       9.028   5.731   5.076  1.00  2.27           H  
ATOM    421 1HZ  LYS A  27       7.396   5.279   3.365  1.00  2.27           H  
ATOM    422 2HZ  LYS A  27       8.071   6.739   3.103  1.00  2.27           H  
ATOM    423 3HZ  LYS A  27       8.495   5.460   2.159  1.00  2.27           H  
ATOM    424  N   LEU A  28      14.070  10.557   2.903  1.00  1.18           N  
ATOM    425  CA  LEU A  28      15.508  10.851   2.899  1.00  1.25           C  
ATOM    426  C   LEU A  28      15.905  12.323   2.848  1.00  1.25           C  
ATOM    427  O   LEU A  28      17.066  12.661   3.110  1.00  1.39           O  
ATOM    428  CB  LEU A  28      16.192  10.136   1.725  1.00  1.73           C  
ATOM    429  CG  LEU A  28      16.612   8.622   1.900  1.00  1.73           C  
ATOM    430  CD1 LEU A  28      17.553   8.424   3.090  1.00  1.73           C  
ATOM    431  CD2 LEU A  28      15.372   7.751   2.035  1.00  1.73           C  
ATOM    432  H   LEU A  28      13.563  10.487   2.020  1.00  1.42           H  
ATOM    433  HA  LEU A  28      15.906  10.467   3.827  1.00  1.50           H  
ATOM    434 1HB  LEU A  28      15.504  10.176   0.881  1.00  2.08           H  
ATOM    435 2HB  LEU A  28      17.085  10.692   1.456  1.00  2.08           H  
ATOM    436  HG  LEU A  28      17.154   8.325   1.033  1.00  2.08           H  
ATOM    437 1HD1 LEU A  28      17.842   7.373   3.139  1.00  2.08           H  
ATOM    438 2HD1 LEU A  28      18.441   9.039   2.952  1.00  2.08           H  
ATOM    439 3HD1 LEU A  28      17.070   8.687   4.018  1.00  2.08           H  
ATOM    440 1HD2 LEU A  28      15.685   6.720   2.110  1.00  2.08           H  
ATOM    441 2HD2 LEU A  28      14.826   8.011   2.919  1.00  2.08           H  
ATOM    442 3HD2 LEU A  28      14.729   7.876   1.161  1.00  2.08           H  
ATOM    443  N   HIS A  29      14.982  13.235   2.569  1.00  1.24           N  
ATOM    444  CA  HIS A  29      15.387  14.640   2.570  1.00  1.43           C  
ATOM    445  C   HIS A  29      15.658  15.088   4.011  1.00  1.52           C  
ATOM    446  O   HIS A  29      16.387  16.050   4.256  1.00  1.63           O  
ATOM    447  CB  HIS A  29      14.384  15.535   1.853  1.00  1.93           C  
ATOM    448  CG  HIS A  29      14.435  15.348   0.360  1.00  1.93           C  
ATOM    449  ND1 HIS A  29      13.685  16.106  -0.511  1.00  1.93           N  
ATOM    450  CD2 HIS A  29      15.148  14.484  -0.410  1.00  1.93           C  
ATOM    451  CE1 HIS A  29      13.946  15.724  -1.748  1.00  1.93           C  
ATOM    452  NE2 HIS A  29      14.821  14.741  -1.705  1.00  1.93           N  
ATOM    453  H   HIS A  29      14.029  12.969   2.301  1.00  1.49           H  
ATOM    454  HA  HIS A  29      16.321  14.748   2.024  1.00  1.72           H  
ATOM    455 1HB  HIS A  29      13.373  15.305   2.195  1.00  2.32           H  
ATOM    456 2HB  HIS A  29      14.590  16.579   2.082  1.00  2.32           H  
ATOM    457  HD1 HIS A  29      13.199  16.951  -0.284  1.00  2.32           H  
ATOM    458  HD2 HIS A  29      15.865  13.697  -0.183  1.00  2.32           H  
ATOM    459  HE1 HIS A  29      13.448  16.206  -2.584  1.00  2.32           H  
ATOM    460  N   ARG A  30      15.167  14.304   4.972  1.00  1.56           N  
ATOM    461  CA  ARG A  30      15.367  14.522   6.399  1.00  1.80           C  
ATOM    462  C   ARG A  30      16.850  14.368   6.771  1.00  1.83           C  
ATOM    463  O   ARG A  30      17.274  14.788   7.848  1.00  2.04           O  
ATOM    464  CB  ARG A  30      14.586  13.511   7.225  1.00  2.42           C  
ATOM    465  CG  ARG A  30      13.066  13.606   7.154  1.00  2.42           C  
ATOM    466  CD  ARG A  30      12.422  12.585   8.036  1.00  2.42           C  
ATOM    467  NE  ARG A  30      12.699  11.221   7.585  1.00  2.42           N  
ATOM    468  CZ  ARG A  30      12.426  10.090   8.246  1.00  2.42           C  
ATOM    469  NH1 ARG A  30      11.838  10.090   9.430  1.00  2.42           N  
ATOM    470  NH2 ARG A  30      12.776   8.975   7.653  1.00  2.42           N  
ATOM    471  H   ARG A  30      14.595  13.525   4.674  1.00  1.87           H  
ATOM    472  HA  ARG A  30      15.041  15.531   6.651  1.00  2.16           H  
ATOM    473 1HB  ARG A  30      14.863  12.507   6.899  1.00  2.90           H  
ATOM    474 2HB  ARG A  30      14.873  13.599   8.271  1.00  2.90           H  
ATOM    475 1HG  ARG A  30      12.742  14.596   7.470  1.00  2.90           H  
ATOM    476 2HG  ARG A  30      12.736  13.420   6.128  1.00  2.90           H  
ATOM    477 1HD  ARG A  30      12.800  12.697   9.051  1.00  2.90           H  
ATOM    478 2HD  ARG A  30      11.343  12.734   8.026  1.00  2.90           H  
ATOM    479  HE  ARG A  30      13.154  11.088   6.671  1.00  2.90           H  
ATOM    480 1HH1 ARG A  30      11.579  10.960   9.869  1.00  2.90           H  
ATOM    481 2HH1 ARG A  30      11.649   9.216   9.901  1.00  2.90           H  
ATOM    482 1HH2 ARG A  30      13.234   9.068   6.733  1.00  2.90           H  
ATOM    483 2HH2 ARG A  30      12.608   8.077   8.081  1.00  2.90           H  
ATOM    484  N   ARG A  31      17.626  13.720   5.888  1.00  1.68           N  
ATOM    485  CA  ARG A  31      19.044  13.466   6.069  1.00  1.77           C  
ATOM    486  C   ARG A  31      19.858  14.274   5.061  1.00  1.73           C  
ATOM    487  O   ARG A  31      21.031  13.973   4.831  1.00  1.82           O  
ATOM    488  CB  ARG A  31      19.358  11.995   5.857  1.00  2.44           C  
ATOM    489  CG  ARG A  31      18.694  11.027   6.814  1.00  2.44           C  
ATOM    490  CD  ARG A  31      19.115   9.641   6.510  1.00  2.44           C  
ATOM    491  NE  ARG A  31      18.465   8.660   7.361  1.00  2.44           N  
ATOM    492  CZ  ARG A  31      18.655   7.324   7.282  1.00  2.44           C  
ATOM    493  NH1 ARG A  31      19.478   6.818   6.382  1.00  2.44           N  
ATOM    494  NH2 ARG A  31      18.011   6.521   8.113  1.00  2.44           N  
ATOM    495  H   ARG A  31      17.225  13.405   5.005  1.00  2.02           H  
ATOM    496  HA  ARG A  31      19.334  13.762   7.076  1.00  2.12           H  
ATOM    497 1HB  ARG A  31      19.052  11.713   4.848  1.00  2.93           H  
ATOM    498 2HB  ARG A  31      20.434  11.839   5.927  1.00  2.93           H  
ATOM    499 1HG  ARG A  31      18.974  11.266   7.838  1.00  2.93           H  
ATOM    500 2HG  ARG A  31      17.608  11.091   6.704  1.00  2.93           H  
ATOM    501 1HD  ARG A  31      18.873   9.418   5.481  1.00  2.93           H  
ATOM    502 2HD  ARG A  31      20.192   9.560   6.656  1.00  2.93           H  
ATOM    503  HE  ARG A  31      17.823   9.006   8.063  1.00  2.93           H  
ATOM    504 1HH1 ARG A  31      19.973   7.424   5.746  1.00  2.93           H  
ATOM    505 2HH1 ARG A  31      19.617   5.819   6.329  1.00  2.93           H  
ATOM    506 1HH2 ARG A  31      17.381   6.906   8.804  1.00  2.93           H  
ATOM    507 2HH2 ARG A  31      18.148   5.522   8.062  1.00  2.93           H  
ATOM    508  N   GLU A  32      19.217  15.291   4.472  1.00  1.74           N  
ATOM    509  CA  GLU A  32      19.771  16.159   3.437  1.00  1.88           C  
ATOM    510  C   GLU A  32      20.088  15.436   2.119  1.00  1.67           C  
ATOM    511  O   GLU A  32      21.072  15.757   1.449  1.00  1.98           O  
ATOM    512  CB  GLU A  32      21.042  16.877   3.935  1.00  2.58           C  
ATOM    513  CG  GLU A  32      20.848  17.796   5.147  1.00  2.58           C  
ATOM    514  CD  GLU A  32      22.123  18.517   5.532  1.00  2.58           C  
ATOM    515  OE1 GLU A  32      23.162  18.101   5.079  1.00  2.58           O  
ATOM    516  OE2 GLU A  32      22.055  19.475   6.267  1.00  2.58           O  
ATOM    517  H   GLU A  32      18.248  15.480   4.733  1.00  2.09           H  
ATOM    518  HA  GLU A  32      19.021  16.919   3.215  1.00  2.26           H  
ATOM    519 1HB  GLU A  32      21.822  16.162   4.171  1.00  3.10           H  
ATOM    520 2HB  GLU A  32      21.427  17.503   3.131  1.00  3.10           H  
ATOM    521 1HG  GLU A  32      20.077  18.529   4.915  1.00  3.10           H  
ATOM    522 2HG  GLU A  32      20.502  17.198   5.989  1.00  3.10           H  
ATOM    523  N   GLY A  33      19.218  14.506   1.704  1.00  1.57           N  
ATOM    524  CA  GLY A  33      19.379  13.841   0.424  1.00  1.78           C  
ATOM    525  C   GLY A  33      18.829  14.743  -0.677  1.00  1.66           C  
ATOM    526  O   GLY A  33      18.603  15.936  -0.466  1.00  1.73           O  
ATOM    527  H   GLY A  33      18.444  14.205   2.294  1.00  1.88           H  
ATOM    528 1HA  GLY A  33      20.433  13.628   0.247  1.00  2.14           H  
ATOM    529 2HA  GLY A  33      18.844  12.892   0.433  1.00  2.14           H  
ATOM    530  N   ALA A  34      18.617  14.187  -1.863  1.00  1.68           N  
ATOM    531  CA  ALA A  34      18.165  15.001  -2.986  1.00  1.75           C  
ATOM    532  C   ALA A  34      17.404  14.186  -4.007  1.00  1.50           C  
ATOM    533  O   ALA A  34      17.583  12.965  -4.086  1.00  1.27           O  
ATOM    534  CB  ALA A  34      19.360  15.654  -3.664  1.00  2.43           C  
ATOM    535  H   ALA A  34      18.784  13.202  -1.989  1.00  2.02           H  
ATOM    536  HA  ALA A  34      17.494  15.771  -2.598  1.00  2.10           H  
ATOM    537 1HB  ALA A  34      19.018  16.282  -4.482  1.00  2.92           H  
ATOM    538 2HB  ALA A  34      19.895  16.267  -2.935  1.00  2.92           H  
ATOM    539 3HB  ALA A  34      20.025  14.887  -4.048  1.00  2.92           H  
ATOM    540  N   CYS A  35      16.603  14.873  -4.825  1.00  1.73           N  
ATOM    541  CA  CYS A  35      15.856  14.229  -5.896  1.00  1.69           C  
ATOM    542  C   CYS A  35      16.758  13.585  -6.943  1.00  1.53           C  
ATOM    543  O   CYS A  35      16.390  12.565  -7.520  1.00  1.50           O  
ATOM    544  CB  CYS A  35      14.921  15.216  -6.581  1.00  2.38           C  
ATOM    545  SG  CYS A  35      13.552  15.740  -5.540  1.00  2.38           S  
ATOM    546  H   CYS A  35      16.493  15.868  -4.676  1.00  2.08           H  
ATOM    547  HA  CYS A  35      15.237  13.454  -5.446  1.00  2.03           H  
ATOM    548 1HB  CYS A  35      15.474  16.101  -6.894  1.00  2.86           H  
ATOM    549 2HB  CYS A  35      14.504  14.753  -7.476  1.00  2.86           H  
ATOM    550  HG  CYS A  35      13.228  14.511  -5.108  1.00  2.86           H  
ATOM    551  N   VAL A  36      17.938  14.153  -7.204  1.00  1.63           N  
ATOM    552  CA  VAL A  36      18.788  13.523  -8.207  1.00  1.82           C  
ATOM    553  C   VAL A  36      19.332  12.209  -7.658  1.00  1.62           C  
ATOM    554  O   VAL A  36      19.410  11.211  -8.380  1.00  1.96           O  
ATOM    555  CB  VAL A  36      19.938  14.467  -8.648  1.00  2.47           C  
ATOM    556  CG1 VAL A  36      21.038  14.619  -7.552  1.00  2.47           C  
ATOM    557  CG2 VAL A  36      20.539  13.932  -9.950  1.00  2.47           C  
ATOM    558  H   VAL A  36      18.208  15.006  -6.737  1.00  1.96           H  
ATOM    559  HA  VAL A  36      18.180  13.304  -9.087  1.00  2.18           H  
ATOM    560  HB  VAL A  36      19.520  15.458  -8.818  1.00  2.96           H  
ATOM    561 1HG1 VAL A  36      21.796  15.313  -7.909  1.00  2.96           H  
ATOM    562 2HG1 VAL A  36      20.602  15.012  -6.638  1.00  2.96           H  
ATOM    563 3HG1 VAL A  36      21.522  13.671  -7.344  1.00  2.96           H  
ATOM    564 1HG2 VAL A  36      21.325  14.604 -10.291  1.00  2.96           H  
ATOM    565 2HG2 VAL A  36      20.956  12.947  -9.795  1.00  2.96           H  
ATOM    566 3HG2 VAL A  36      19.759  13.872 -10.710  1.00  2.96           H  
ATOM    567  N   ASN A  37      19.663  12.199  -6.365  1.00  1.32           N  
ATOM    568  CA  ASN A  37      20.180  11.012  -5.716  1.00  1.47           C  
ATOM    569  C   ASN A  37      19.093   9.962  -5.682  1.00  1.30           C  
ATOM    570  O   ASN A  37      19.364   8.766  -5.783  1.00  1.39           O  
ATOM    571  CB  ASN A  37      20.672  11.353  -4.330  1.00  2.00           C  
ATOM    572  CG  ASN A  37      21.932  12.156  -4.373  1.00  2.00           C  
ATOM    573  OD1 ASN A  37      22.684  12.119  -5.353  1.00  2.00           O  
ATOM    574  ND2 ASN A  37      22.181  12.902  -3.329  1.00  2.00           N  
ATOM    575  H   ASN A  37      19.585  13.060  -5.844  1.00  1.58           H  
ATOM    576  HA  ASN A  37      20.999  10.613  -6.300  1.00  1.76           H  
ATOM    577 1HB  ASN A  37      19.909  11.919  -3.802  1.00  2.40           H  
ATOM    578 2HB  ASN A  37      20.849  10.437  -3.771  1.00  2.40           H  
ATOM    579 1HD2 ASN A  37      23.010  13.464  -3.307  1.00  2.40           H  
ATOM    580 2HD2 ASN A  37      21.553  12.916  -2.552  1.00  2.40           H  
ATOM    581  N   CYS A  38      17.857  10.422  -5.539  1.00  1.16           N  
ATOM    582  CA  CYS A  38      16.706   9.554  -5.534  1.00  1.06           C  
ATOM    583  C   CYS A  38      16.506   8.874  -6.887  1.00  1.05           C  
ATOM    584  O   CYS A  38      16.412   7.647  -6.984  1.00  1.05           O  
ATOM    585  CB  CYS A  38      15.467  10.364  -5.232  1.00  1.53           C  
ATOM    586  SG  CYS A  38      14.078   9.421  -5.124  1.00  1.53           S  
ATOM    587  H   CYS A  38      17.734  11.422  -5.369  1.00  1.39           H  
ATOM    588  HA  CYS A  38      16.844   8.796  -4.767  1.00  1.27           H  
ATOM    589 1HB  CYS A  38      15.593  10.930  -4.313  1.00  1.84           H  
ATOM    590 2HB  CYS A  38      15.296  11.068  -6.018  1.00  1.84           H  
ATOM    591  HG  CYS A  38      14.504   8.665  -4.107  1.00  1.84           H  
ATOM    592  N   GLU A  39      16.532   9.646  -7.973  1.00  1.13           N  
ATOM    593  CA  GLU A  39      16.325   9.035  -9.277  1.00  1.18           C  
ATOM    594  C   GLU A  39      17.396   7.992  -9.597  1.00  1.19           C  
ATOM    595  O   GLU A  39      17.109   6.994 -10.283  1.00  1.23           O  
ATOM    596  CB  GLU A  39      16.240  10.087 -10.385  1.00  1.63           C  
ATOM    597  CG  GLU A  39      14.954  10.928 -10.359  1.00  1.63           C  
ATOM    598  CD  GLU A  39      14.870  11.934 -11.492  1.00  1.63           C  
ATOM    599  OE1 GLU A  39      15.820  12.050 -12.233  1.00  1.63           O  
ATOM    600  OE2 GLU A  39      13.851  12.574 -11.616  1.00  1.63           O  
ATOM    601  H   GLU A  39      16.632  10.664  -7.881  1.00  1.36           H  
ATOM    602  HA  GLU A  39      15.372   8.519  -9.252  1.00  1.42           H  
ATOM    603 1HB  GLU A  39      17.085  10.776 -10.282  1.00  1.96           H  
ATOM    604 2HB  GLU A  39      16.323   9.607 -11.357  1.00  1.96           H  
ATOM    605 1HG  GLU A  39      14.096  10.257 -10.419  1.00  1.96           H  
ATOM    606 2HG  GLU A  39      14.896  11.451  -9.405  1.00  1.96           H  
ATOM    607  N   MET A  40      18.633   8.245  -9.138  1.00  1.23           N  
ATOM    608  CA  MET A  40      19.757   7.340  -9.355  1.00  1.34           C  
ATOM    609  C   MET A  40      19.817   6.117  -8.415  1.00  1.27           C  
ATOM    610  O   MET A  40      20.124   5.010  -8.866  1.00  1.34           O  
ATOM    611  CB  MET A  40      21.057   8.108  -9.166  1.00  1.83           C  
ATOM    612  CG  MET A  40      21.368   9.151 -10.211  1.00  1.83           C  
ATOM    613  SD  MET A  40      23.035   9.848 -10.022  1.00  1.83           S  
ATOM    614  CE  MET A  40      22.920  10.772  -8.475  1.00  1.83           C  
ATOM    615  H   MET A  40      18.795   9.134  -8.650  1.00  1.48           H  
ATOM    616  HA  MET A  40      19.694   6.970 -10.375  1.00  1.61           H  
ATOM    617 1HB  MET A  40      21.011   8.608  -8.205  1.00  2.20           H  
ATOM    618 2HB  MET A  40      21.890   7.404  -9.128  1.00  2.20           H  
ATOM    619 1HG  MET A  40      21.294   8.697 -11.197  1.00  2.20           H  
ATOM    620 2HG  MET A  40      20.643   9.958 -10.155  1.00  2.20           H  
ATOM    621 1HE  MET A  40      23.870  11.262  -8.271  1.00  2.20           H  
ATOM    622 2HE  MET A  40      22.142  11.513  -8.542  1.00  2.20           H  
ATOM    623 3HE  MET A  40      22.703  10.092  -7.665  1.00  2.20           H  
ATOM    624  N   HIS A  41      19.548   6.307  -7.108  1.00  1.20           N  
ATOM    625  CA  HIS A  41      19.749   5.227  -6.137  1.00  1.24           C  
ATOM    626  C   HIS A  41      18.541   4.798  -5.277  1.00  1.14           C  
ATOM    627  O   HIS A  41      18.669   3.893  -4.440  1.00  1.18           O  
ATOM    628  CB  HIS A  41      20.864   5.664  -5.191  1.00  1.72           C  
ATOM    629  CG  HIS A  41      22.148   5.988  -5.904  1.00  1.72           C  
ATOM    630  ND1 HIS A  41      22.936   5.033  -6.511  1.00  1.72           N  
ATOM    631  CD2 HIS A  41      22.762   7.179  -6.112  1.00  1.72           C  
ATOM    632  CE1 HIS A  41      23.986   5.625  -7.060  1.00  1.72           C  
ATOM    633  NE2 HIS A  41      23.904   6.925  -6.832  1.00  1.72           N  
ATOM    634  H   HIS A  41      19.298   7.232  -6.759  1.00  1.44           H  
ATOM    635  HA  HIS A  41      20.086   4.345  -6.673  1.00  1.49           H  
ATOM    636 1HB  HIS A  41      20.543   6.551  -4.641  1.00  2.06           H  
ATOM    637 2HB  HIS A  41      21.060   4.876  -4.465  1.00  2.06           H  
ATOM    638  HD1 HIS A  41      22.620   4.126  -6.796  1.00  2.06           H  
ATOM    639  HD2 HIS A  41      22.505   8.202  -5.825  1.00  2.06           H  
ATOM    640  HE1 HIS A  41      24.734   5.041  -7.594  1.00  2.06           H  
ATOM    641  N   ALA A  42      17.351   5.368  -5.486  1.00  1.07           N  
ATOM    642  CA  ALA A  42      16.198   5.038  -4.649  1.00  1.05           C  
ATOM    643  C   ALA A  42      15.831   3.572  -4.656  1.00  1.03           C  
ATOM    644  O   ALA A  42      15.313   3.079  -3.657  1.00  1.04           O  
ATOM    645  CB  ALA A  42      14.980   5.835  -5.059  1.00  1.48           C  
ATOM    646  H   ALA A  42      17.224   6.107  -6.183  1.00  1.28           H  
ATOM    647  HA  ALA A  42      16.458   5.297  -3.631  1.00  1.26           H  
ATOM    648 1HB  ALA A  42      14.151   5.610  -4.394  1.00  1.78           H  
ATOM    649 2HB  ALA A  42      15.224   6.862  -4.987  1.00  1.78           H  
ATOM    650 3HB  ALA A  42      14.703   5.595  -6.083  1.00  1.78           H  
ATOM    651  N   LEU A  43      16.148   2.834  -5.719  1.00  1.06           N  
ATOM    652  CA  LEU A  43      15.777   1.426  -5.812  1.00  1.10           C  
ATOM    653  C   LEU A  43      16.263   0.601  -4.603  1.00  1.09           C  
ATOM    654  O   LEU A  43      15.684  -0.448  -4.294  1.00  1.11           O  
ATOM    655  CB  LEU A  43      16.310   0.837  -7.135  1.00  1.52           C  
ATOM    656  CG  LEU A  43      17.826   0.419  -7.250  1.00  1.52           C  
ATOM    657  CD1 LEU A  43      18.000  -0.315  -8.571  1.00  1.52           C  
ATOM    658  CD2 LEU A  43      18.763   1.624  -7.181  1.00  1.52           C  
ATOM    659  H   LEU A  43      16.595   3.272  -6.518  1.00  1.27           H  
ATOM    660  HA  LEU A  43      14.700   1.358  -5.858  1.00  1.32           H  
ATOM    661 1HB  LEU A  43      15.716  -0.037  -7.376  1.00  1.82           H  
ATOM    662 2HB  LEU A  43      16.128   1.571  -7.916  1.00  1.82           H  
ATOM    663  HG  LEU A  43      18.074  -0.276  -6.444  1.00  1.82           H  
ATOM    664 1HD1 LEU A  43      19.031  -0.651  -8.670  1.00  1.82           H  
ATOM    665 2HD1 LEU A  43      17.339  -1.158  -8.596  1.00  1.82           H  
ATOM    666 3HD1 LEU A  43      17.754   0.351  -9.396  1.00  1.82           H  
ATOM    667 1HD2 LEU A  43      19.793   1.284  -7.276  1.00  1.82           H  
ATOM    668 2HD2 LEU A  43      18.542   2.325  -7.988  1.00  1.82           H  
ATOM    669 3HD2 LEU A  43      18.655   2.114  -6.238  1.00  1.82           H  
ATOM    670  N   ASN A  44      17.312   1.058  -3.906  1.00  1.13           N  
ATOM    671  CA  ASN A  44      17.820   0.305  -2.770  1.00  1.21           C  
ATOM    672  C   ASN A  44      16.928   0.518  -1.533  1.00  1.16           C  
ATOM    673  O   ASN A  44      16.765  -0.387  -0.697  1.00  1.21           O  
ATOM    674  CB  ASN A  44      19.244   0.719  -2.517  1.00  1.66           C  
ATOM    675  CG  ASN A  44      20.156   0.241  -3.616  1.00  1.66           C  
ATOM    676  OD1 ASN A  44      19.903  -0.769  -4.288  1.00  1.66           O  
ATOM    677  ND2 ASN A  44      21.220   0.967  -3.825  1.00  1.66           N  
ATOM    678  H   ASN A  44      17.739   1.964  -4.142  1.00  1.36           H  
ATOM    679  HA  ASN A  44      17.794  -0.757  -3.017  1.00  1.45           H  
ATOM    680 1HB  ASN A  44      19.302   1.808  -2.457  1.00  1.99           H  
ATOM    681 2HB  ASN A  44      19.584   0.314  -1.565  1.00  1.99           H  
ATOM    682 1HD2 ASN A  44      21.865   0.710  -4.542  1.00  1.99           H  
ATOM    683 2HD2 ASN A  44      21.391   1.780  -3.267  1.00  1.99           H  
ATOM    684  N   GLU A  45      16.373   1.730  -1.420  1.00  1.12           N  
ATOM    685  CA  GLU A  45      15.510   2.117  -0.314  1.00  1.16           C  
ATOM    686  C   GLU A  45      14.181   1.462  -0.554  1.00  1.07           C  
ATOM    687  O   GLU A  45      13.525   0.987   0.377  1.00  1.09           O  
ATOM    688  CB  GLU A  45      15.326   3.629  -0.268  1.00  1.61           C  
ATOM    689  CG  GLU A  45      14.514   4.160   0.915  1.00  1.61           C  
ATOM    690  CD  GLU A  45      15.211   3.971   2.230  1.00  1.61           C  
ATOM    691  OE1 GLU A  45      16.408   3.810   2.222  1.00  1.61           O  
ATOM    692  OE2 GLU A  45      14.557   4.002   3.240  1.00  1.61           O  
ATOM    693  H   GLU A  45      16.517   2.405  -2.162  1.00  1.34           H  
ATOM    694  HA  GLU A  45      15.929   1.757   0.627  1.00  1.39           H  
ATOM    695 1HB  GLU A  45      16.300   4.109  -0.253  1.00  1.93           H  
ATOM    696 2HB  GLU A  45      14.826   3.931  -1.177  1.00  1.93           H  
ATOM    697 1HG  GLU A  45      14.320   5.217   0.763  1.00  1.93           H  
ATOM    698 2HG  GLU A  45      13.552   3.650   0.946  1.00  1.93           H  
ATOM    699  N   ILE A  46      13.796   1.445  -1.833  1.00  1.02           N  
ATOM    700  CA  ILE A  46      12.542   0.888  -2.277  1.00  0.99           C  
ATOM    701  C   ILE A  46      12.530  -0.585  -1.933  1.00  0.92           C  
ATOM    702  O   ILE A  46      11.569  -1.072  -1.345  1.00  0.92           O  
ATOM    703  CB  ILE A  46      12.338   1.153  -3.784  1.00  1.40           C  
ATOM    704  CG1 ILE A  46      12.126   2.691  -3.995  1.00  1.40           C  
ATOM    705  CG2 ILE A  46      11.175   0.339  -4.361  1.00  1.40           C  
ATOM    706  CD1 ILE A  46      12.231   3.163  -5.416  1.00  1.40           C  
ATOM    707  H   ILE A  46      14.420   1.870  -2.521  1.00  1.22           H  
ATOM    708  HA  ILE A  46      11.747   1.384  -1.739  1.00  1.19           H  
ATOM    709  HB  ILE A  46      13.235   0.870  -4.292  1.00  1.68           H  
ATOM    710 1HG1 ILE A  46      11.138   2.951  -3.629  1.00  1.68           H  
ATOM    711 2HG1 ILE A  46      12.857   3.229  -3.401  1.00  1.68           H  
ATOM    712 1HG2 ILE A  46      11.071   0.521  -5.424  1.00  1.68           H  
ATOM    713 2HG2 ILE A  46      11.362  -0.710  -4.204  1.00  1.68           H  
ATOM    714 3HG2 ILE A  46      10.264   0.608  -3.880  1.00  1.68           H  
ATOM    715 1HD1 ILE A  46      12.071   4.240  -5.435  1.00  1.68           H  
ATOM    716 2HD1 ILE A  46      13.201   2.957  -5.807  1.00  1.68           H  
ATOM    717 3HD1 ILE A  46      11.489   2.672  -6.030  1.00  1.68           H  
ATOM    718  N   GLN A  47      13.596  -1.330  -2.227  1.00  0.92           N  
ATOM    719  CA  GLN A  47      13.551  -2.716  -1.797  1.00  0.92           C  
ATOM    720  C   GLN A  47      13.236  -2.854  -0.315  1.00  0.91           C  
ATOM    721  O   GLN A  47      12.320  -3.587   0.053  1.00  0.93           O  
ATOM    722  CB  GLN A  47      14.863  -3.449  -2.057  1.00  1.29           C  
ATOM    723  CG  GLN A  47      14.915  -4.883  -1.428  1.00  1.29           C  
ATOM    724  CD  GLN A  47      16.180  -5.631  -1.725  1.00  1.29           C  
ATOM    725  OE1 GLN A  47      17.024  -5.160  -2.477  1.00  1.29           O  
ATOM    726  NE2 GLN A  47      16.322  -6.808  -1.134  1.00  1.29           N  
ATOM    727  H   GLN A  47      14.394  -0.960  -2.760  1.00  1.10           H  
ATOM    728  HA  GLN A  47      12.763  -3.215  -2.359  1.00  1.10           H  
ATOM    729 1HB  GLN A  47      14.993  -3.545  -3.117  1.00  1.55           H  
ATOM    730 2HB  GLN A  47      15.700  -2.859  -1.672  1.00  1.55           H  
ATOM    731 1HG  GLN A  47      14.880  -4.782  -0.345  1.00  1.55           H  
ATOM    732 2HG  GLN A  47      14.080  -5.473  -1.742  1.00  1.55           H  
ATOM    733 1HE2 GLN A  47      17.159  -7.366  -1.297  1.00  1.55           H  
ATOM    734 2HE2 GLN A  47      15.606  -7.157  -0.526  1.00  1.55           H  
ATOM    735  N   GLU A  48      13.929  -2.141   0.566  1.00  0.97           N  
ATOM    736  CA  GLU A  48      13.588  -2.375   1.970  1.00  1.06           C  
ATOM    737  C   GLU A  48      12.158  -1.935   2.325  1.00  1.01           C  
ATOM    738  O   GLU A  48      11.378  -2.707   2.898  1.00  1.08           O  
ATOM    739  CB  GLU A  48      14.581  -1.683   2.900  1.00  1.45           C  
ATOM    740  CG  GLU A  48      14.301  -1.928   4.391  1.00  1.45           C  
ATOM    741  CD  GLU A  48      15.328  -1.335   5.290  1.00  1.45           C  
ATOM    742  OE1 GLU A  48      16.281  -0.794   4.790  1.00  1.45           O  
ATOM    743  OE2 GLU A  48      15.164  -1.416   6.482  1.00  1.45           O  
ATOM    744  H   GLU A  48      14.687  -1.508   0.270  1.00  1.16           H  
ATOM    745  HA  GLU A  48      13.656  -3.446   2.154  1.00  1.27           H  
ATOM    746 1HB  GLU A  48      15.589  -2.032   2.677  1.00  1.74           H  
ATOM    747 2HB  GLU A  48      14.558  -0.604   2.718  1.00  1.74           H  
ATOM    748 1HG  GLU A  48      13.333  -1.499   4.648  1.00  1.74           H  
ATOM    749 2HG  GLU A  48      14.245  -3.003   4.568  1.00  1.74           H  
ATOM    750  N   VAL A  49      11.819  -0.701   1.971  1.00  0.97           N  
ATOM    751  CA  VAL A  49      10.533  -0.109   2.313  1.00  1.06           C  
ATOM    752  C   VAL A  49       9.313  -0.784   1.695  1.00  0.99           C  
ATOM    753  O   VAL A  49       8.267  -0.861   2.332  1.00  1.12           O  
ATOM    754  CB  VAL A  49      10.545   1.396   1.967  1.00  1.45           C  
ATOM    755  CG1 VAL A  49       9.127   2.010   2.115  1.00  1.45           C  
ATOM    756  CG2 VAL A  49      11.530   2.105   2.892  1.00  1.45           C  
ATOM    757  H   VAL A  49      12.504  -0.138   1.459  1.00  1.16           H  
ATOM    758  HA  VAL A  49      10.431  -0.186   3.396  1.00  1.27           H  
ATOM    759  HB  VAL A  49      10.875   1.527   0.945  1.00  1.74           H  
ATOM    760 1HG1 VAL A  49       9.168   3.069   1.860  1.00  1.74           H  
ATOM    761 2HG1 VAL A  49       8.429   1.523   1.445  1.00  1.74           H  
ATOM    762 3HG1 VAL A  49       8.781   1.892   3.141  1.00  1.74           H  
ATOM    763 1HG2 VAL A  49      11.571   3.167   2.648  1.00  1.74           H  
ATOM    764 2HG2 VAL A  49      11.218   1.981   3.926  1.00  1.74           H  
ATOM    765 3HG2 VAL A  49      12.531   1.678   2.767  1.00  1.74           H  
ATOM    766  N   PHE A  50       9.395  -1.155   0.424  1.00  0.87           N  
ATOM    767  CA  PHE A  50       8.279  -1.730  -0.297  1.00  0.91           C  
ATOM    768  C   PHE A  50       8.151  -3.248  -0.073  1.00  0.94           C  
ATOM    769  O   PHE A  50       7.025  -3.765   0.015  1.00  1.07           O  
ATOM    770  CB  PHE A  50       8.413  -1.366  -1.779  1.00  1.26           C  
ATOM    771  CG  PHE A  50       8.232   0.164  -2.084  1.00  1.26           C  
ATOM    772  CD1 PHE A  50       9.019   1.148  -1.487  1.00  1.26           C  
ATOM    773  CD2 PHE A  50       7.337   0.600  -2.991  1.00  1.26           C  
ATOM    774  CE1 PHE A  50       8.891   2.470  -1.774  1.00  1.26           C  
ATOM    775  CE2 PHE A  50       7.220   1.957  -3.281  1.00  1.26           C  
ATOM    776  CZ  PHE A  50       7.996   2.867  -2.672  1.00  1.26           C  
ATOM    777  H   PHE A  50      10.275  -1.051  -0.079  1.00  1.04           H  
ATOM    778  HA  PHE A  50       7.367  -1.259   0.069  1.00  1.09           H  
ATOM    779 1HB  PHE A  50       9.379  -1.678  -2.151  1.00  1.51           H  
ATOM    780 2HB  PHE A  50       7.667  -1.905  -2.343  1.00  1.51           H  
ATOM    781  HD1 PHE A  50       9.755   0.885  -0.791  1.00  1.51           H  
ATOM    782  HD2 PHE A  50       6.729  -0.122  -3.491  1.00  1.51           H  
ATOM    783  HE1 PHE A  50       9.525   3.210  -1.274  1.00  1.51           H  
ATOM    784  HE2 PHE A  50       6.508   2.314  -4.012  1.00  1.51           H  
ATOM    785  HZ  PHE A  50       7.893   3.925  -2.905  1.00  1.51           H  
ATOM    786  N   THR A  51       9.277  -3.983   0.111  1.00  0.92           N  
ATOM    787  CA  THR A  51       9.138  -5.426   0.322  1.00  1.06           C  
ATOM    788  C   THR A  51       8.581  -5.665   1.732  1.00  1.16           C  
ATOM    789  O   THR A  51       7.915  -6.672   1.992  1.00  1.29           O  
ATOM    790  CB  THR A  51      10.448  -6.210   0.086  1.00  1.42           C  
ATOM    791  OG1 THR A  51      11.460  -5.811   1.015  1.00  1.42           O  
ATOM    792  CG2 THR A  51      10.952  -5.992  -1.368  1.00  1.42           C  
ATOM    793  H   THR A  51      10.220  -3.592   0.063  1.00  1.10           H  
ATOM    794  HA  THR A  51       8.419  -5.813  -0.388  1.00  1.27           H  
ATOM    795  HB  THR A  51      10.248  -7.272   0.225  1.00  1.70           H  
ATOM    796  HG1 THR A  51      11.733  -4.900   0.820  1.00  1.70           H  
ATOM    797 1HG2 THR A  51      11.859  -6.568  -1.520  1.00  1.70           H  
ATOM    798 2HG2 THR A  51      10.202  -6.314  -2.066  1.00  1.70           H  
ATOM    799 3HG2 THR A  51      11.151  -4.950  -1.543  1.00  1.70           H  
ATOM    800  N   LEU A  52       8.702  -4.653   2.601  1.00  1.19           N  
ATOM    801  CA  LEU A  52       8.114  -4.635   3.933  1.00  1.38           C  
ATOM    802  C   LEU A  52       6.600  -4.873   3.885  1.00  1.45           C  
ATOM    803  O   LEU A  52       6.014  -5.359   4.853  1.00  1.62           O  
ATOM    804  CB  LEU A  52       8.353  -3.264   4.574  1.00  1.86           C  
ATOM    805  CG  LEU A  52       7.892  -3.023   6.034  1.00  1.86           C  
ATOM    806  CD1 LEU A  52       8.619  -3.963   7.003  1.00  1.86           C  
ATOM    807  CD2 LEU A  52       8.154  -1.548   6.364  1.00  1.86           C  
ATOM    808  H   LEU A  52       9.345  -3.884   2.380  1.00  1.43           H  
ATOM    809  HA  LEU A  52       8.581  -5.422   4.518  1.00  1.66           H  
ATOM    810 1HB  LEU A  52       9.414  -3.035   4.511  1.00  2.23           H  
ATOM    811 2HB  LEU A  52       7.820  -2.541   3.975  1.00  2.23           H  
ATOM    812  HG  LEU A  52       6.821  -3.219   6.119  1.00  2.23           H  
ATOM    813 1HD1 LEU A  52       8.277  -3.766   8.020  1.00  2.23           H  
ATOM    814 2HD1 LEU A  52       8.401  -4.997   6.751  1.00  2.23           H  
ATOM    815 3HD1 LEU A  52       9.693  -3.790   6.941  1.00  2.23           H  
ATOM    816 1HD2 LEU A  52       7.821  -1.335   7.379  1.00  2.23           H  
ATOM    817 2HD2 LEU A  52       9.221  -1.338   6.278  1.00  2.23           H  
ATOM    818 3HD2 LEU A  52       7.603  -0.922   5.658  1.00  2.23           H  
ATOM    819  N   HIS A  53       5.957  -4.461   2.784  1.00  1.40           N  
ATOM    820  CA  HIS A  53       4.514  -4.550   2.613  1.00  1.60           C  
ATOM    821  C   HIS A  53       4.113  -5.710   1.707  1.00  1.64           C  
ATOM    822  O   HIS A  53       2.974  -5.776   1.234  1.00  1.87           O  
ATOM    823  CB  HIS A  53       3.998  -3.267   1.989  1.00  2.16           C  
ATOM    824  CG  HIS A  53       4.189  -2.057   2.826  1.00  2.16           C  
ATOM    825  ND1 HIS A  53       3.405  -1.773   3.921  1.00  2.16           N  
ATOM    826  CD2 HIS A  53       5.079  -1.055   2.730  1.00  2.16           C  
ATOM    827  CE1 HIS A  53       3.813  -0.640   4.462  1.00  2.16           C  
ATOM    828  NE2 HIS A  53       4.827  -0.187   3.758  1.00  2.16           N  
ATOM    829  H   HIS A  53       6.484  -4.105   1.988  1.00  1.68           H  
ATOM    830  HA  HIS A  53       4.038  -4.691   3.581  1.00  1.92           H  
ATOM    831 1HB  HIS A  53       4.533  -3.118   1.065  1.00  2.59           H  
ATOM    832 2HB  HIS A  53       2.944  -3.373   1.755  1.00  2.59           H  
ATOM    833  HD2 HIS A  53       5.849  -0.959   1.974  1.00  2.59           H  
ATOM    834  HE1 HIS A  53       3.383  -0.161   5.342  1.00  2.59           H  
ATOM    835  HE2 HIS A  53       5.340   0.663   3.939  1.00  2.59           H  
ATOM    836  N   GLY A  54       5.044  -6.627   1.452  1.00  1.53           N  
ATOM    837  CA  GLY A  54       4.764  -7.783   0.618  1.00  1.67           C  
ATOM    838  C   GLY A  54       5.162  -7.670  -0.856  1.00  1.60           C  
ATOM    839  O   GLY A  54       4.778  -8.534  -1.648  1.00  1.78           O  
ATOM    840  H   GLY A  54       5.983  -6.541   1.851  1.00  1.84           H  
ATOM    841 1HA  GLY A  54       5.276  -8.642   1.050  1.00  2.00           H  
ATOM    842 2HA  GLY A  54       3.701  -8.007   0.678  1.00  2.00           H  
ATOM    843  N   MET A  55       5.912  -6.636  -1.255  1.00  1.40           N  
ATOM    844  CA  MET A  55       6.313  -6.549  -2.650  1.00  1.39           C  
ATOM    845  C   MET A  55       7.556  -7.376  -2.870  1.00  1.25           C  
ATOM    846  O   MET A  55       8.241  -7.763  -1.923  1.00  1.19           O  
ATOM    847  CB  MET A  55       6.618  -5.115  -3.065  1.00  1.95           C  
ATOM    848  CG  MET A  55       5.482  -4.156  -2.935  1.00  1.95           C  
ATOM    849  SD  MET A  55       4.106  -4.519  -4.007  1.00  1.95           S  
ATOM    850  CE  MET A  55       2.971  -5.262  -2.819  1.00  1.95           C  
ATOM    851  H   MET A  55       6.225  -5.887  -0.633  1.00  1.68           H  
ATOM    852  HA  MET A  55       5.527  -6.959  -3.280  1.00  1.67           H  
ATOM    853 1HB  MET A  55       7.441  -4.741  -2.471  1.00  2.34           H  
ATOM    854 2HB  MET A  55       6.946  -5.105  -4.104  1.00  2.34           H  
ATOM    855 1HG  MET A  55       5.130  -4.182  -1.905  1.00  2.34           H  
ATOM    856 2HG  MET A  55       5.830  -3.158  -3.145  1.00  2.34           H  
ATOM    857 1HE  MET A  55       2.052  -5.554  -3.315  1.00  2.34           H  
ATOM    858 2HE  MET A  55       3.410  -6.137  -2.382  1.00  2.34           H  
ATOM    859 3HE  MET A  55       2.749  -4.549  -2.029  1.00  2.34           H  
ATOM    860  N   LYS A  56       7.851  -7.656  -4.123  1.00  1.46           N  
ATOM    861  CA  LYS A  56       9.106  -8.303  -4.455  1.00  1.62           C  
ATOM    862  C   LYS A  56       9.891  -7.233  -5.186  1.00  1.47           C  
ATOM    863  O   LYS A  56       9.354  -6.603  -6.098  1.00  1.30           O  
ATOM    864  CB  LYS A  56       8.891  -9.549  -5.319  1.00  2.20           C  
ATOM    865  CG  LYS A  56       7.936 -10.600  -4.720  1.00  2.20           C  
ATOM    866  CD  LYS A  56       8.476 -11.232  -3.437  1.00  2.20           C  
ATOM    867  CE  LYS A  56       7.548 -12.337  -2.935  1.00  2.20           C  
ATOM    868  NZ  LYS A  56       8.026 -12.929  -1.647  1.00  2.20           N  
ATOM    869  H   LYS A  56       7.214  -7.357  -4.848  1.00  1.75           H  
ATOM    870  HA  LYS A  56       9.651  -8.566  -3.549  1.00  1.94           H  
ATOM    871 1HB  LYS A  56       8.503  -9.262  -6.285  1.00  2.64           H  
ATOM    872 2HB  LYS A  56       9.851 -10.035  -5.493  1.00  2.64           H  
ATOM    873 1HG  LYS A  56       6.978 -10.125  -4.496  1.00  2.64           H  
ATOM    874 2HG  LYS A  56       7.764 -11.384  -5.456  1.00  2.64           H  
ATOM    875 1HD  LYS A  56       9.467 -11.647  -3.617  1.00  2.64           H  
ATOM    876 2HD  LYS A  56       8.549 -10.472  -2.658  1.00  2.64           H  
ATOM    877 1HE  LYS A  56       6.552 -11.920  -2.783  1.00  2.64           H  
ATOM    878 2HE  LYS A  56       7.492 -13.124  -3.685  1.00  2.64           H  
ATOM    879 1HZ  LYS A  56       7.385 -13.652  -1.348  1.00  2.64           H  
ATOM    880 2HZ  LYS A  56       8.945 -13.328  -1.775  1.00  2.64           H  
ATOM    881 3HZ  LYS A  56       8.068 -12.204  -0.942  1.00  2.64           H  
ATOM    882  N   CYS A  57      11.161  -7.053  -4.830  1.00  1.74           N  
ATOM    883  CA  CYS A  57      11.980  -5.980  -5.404  1.00  1.81           C  
ATOM    884  C   CYS A  57      12.374  -6.184  -6.856  1.00  1.76           C  
ATOM    885  O   CYS A  57      12.865  -5.259  -7.519  1.00  1.77           O  
ATOM    886  CB  CYS A  57      13.186  -5.743  -4.536  1.00  2.51           C  
ATOM    887  SG  CYS A  57      14.269  -7.098  -4.459  1.00  2.51           S  
ATOM    888  H   CYS A  57      11.557  -7.650  -4.114  1.00  2.09           H  
ATOM    889  HA  CYS A  57      11.388  -5.079  -5.352  1.00  2.17           H  
ATOM    890 1HB  CYS A  57      13.735  -4.891  -4.899  1.00  3.01           H  
ATOM    891 2HB  CYS A  57      12.853  -5.512  -3.550  1.00  3.01           H  
ATOM    892  HG  CYS A  57      15.310  -6.432  -3.939  1.00  3.01           H  
ATOM    893  N   SER A  58      12.084  -7.369  -7.365  1.00  1.90           N  
ATOM    894  CA  SER A  58      12.296  -7.684  -8.752  1.00  2.05           C  
ATOM    895  C   SER A  58      11.387  -6.799  -9.618  1.00  1.81           C  
ATOM    896  O   SER A  58      11.728  -6.464 -10.754  1.00  2.03           O  
ATOM    897  CB  SER A  58      11.976  -9.135  -8.974  1.00  2.81           C  
ATOM    898  OG  SER A  58      10.605  -9.386  -8.821  1.00  2.81           O  
ATOM    899  H   SER A  58      11.690  -8.073  -6.760  1.00  2.28           H  
ATOM    900  HA  SER A  58      13.340  -7.496  -9.007  1.00  2.46           H  
ATOM    901 1HB  SER A  58      12.303  -9.424  -9.958  1.00  3.37           H  
ATOM    902 2HB  SER A  58      12.538  -9.727  -8.255  1.00  3.37           H  
ATOM    903  HG  SER A  58      10.495 -10.336  -8.928  1.00  3.37           H  
ATOM    904  N   HIS A  59      10.283  -6.287  -9.035  1.00  1.59           N  
ATOM    905  CA  HIS A  59       9.336  -5.441  -9.752  1.00  1.78           C  
ATOM    906  C   HIS A  59       9.869  -4.046  -9.912  1.00  1.79           C  
ATOM    907  O   HIS A  59       9.347  -3.266 -10.700  1.00  2.16           O  
ATOM    908  CB  HIS A  59       7.980  -5.353  -9.047  1.00  2.42           C  
ATOM    909  CG  HIS A  59       7.156  -6.593  -9.130  1.00  2.42           C  
ATOM    910  ND1 HIS A  59       7.321  -7.637  -8.271  1.00  2.42           N  
ATOM    911  CD2 HIS A  59       6.148  -6.949  -9.966  1.00  2.42           C  
ATOM    912  CE1 HIS A  59       6.460  -8.596  -8.566  1.00  2.42           C  
ATOM    913  NE2 HIS A  59       5.731  -8.203  -9.590  1.00  2.42           N  
ATOM    914  H   HIS A  59      10.052  -6.532  -8.068  1.00  1.91           H  
ATOM    915  HA  HIS A  59       9.154  -5.848 -10.733  1.00  2.14           H  
ATOM    916 1HB  HIS A  59       8.142  -5.122  -7.990  1.00  2.90           H  
ATOM    917 2HB  HIS A  59       7.409  -4.531  -9.469  1.00  2.90           H  
ATOM    918  HD1 HIS A  59       7.968  -7.663  -7.504  1.00  2.90           H  
ATOM    919  HD2 HIS A  59       5.662  -6.448 -10.800  1.00  2.90           H  
ATOM    920  HE1 HIS A  59       6.443  -9.518  -7.984  1.00  2.90           H  
ATOM    921  N   PHE A  60      10.918  -3.720  -9.170  1.00  1.66           N  
ATOM    922  CA  PHE A  60      11.454  -2.392  -9.190  1.00  1.96           C  
ATOM    923  C   PHE A  60      12.778  -2.457  -9.926  1.00  2.01           C  
ATOM    924  O   PHE A  60      13.615  -1.561  -9.837  1.00  2.47           O  
ATOM    925  CB  PHE A  60      11.563  -1.888  -7.750  1.00  2.62           C  
ATOM    926  CG  PHE A  60      10.203  -2.026  -7.018  1.00  2.62           C  
ATOM    927  CD1 PHE A  60      10.128  -2.626  -5.775  1.00  2.62           C  
ATOM    928  CD2 PHE A  60       9.008  -1.642  -7.610  1.00  2.62           C  
ATOM    929  CE1 PHE A  60       8.911  -2.818  -5.142  1.00  2.62           C  
ATOM    930  CE2 PHE A  60       7.808  -1.836  -6.995  1.00  2.62           C  
ATOM    931  CZ  PHE A  60       7.750  -2.420  -5.759  1.00  2.62           C  
ATOM    932  H   PHE A  60      11.385  -4.404  -8.575  1.00  1.99           H  
ATOM    933  HA  PHE A  60      10.797  -1.742  -9.757  1.00  2.35           H  
ATOM    934 1HB  PHE A  60      12.305  -2.475  -7.214  1.00  3.14           H  
ATOM    935 2HB  PHE A  60      11.876  -0.848  -7.734  1.00  3.14           H  
ATOM    936  HD1 PHE A  60      11.046  -2.943  -5.292  1.00  3.14           H  
ATOM    937  HD2 PHE A  60       9.023  -1.201  -8.577  1.00  3.14           H  
ATOM    938  HE1 PHE A  60       8.877  -3.290  -4.161  1.00  3.14           H  
ATOM    939  HE2 PHE A  60       6.895  -1.522  -7.502  1.00  3.14           H  
ATOM    940  HZ  PHE A  60       6.792  -2.573  -5.277  1.00  3.14           H  
ATOM    941  N   LYS A  61      12.951  -3.563 -10.661  1.00  1.91           N  
ATOM    942  CA  LYS A  61      14.085  -3.831 -11.512  1.00  2.07           C  
ATOM    943  C   LYS A  61      15.439  -3.775 -10.830  1.00  1.94           C  
ATOM    944  O   LYS A  61      16.389  -3.251 -11.415  1.00  2.16           O  
ATOM    945  CB  LYS A  61      14.079  -2.844 -12.683  1.00  2.83           C  
ATOM    946  CG  LYS A  61      12.721  -2.703 -13.420  1.00  2.83           C  
ATOM    947  CD  LYS A  61      12.299  -3.990 -14.105  1.00  2.83           C  
ATOM    948  CE  LYS A  61      11.018  -3.818 -14.933  1.00  2.83           C  
ATOM    949  NZ  LYS A  61      11.182  -2.848 -16.057  1.00  2.83           N  
ATOM    950  H   LYS A  61      12.241  -4.294 -10.649  1.00  2.29           H  
ATOM    951  HA  LYS A  61      13.970  -4.845 -11.899  1.00  2.48           H  
ATOM    952 1HB  LYS A  61      14.368  -1.856 -12.325  1.00  3.40           H  
ATOM    953 2HB  LYS A  61      14.823  -3.151 -13.416  1.00  3.40           H  
ATOM    954 1HG  LYS A  61      11.941  -2.413 -12.714  1.00  3.40           H  
ATOM    955 2HG  LYS A  61      12.809  -1.917 -14.163  1.00  3.40           H  
ATOM    956 1HD  LYS A  61      13.096  -4.331 -14.755  1.00  3.40           H  
ATOM    957 2HD  LYS A  61      12.106  -4.754 -13.354  1.00  3.40           H  
ATOM    958 1HE  LYS A  61      10.744  -4.779 -15.346  1.00  3.40           H  
ATOM    959 2HE  LYS A  61      10.212  -3.470 -14.283  1.00  3.40           H  
ATOM    960 1HZ  LYS A  61      10.309  -2.744 -16.577  1.00  3.40           H  
ATOM    961 2HZ  LYS A  61      11.385  -1.907 -15.705  1.00  3.40           H  
ATOM    962 3HZ  LYS A  61      11.907  -3.133 -16.691  1.00  3.40           H  
ATOM    963  N   LEU A  62      15.581  -4.343  -9.633  1.00  1.84           N  
ATOM    964  CA  LEU A  62      16.917  -4.298  -9.056  1.00  1.96           C  
ATOM    965  C   LEU A  62      17.841  -5.280  -9.787  1.00  2.01           C  
ATOM    966  O   LEU A  62      17.460  -6.426 -10.004  1.00  1.88           O  
ATOM    967  CB  LEU A  62      16.885  -4.615  -7.563  1.00  2.70           C  
ATOM    968  CG  LEU A  62      16.645  -3.430  -6.620  1.00  2.70           C  
ATOM    969  CD1 LEU A  62      15.230  -2.864  -6.803  1.00  2.70           C  
ATOM    970  CD2 LEU A  62      16.868  -3.890  -5.226  1.00  2.70           C  
ATOM    971  H   LEU A  62      14.777  -4.744  -9.129  1.00  2.21           H  
ATOM    972  HA  LEU A  62      17.271  -3.290  -9.185  1.00  2.35           H  
ATOM    973 1HB  LEU A  62      16.089  -5.341  -7.381  1.00  3.24           H  
ATOM    974 2HB  LEU A  62      17.831  -5.064  -7.285  1.00  3.24           H  
ATOM    975  HG  LEU A  62      17.351  -2.645  -6.835  1.00  3.24           H  
ATOM    976 1HD1 LEU A  62      15.084  -2.034  -6.119  1.00  3.24           H  
ATOM    977 2HD1 LEU A  62      15.089  -2.506  -7.817  1.00  3.24           H  
ATOM    978 3HD1 LEU A  62      14.506  -3.625  -6.593  1.00  3.24           H  
ATOM    979 1HD2 LEU A  62      16.725  -3.050  -4.545  1.00  3.24           H  
ATOM    980 2HD2 LEU A  62      16.169  -4.678  -4.984  1.00  3.24           H  
ATOM    981 3HD2 LEU A  62      17.885  -4.268  -5.115  1.00  3.24           H  
ATOM    982  N   PRO A  63      19.109  -4.907 -10.075  1.00  2.43           N  
ATOM    983  CA  PRO A  63      20.113  -5.695 -10.804  1.00  2.76           C  
ATOM    984  C   PRO A  63      20.500  -7.015 -10.144  1.00  2.74           C  
ATOM    985  O   PRO A  63      21.002  -7.924 -10.801  1.00  2.94           O  
ATOM    986  CB  PRO A  63      21.314  -4.737 -10.862  1.00  4.14           C  
ATOM    987  CG  PRO A  63      21.118  -3.780  -9.705  1.00  4.14           C  
ATOM    988  CD  PRO A  63      19.620  -3.600  -9.594  1.00  4.14           C  
ATOM    989  HA  PRO A  63      19.730  -5.885 -11.819  1.00  3.31           H  
ATOM    990 1HB  PRO A  63      22.249  -5.315 -10.768  1.00  4.97           H  
ATOM    991 2HB  PRO A  63      21.344  -4.232 -11.837  1.00  4.97           H  
ATOM    992 1HG  PRO A  63      21.572  -4.201  -8.784  1.00  4.97           H  
ATOM    993 2HG  PRO A  63      21.645  -2.834  -9.908  1.00  4.97           H  
ATOM    994 1HD  PRO A  63      19.379  -3.420  -8.535  1.00  4.97           H  
ATOM    995 2HD  PRO A  63      19.272  -2.783 -10.256  1.00  4.97           H  
ATOM    996  N   ASP A  64      20.246  -7.118  -8.850  1.00  2.71           N  
ATOM    997  CA  ASP A  64      20.565  -8.296  -8.062  1.00  2.85           C  
ATOM    998  C   ASP A  64      19.403  -9.279  -8.038  1.00  2.65           C  
ATOM    999  O   ASP A  64      19.553 -10.435  -7.641  1.00  2.98           O  
ATOM   1000  CB  ASP A  64      20.908  -7.878  -6.636  1.00  3.94           C  
ATOM   1001  CG  ASP A  64      22.155  -7.022  -6.547  1.00  3.94           C  
ATOM   1002  OD1 ASP A  64      23.204  -7.445  -6.976  1.00  3.94           O  
ATOM   1003  OD2 ASP A  64      22.036  -5.922  -6.057  1.00  3.94           O  
ATOM   1004  H   ASP A  64      19.844  -6.332  -8.364  1.00  3.25           H  
ATOM   1005  HA  ASP A  64      21.428  -8.790  -8.508  1.00  3.42           H  
ATOM   1006 1HB  ASP A  64      20.087  -7.308  -6.229  1.00  4.73           H  
ATOM   1007 2HB  ASP A  64      21.033  -8.765  -6.013  1.00  4.73           H  
ATOM   1008  N   TYR A  65      18.214  -8.778  -8.366  1.00  2.34           N  
ATOM   1009  CA  TYR A  65      16.980  -9.525  -8.271  1.00  2.35           C  
ATOM   1010  C   TYR A  65      16.128  -9.622  -9.542  1.00  2.30           C  
ATOM   1011  O   TYR A  65      14.906  -9.572  -9.408  1.00  2.51           O  
ATOM   1012  CB  TYR A  65      16.126  -8.913  -7.173  1.00  3.29           C  
ATOM   1013  CG  TYR A  65      16.783  -8.924  -5.841  1.00  3.29           C  
ATOM   1014  CD1 TYR A  65      17.433  -7.793  -5.392  1.00  3.29           C  
ATOM   1015  CD2 TYR A  65      16.722 -10.051  -5.051  1.00  3.29           C  
ATOM   1016  CE1 TYR A  65      18.014  -7.779  -4.160  1.00  3.29           C  
ATOM   1017  CE2 TYR A  65      17.307 -10.041  -3.808  1.00  3.29           C  
ATOM   1018  CZ  TYR A  65      17.948  -8.904  -3.360  1.00  3.29           C  
ATOM   1019  OH  TYR A  65      18.518  -8.876  -2.106  1.00  3.29           O  
ATOM   1020  H   TYR A  65      18.159  -7.837  -8.756  1.00  2.81           H  
ATOM   1021  HA  TYR A  65      17.233 -10.544  -7.981  1.00  2.82           H  
ATOM   1022 1HB  TYR A  65      15.887  -7.878  -7.430  1.00  3.95           H  
ATOM   1023 2HB  TYR A  65      15.184  -9.456  -7.089  1.00  3.95           H  
ATOM   1024  HD1 TYR A  65      17.474  -6.917  -6.013  1.00  3.95           H  
ATOM   1025  HD2 TYR A  65      16.206 -10.942  -5.408  1.00  3.95           H  
ATOM   1026  HE1 TYR A  65      18.519  -6.880  -3.806  1.00  3.95           H  
ATOM   1027  HE2 TYR A  65      17.257 -10.925  -3.175  1.00  3.95           H  
ATOM   1028  HH  TYR A  65      18.456  -9.750  -1.705  1.00  3.95           H  
ATOM   1029  N   PRO A  66      16.659  -9.790 -10.782  1.00  2.59           N  
ATOM   1030  CA  PRO A  66      15.879  -9.837 -12.024  1.00  2.95           C  
ATOM   1031  C   PRO A  66      15.132 -11.165 -12.210  1.00  2.75           C  
ATOM   1032  O   PRO A  66      15.320 -11.882 -13.188  1.00  2.83           O  
ATOM   1033  CB  PRO A  66      16.964  -9.664 -13.087  1.00  4.43           C  
ATOM   1034  CG  PRO A  66      18.177 -10.341 -12.473  1.00  4.43           C  
ATOM   1035  CD  PRO A  66      18.103  -9.984 -10.993  1.00  4.43           C  
ATOM   1036  HA  PRO A  66      15.178  -8.991 -12.038  1.00  3.54           H  
ATOM   1037 1HB  PRO A  66      16.640 -10.113 -14.044  1.00  5.32           H  
ATOM   1038 2HB  PRO A  66      17.124  -8.591 -13.289  1.00  5.32           H  
ATOM   1039 1HG  PRO A  66      18.146 -11.425 -12.658  1.00  5.32           H  
ATOM   1040 2HG  PRO A  66      19.098  -9.960 -12.945  1.00  5.32           H  
ATOM   1041 1HD  PRO A  66      18.499 -10.795 -10.364  1.00  5.32           H  
ATOM   1042 2HD  PRO A  66      18.641  -9.045 -10.871  1.00  5.32           H  
ATOM   1043  N   LEU A  67      14.321 -11.478 -11.213  1.00  3.05           N  
ATOM   1044  CA  LEU A  67      13.451 -12.634 -11.122  1.00  3.26           C  
ATOM   1045  C   LEU A  67      12.277 -12.439 -12.073  1.00  3.34           C  
ATOM   1046  O   LEU A  67      11.749 -13.381 -12.659  1.00  3.86           O  
ATOM   1047  CB  LEU A  67      12.981 -12.752  -9.672  1.00  4.48           C  
ATOM   1048  CG  LEU A  67      14.105 -13.027  -8.616  1.00  4.48           C  
ATOM   1049  CD1 LEU A  67      13.517 -12.878  -7.228  1.00  4.48           C  
ATOM   1050  CD2 LEU A  67      14.690 -14.423  -8.802  1.00  4.48           C  
ATOM   1051  H   LEU A  67      14.278 -10.811 -10.458  1.00  3.66           H  
ATOM   1052  HA  LEU A  67      13.998 -13.521 -11.433  1.00  3.91           H  
ATOM   1053 1HB  LEU A  67      12.482 -11.849  -9.397  1.00  5.38           H  
ATOM   1054 2HB  LEU A  67      12.263 -13.566  -9.613  1.00  5.38           H  
ATOM   1055  HG  LEU A  67      14.899 -12.290  -8.728  1.00  5.38           H  
ATOM   1056 1HD1 LEU A  67      14.295 -13.050  -6.483  1.00  5.38           H  
ATOM   1057 2HD1 LEU A  67      13.121 -11.870  -7.105  1.00  5.38           H  
ATOM   1058 3HD1 LEU A  67      12.717 -13.602  -7.089  1.00  5.38           H  
ATOM   1059 1HD2 LEU A  67      15.464 -14.590  -8.053  1.00  5.38           H  
ATOM   1060 2HD2 LEU A  67      13.904 -15.169  -8.681  1.00  5.38           H  
ATOM   1061 3HD2 LEU A  67      15.130 -14.522  -9.789  1.00  5.38           H  
ATOM   1062  N   LEU A  68      11.853 -11.179 -12.155  1.00  3.33           N  
ATOM   1063  CA  LEU A  68      10.736 -10.679 -12.936  1.00  3.83           C  
ATOM   1064  C   LEU A  68      10.954 -10.947 -14.420  1.00  3.54           C  
ATOM   1065  O   LEU A  68      12.014 -10.638 -14.959  1.00  3.83           O  
ATOM   1066  CB  LEU A  68      10.667  -9.153 -12.784  1.00  5.16           C  
ATOM   1067  CG  LEU A  68       9.423  -8.406 -13.281  1.00  5.16           C  
ATOM   1068  CD1 LEU A  68       8.256  -8.652 -12.332  1.00  5.16           C  
ATOM   1069  CD2 LEU A  68       9.776  -6.956 -13.450  1.00  5.16           C  
ATOM   1070  H   LEU A  68      12.350 -10.493 -11.611  1.00  4.00           H  
ATOM   1071  HA  LEU A  68       9.823 -11.168 -12.606  1.00  4.60           H  
ATOM   1072 1HB  LEU A  68      10.771  -8.915 -11.734  1.00  6.19           H  
ATOM   1073 2HB  LEU A  68      11.507  -8.739 -13.294  1.00  6.19           H  
ATOM   1074  HG  LEU A  68       9.120  -8.788 -14.228  1.00  6.19           H  
ATOM   1075 1HD1 LEU A  68       7.371  -8.124 -12.700  1.00  6.19           H  
ATOM   1076 2HD1 LEU A  68       8.033  -9.709 -12.268  1.00  6.19           H  
ATOM   1077 3HD1 LEU A  68       8.513  -8.280 -11.339  1.00  6.19           H  
ATOM   1078 1HD2 LEU A  68       8.920  -6.424 -13.821  1.00  6.19           H  
ATOM   1079 2HD2 LEU A  68      10.087  -6.537 -12.530  1.00  6.19           H  
ATOM   1080 3HD2 LEU A  68      10.585  -6.873 -14.159  1.00  6.19           H  
ATOM   1081  N   MET A  69       9.916 -11.397 -15.116  1.00  3.49           N  
ATOM   1082  CA  MET A  69      10.015 -11.661 -16.557  1.00  3.67           C  
ATOM   1083  C   MET A  69      10.344 -10.415 -17.383  1.00  3.73           C  
ATOM   1084  O   MET A  69      10.797 -10.517 -18.521  1.00  4.02           O  
ATOM   1085  CB  MET A  69       8.714 -12.267 -17.078  1.00  5.07           C  
ATOM   1086  CG  MET A  69       8.436 -13.701 -16.621  1.00  5.07           C  
ATOM   1087  SD  MET A  69       9.739 -14.880 -17.096  1.00  5.07           S  
ATOM   1088  CE  MET A  69       9.638 -14.899 -18.889  1.00  5.07           C  
ATOM   1089  H   MET A  69       9.062 -11.616 -14.623  1.00  4.19           H  
ATOM   1090  HA  MET A  69      10.825 -12.372 -16.713  1.00  4.40           H  
ATOM   1091 1HB  MET A  69       7.880 -11.654 -16.741  1.00  6.08           H  
ATOM   1092 2HB  MET A  69       8.705 -12.232 -18.163  1.00  6.08           H  
ATOM   1093 1HG  MET A  69       8.340 -13.723 -15.538  1.00  6.08           H  
ATOM   1094 2HG  MET A  69       7.493 -14.041 -17.051  1.00  6.08           H  
ATOM   1095 1HE  MET A  69      10.381 -15.592 -19.284  1.00  6.08           H  
ATOM   1096 2HE  MET A  69       8.642 -15.222 -19.196  1.00  6.08           H  
ATOM   1097 3HE  MET A  69       9.837 -13.904 -19.284  1.00  6.08           H  
ATOM   1098  N   ASN A  70      10.061  -9.247 -16.817  1.00  4.02           N  
ATOM   1099  CA  ASN A  70      10.283  -7.963 -17.456  1.00  4.60           C  
ATOM   1100  C   ASN A  70      11.581  -7.260 -17.011  1.00  4.82           C  
ATOM   1101  O   ASN A  70      11.781  -6.088 -17.346  1.00  5.18           O  
ATOM   1102  CB  ASN A  70       9.087  -7.060 -17.192  1.00  6.21           C  
ATOM   1103  CG  ASN A  70       7.836  -7.550 -17.852  1.00  6.21           C  
ATOM   1104  OD1 ASN A  70       7.882  -8.084 -18.969  1.00  6.21           O  
ATOM   1105  ND2 ASN A  70       6.701  -7.384 -17.198  1.00  6.21           N  
ATOM   1106  H   ASN A  70       9.693  -9.271 -15.882  1.00  4.82           H  
ATOM   1107  HA  ASN A  70      10.368  -8.129 -18.531  1.00  5.52           H  
ATOM   1108 1HB  ASN A  70       8.904  -6.997 -16.134  1.00  7.45           H  
ATOM   1109 2HB  ASN A  70       9.300  -6.052 -17.546  1.00  7.45           H  
ATOM   1110 1HD2 ASN A  70       5.844  -7.694 -17.608  1.00  7.45           H  
ATOM   1111 2HD2 ASN A  70       6.655  -6.931 -16.272  1.00  7.45           H  
ATOM   1112  N   ALA A  71      12.448  -7.940 -16.251  1.00  5.00           N  
ATOM   1113  CA  ALA A  71      13.683  -7.310 -15.767  1.00  5.62           C  
ATOM   1114  C   ALA A  71      14.922  -7.874 -16.457  1.00  6.40           C  
ATOM   1115  O   ALA A  71      16.044  -7.536 -16.075  1.00  7.07           O  
ATOM   1116  OXT ALA A  71      14.814  -8.750 -17.313  1.00  8.43           O  
ATOM   1117  CB  ALA A  71      13.817  -7.479 -14.259  1.00  7.22           C  
ATOM   1118  H   ALA A  71      12.259  -8.916 -15.999  1.00  6.00           H  
ATOM   1119  HA  ALA A  71      13.634  -6.252 -16.001  1.00  6.74           H  
ATOM   1120 1HB  ALA A  71      14.725  -6.984 -13.912  1.00  8.66           H  
ATOM   1121 2HB  ALA A  71      12.962  -7.040 -13.762  1.00  8.66           H  
ATOM   1122 3HB  ALA A  71      13.868  -8.544 -14.031  1.00  8.66           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 -404.943 48.1336 279.251 -24.588 7.34879 16.7524 142.352 -155.219 -0.51194 -2.36789 -119.836 -17.564 -47.696 -3.74148 -7.25549 -6.38417 0 0.67759 4.62009 38.7063 72.9572 -11.4624 5.99287 0.75494 -0.31984 45.8736 -138.468
CYS:NtermProteinFull_1 -5.29181 0.71559 0.86561 -0.04209 0 0.026 0.24859 -0.59957 -0.00587 -0.03138 -0.07526 0.61267 0 0 0 0 0 0.02851 0.00888 1.44408 0 0 0 3.6196 0 0.11945 1.643
VAL_2 -4.78363 0.89461 0.05192 -0.30529 0.29048 0.07231 0.23685 -0.89329 -0 -0 0.4473 -0.5685 0 0 0 0 0 0.18015 0.02622 0.31558 0 -0.41477 0 1.9342 0.23534 0.32992 -1.9506
PHE_3 -9.35524 1.61253 0.11115 -1.00014 0.31242 0.53955 0.87044 -1.29491 -0 -0 0.63514 -0.09799 0 0 0 0 0 0.31196 0.04101 0 1.54519 0.04052 0 1.0402 0.65892 0.66691 -3.36233
GLY_4 -1.80537 0.11521 1.27261 -4e-05 0 0 0.76832 -0.71495 -0 -0 -0.1021 -0.35009 0 0 -1.04956 0 0 -0.03478 0 0 0 0.16154 0 0.83697 1.06583 0.92604 1.08963
CYS_5 -4.82325 0.86088 3.20771 -0.15754 0.145 0.08247 1.90466 -1.93061 -0 -0 -0.3252 -1.54847 0 0 0 0 0 0.08152 0.22081 0.16959 0 -0.32571 0 3.6196 1.75682 1.23242 4.17071
PRO_6 -5.23583 1.47051 2.03557 -0.06754 2e-05 0.04216 0.98574 -1.17556 -0 -0 -0.70381 0.59924 0 0 0 0 0 -0.04592 0.02349 0.17433 0 -0.59566 0 -2.4119 1.27831 1.14827 -2.47857
SER_7 -1.89735 0.19058 1.76594 -0.03097 0.00081 0.05298 0.63001 -0.88205 -0 -0 0.11051 -0.88991 0 0 0 0 0 -0.05313 7e-05 0.14478 0 -0.41497 0.60016 -0.77834 0.21903 0.52267 -0.70917
ALA_8 -4.70785 0.68139 3.8532 -0.02907 0.01461 0 2.56613 -2.29101 -0 -0 -2.34057 -0.45556 0 0 0 0 0 0.0151 0 0 0 0.11783 0 1.8394 0.58355 0.32011 0.16724
ALA_9 -5.90877 0.42973 3.28964 -0.02372 0 0 2.31435 -2.40763 -0 -1e-05 -1.41259 -0.34032 0 0 0 0 0 -0.08469 0 0 0 -0.4167 0 1.8394 0.22965 0.55502 -1.93664
ASP_10 -6.02431 0.6493 7.02576 -0.16625 0.07429 0.55299 2.8817 -3.188 -0.01433 -0.09535 -3.63994 -3.32007 0 0 -0.33343 -0.57444 0 0.06466 0.11112 0 4.36293 0.07831 0 -2.3716 -0.16816 0.55971 -3.53514
LYS_11 -5.02755 0.24933 7.24624 -0.44217 0.05465 0.23816 2.93924 -3.03579 -0 -0 -5.00561 0.10021 0 0 -0.33343 -0.6625 0 -0.0121 0.04158 2.40136 0 0.02396 0 -1.5107 0.06368 0.35254 -2.3189
LEU_12 -9.07782 1.20996 5.70683 -0.51914 0.24454 0.12285 3.19549 -3.57803 -0.00279 -0.03354 -2.29122 0.26054 0 0 0 0 0 0.00563 0.03969 0.36314 0 -0.27789 0 0.18072 -0.20895 0.74996 -3.91006
TRP_13 -9.94849 0.74509 5.87182 -1.20428 0.03189 0.45736 2.78868 -3.45289 -0 -0 -1.56551 -0.33506 0 0 0 0 0 0.00494 0.43566 0 1.77559 -0.13879 0 1.6906 -0.23732 0.78928 -2.29144
ASP_14 -4.01136 0.47952 6.35525 -0.10612 0.00425 0.3234 3.0234 -2.65289 -0 -0 -5.45783 -0.26712 0 0 0 -0.7956 0 -0.02418 0.01466 0 1.84645 0.0581 0 -2.3716 -0.19804 0.69648 -3.08323
GLU_15 -3.81931 0.07262 5.51314 -0.21419 0.03405 0.31792 2.25049 -2.23172 -0 -0 -3.13493 -0.51471 0 0 0 -0.6625 0 -0.05513 0.03822 0 3.29277 -0.15738 0 -2.7348 -0.07583 0.79049 -1.2908
ASN_16 -5.48368 0.48655 5.35728 -0.20784 0.03939 0.32941 2.81297 -2.72187 -0.0244 -0.11865 -2.46856 -0.73214 0 0 0 0 0 -0.02256 0.18382 0 2.41501 -0.72161 0 -0.93687 0.15714 0.4855 -1.17109
LYS_17 -5.74978 0.74232 6.26155 -0.38324 0.02942 0.21415 3.6584 -2.81392 -0 -0 -3.52337 -0.21785 0 0 -0.89292 0 0 -0.09331 0.1841 1.86639 0 -0.0582 0 -1.5107 0.14752 0.5572 -1.58223
SER_18 -3.49346 0.45632 3.86373 -0.02911 0.00041 0.04654 1.51709 -1.84993 -0 -0 -0.61012 -0.93434 0 0 0 0 0 -0.11807 0.00071 0.16187 0 -0.28099 0.61636 -0.77834 -0.13775 0.59397 -0.9751
HIS_19 -6.2227 0.36531 5.46094 -0.40531 0.10726 0.37639 3.11133 -2.74885 -0 -0 -2.82143 -0.53585 0 0 -1.04956 0 0 -0.0017 0.05033 0 3.05666 0.03874 0 -0.45461 -0.25778 0.65253 -1.27832
PHE_20 -10.8581 1.4339 2.42207 -0.62369 0.10898 0.33958 2.39609 -2.66234 -0.02653 -0.15223 -2.49343 0.20674 0 0 0 0 0 0.00375 0.17555 0 2.5225 -0.00736 0 1.0402 -0.06636 0.84178 -5.39886
ILE_21 -8.56998 1.40472 4.53126 -0.66126 0.46138 0.15086 2.48074 -2.69685 -0 -0 -2.11906 0.32998 0 0 0 0 0 -0.06356 0.0053 0.60403 0 -0.48975 0 0.73287 0.06306 0.8291 -3.00714
GLU_22 -5.67593 0.36787 5.92591 -0.33219 0.07439 0.37465 2.34395 -2.81914 -0 -0 -2.19831 -0.59309 0 0 0 0 0 -0.01251 0.05527 0 3.33652 -0.13982 0 -2.7348 -0.17218 0.59293 -1.60647
ASP_23 -6.47532 0.59529 8.26907 -0.23728 0.0014 0.77428 3.59889 -3.72608 -0.0299 -0.11474 -5.60206 -0.05186 0 0 0 -0.51337 0 0.10031 0.00413 0 3.16281 0.31157 0 -2.3716 -0.21657 0.28317 -2.23787
PHE_24 -10.3708 1.73259 4.49589 -0.83314 0.14858 0.30201 2.85792 -3.08493 -0.01375 -0.07226 -2.91515 -0.05213 0 0 0 0 0 0.01676 0.00277 0 2.2648 -0.46465 0 1.0402 0.00728 0.40462 -4.53337
CYS_25 -8.04045 0.5698 5.66916 -0.04528 0 0.014 2.59598 -2.92745 -0 -0 -3.28334 0.04985 0 0 0 0 0 0.07451 0.02367 0.29281 0 0.26512 0 3.6196 0.16438 0.54544 -0.41219
TRP_26 -5.66467 0.53396 5.30893 -0.66949 0.08169 0.32391 1.903 -2.56585 -0 -0 -1.71335 -0.40609 0 0 0 0 0 -0.06216 0.0055 0 2.8236 0.06151 0 1.6906 -0.02181 0.4943 2.12359
LYS_27 -6.22859 0.3943 7.42931 -0.36833 0.04504 0.23513 3.79199 -3.28124 -0.02778 -0.08116 -5.66612 0.24459 0 0 -1.35184 -0.51337 0 0.02334 0.03021 2.46376 0 -0.15077 0 -1.5107 -0.22168 0.62422 -4.11969
LEU_28 -7.17452 0.84482 4.24238 -0.71105 0.52804 0.20664 2.83993 -2.63273 -0 -0 -2.95945 0.25324 0 0 0 0 0 0.14247 0.04143 2.59478 0 -0.1207 0 0.18072 -0.14154 0.98158 -0.88397
HIS_D_29 -6.68416 0.47998 5.91813 -0.41027 0.12328 0.41742 2.49718 -3.12108 -0.01428 -0.08269 -1.67421 -0.59888 0 0 0 0 0 0.10941 0.05972 0 3.12746 -0.0766 0 -0.45461 -0.275 0.89842 0.23921
ARG_30 -3.47267 0.36348 4.00367 -0.67131 0.07868 0.45278 1.93584 -1.77725 -0 -0 -1.29097 0.52604 0 0 -1.35184 0 0 -0.08336 0.10056 1.76785 0 -0.10322 0 -1.2888 -0.42534 0.62064 -0.61522
ARG_31 -3.18051 0.44492 2.96692 -0.47421 0.0786 0.28965 1.0886 -1.44522 -0.05403 -0.25873 -0.45266 0.04019 0 0 0 0 0 0.01087 0.02709 2.05238 0 -0.1948 0 -1.2888 -0.31937 0.50016 -0.16894
GLU_32 -1.9332 0.1644 2.52101 -0.24336 0.05738 0.42743 1.03121 -1.19525 -0.01244 -0.10798 -0.83194 -0.49794 0 0 0 0 0 -0.00752 0.00119 0 2.71205 0.14986 0 -2.7348 0.03673 0.40596 -0.05719
GLY_33 -2.35082 0.08293 2.38146 -0.00025 0 0 0.87872 -1.25368 -0.04212 -0.16118 -0.0102 -0.15221 0 0 0 0 0 -0.06512 0 0 0 -0.99118 0 0.83697 0.19714 0.30284 -0.34671
ALA_34 -3.91943 0.16695 3.09393 -0.02147 0 0 1.88664 -1.9079 -0 -0 -1.1712 -0.39303 0 0 0 0 0 -0.0071 0 0 0 -0.53942 0 1.8394 0.03629 0.14566 -0.79069
CYS_35 -4.11118 0.33342 3.3342 -0.04978 0.00016 0.01924 1.61929 -1.6664 -0 -0 -0.88669 -0.44733 0 0 0 0 0 -0.03843 9e-05 0.39089 0 0.29977 0 3.6196 -0.08947 0.25274 2.58012
VAL_36 -4.61763 0.58533 2.85129 -0.3401 0.11703 0.07951 1.49109 -1.95106 -1e-05 -0.00017 -0.4314 0.05785 0 0 0 0 0 -0.04257 0.01544 1.03103 0 -0.17437 0 1.9342 -0.1272 0.36474 0.84301
ASN_37 -5.91418 0.44814 4.49177 -0.18313 0.03276 0.2702 2.44222 -2.72455 -0 -0 -1.49953 -0.34251 0 0 0 0 0 0.10549 0.02048 0 1.43786 0.21948 0 -0.93687 -0.07977 0.34303 -1.86912
CYS_38 -8.89179 2.23614 4.19339 -0.07155 0.00018 0.06053 2.71229 -2.72008 -0 -0 -2.43462 -0.38762 0 0 0 0 0 -0.00676 0.00293 0.71813 0 0.30003 0 3.6196 0.43076 0.53467 0.29625
GLU_39 -4.36257 0.16595 4.59163 -0.21198 0.02068 0.28099 2.05809 -2.12549 -1e-05 -0.00017 -2.117 -0.5859 0 0 -0.89292 0 0 -0.02341 0.05824 0 3.05255 -0.3404 0 -2.7348 0.08655 0.55915 -2.52081
MET_40 -5.39605 0.43372 3.36003 -0.36151 0.10391 0.09535 1.34278 -2.05036 -0 -0 -0.80271 0.01034 0 0 0 0 0 0.12555 0.10353 1.73283 0 0.11804 0 0.60916 -0.10158 0.54789 -0.12908
HIS_D_41 -4.92927 0.36834 4.43528 -0.43185 0.02016 0.58873 2.30842 -2.35745 -0.01762 -0.07664 -2.43258 -0.24098 0 0 0 0 0 -0.03668 0.13309 0 1.51749 -0.4621 0 -0.45461 0.26973 0.86742 -0.93112
ALA_42 -5.81876 0.99974 3.05401 -0.02464 0.0002 0 3.24424 -2.44074 -0 -0 -3.20431 -0.37137 0 0 0 0 0 -0.10942 0 0 0 -0.23633 0 1.8394 -0.32399 0.80656 -2.58541
LEU_43 -7.07797 0.84772 3.48343 -0.66814 0.25467 0.17431 1.60643 -2.4256 -0 -0 -1.07577 -0.0315 0 0 0 0 0 -0.17142 0.22684 2.25707 0 -0.00477 0 0.18072 -0.28738 0.65807 -2.05328
ASN_44 -4.11003 0.38555 4.38324 -0.18153 0.0299 0.2679 1.84489 -2.20491 -0 -0 -1.12301 -0.28466 0 0 0 0 0 0.0007 0.03058 0 1.60195 0.1718 0 -0.93687 0.13364 0.49723 0.50636
GLU_45 -5.64514 0.40401 5.30331 -0.57839 0.10091 1.037 2.72301 -2.54385 -0.01762 -0.07664 -2.1665 -0.70856 0 0 0 0 0 -0.02667 0.03586 0 3.35894 -0.25735 0 -2.7348 -0.0423 0.37112 -1.46363
ILE_46 -9.62258 1.50407 4.11441 -0.49008 0.2889 0.0934 2.93096 -3.13058 -0.00612 -0.01901 -2.41284 0.10506 0 0 0 0 0 0.11512 0.03681 0.5031 0 -0.43211 0 0.73287 -0.08106 0.75252 -5.01715
GLN_47 -7.31041 0.86441 5.51998 -0.40287 0.12548 0.24942 2.99295 -2.90425 -0 -0 -3.05984 -0.49405 0 0 0 -0.64617 0 -0.01539 0.32954 0 3.03608 0.13473 0 -0.18838 0.2571 1.00455 -0.50713
GLU_48 -3.6056 0.1876 4.48231 -0.33259 0.07298 0.37783 1.81429 -2.11995 -0 -0 -1.08379 -0.5318 0 0 0 0 0 0.02088 0.01744 0 3.0671 0.00065 0 -2.7348 0.30437 0.6278 0.56472
VAL_49 -6.33552 0.45935 4.03393 -0.3231 0.30356 0.07539 2.12633 -2.47409 -0 -0 -1.60993 -0.26497 0 0 0 0 0 0.01475 0.00921 0.15439 0 -0.24395 0 1.9342 -0.01388 0.42087 -1.73347
PHE_50 -12.1219 2.20767 2.79247 -0.55297 0.65644 0.28225 2.83589 -2.91964 -0.00587 -0.03138 -3.44171 -0.02855 0 0 0 0 0 0.03122 0.02996 0 3.93507 0.04623 0 1.0402 0.00289 0.95398 -4.28774
THR_51 -6.17979 0.68045 5.3781 -0.12135 0.03012 0.0552 3.19237 -3.01474 -0.00612 -0.01901 -2.95658 -0.37725 0 0 0 0 0 0.56839 0.02841 0.14823 0 0.0332 4.15319 -1.0874 -0.08063 1.20802 1.63282
LEU_52 -3.56837 0.41188 3.6016 -0.6977 0.21088 0.29059 1.42542 -1.77178 -0 -0 -0.48547 -0.01609 0 0 0 0 0 -0.09776 0.02534 1.14342 0 -0.15423 0 0.18072 -0.22532 0.80807 1.08121
HIS_53 -5.67315 0.55528 3.82756 -0.45076 0.03274 0.54317 1.2321 -2.12071 -0.02933 -0.11074 -0.80436 -0.11685 0 0 0 0 0 -0.05474 0.00264 0 1.63031 -0.38428 0 -0.45461 -0.33687 0.40203 -2.31057
GLY_54 -2.00184 0.13735 2.24237 -6e-05 0 0 0.93691 -1.17236 -0 -0 -1.13571 -0.35135 0 0 0 0 0 -0.16811 0 0 0 -1.52196 0 0.83697 -0.55249 0.45618 -2.2941
MET_55 -7.54484 0.76655 3.82845 -0.67447 0.23043 0.27296 1.05048 -1.88774 -0.02933 -0.11074 -0.37978 0.02336 0 0 0 0 0 0.15306 0.04626 2.83549 0 0.15498 0 0.60916 -0.30042 0.54277 -0.41336
LYS_56 -3.92344 0.28104 3.78418 -0.49589 0.11612 0.30707 2.07149 -1.78295 -0 -0 -0.87437 -0.18073 0 0 0 0 0 0.1706 0.04684 1.92087 0 0.28261 0 -1.5107 -0.04382 0.56871 0.73763
CYS_57 -6.95529 1.0837 2.94569 -0.07094 0.00146 0.04356 1.49072 -1.79051 -0 -0 -1.23525 -0.43102 0 0 0 0 0 0.20723 0.07459 0.54119 0 0.16253 0 3.6196 -0.18393 0.66298 0.1663
SER_58 -5.91091 0.73186 5.3297 -0.02735 0 0.04407 2.5127 -2.56208 -3e-05 -0.00012 -0.58667 -1.11993 0 0 0 0 0 -0.07242 0.00644 0.18044 0 -0.09733 0.60607 -0.77834 -0.54463 0.55364 -1.7349
HIS_D_59 -8.1879 0.9853 5.1449 -0.42242 0.01331 0.45739 2.73195 -3.03243 -0.01157 -0.06194 -1.16077 -0.24767 0 0 0 0 0 -0.02255 0.07447 0 2.96943 -0.11894 0 -0.45461 -0.60535 0.42325 -1.52613
PHE_60 -11.038 1.28748 2.08982 -0.6677 0.19654 0.43221 1.50678 -2.53771 -0.01917 -0.08406 -0.95239 0.0657 0 0 0 0 0 0.0553 0.415 0 2.73668 -0.222 0 1.0402 -0.45998 0.70144 -5.45384
LYS_61 -6.54995 0.7321 6.35465 -0.61323 0.20423 0.44396 3.03028 -2.77036 -0 -0 -5.87992 0.11655 0 0 0 -0.7956 0 -0.09037 0.06462 2.71231 0 -0.15151 0 -1.5107 -0.39588 1.10669 -3.99213
LEU_62 -8.27428 1.16682 3.31804 -0.51563 0.27828 0.11335 2.31999 -2.30069 -0.01917 -0.08406 -0.98438 0.18751 0 0 0 0 0 0.09828 0.07482 3.02428 0 -0.16523 0 0.18072 -0.37253 1.32153 -0.63238
PRO_63 -2.70176 0.39719 1.80499 -0.08628 0.00017 0.05355 0.52356 -0.69717 -0 -0 0.23036 0.68681 0 0 0 0 0 -0.15376 0.00109 0.56573 0 -0.41682 0 -2.4119 -0.4391 0.9331 -1.71024
ASP_64 -3.14634 0.39696 2.08173 -0.11675 0.00331 0.35597 0.34503 -1.00386 -0 -0 -0.17044 -0.52306 0 0 0 0 0 0.04438 0.00457 0 2.33667 -0.29308 0 -2.3716 -0.35815 0.33823 -2.07642
TYR_65 -7.21382 1.24958 3.68089 -0.68816 0.1138 0.41955 2.65334 -2.13435 -0.03108 -0.14043 -2.81292 -0.19862 0 0 0 -0.64617 0 0.0112 0.01041 0 2.05468 -0.02458 0.01709 1.2797 0.71399 1.42458 -0.26133
PRO_66 -3.53899 0.56128 1.97073 -0.1706 0.05517 0.11578 0.44865 -0.9726 -0 -0 0.37878 0.14041 0 0 0 0 0 0.03297 0.00165 0.2025 0 -0.99367 0 -2.4119 1.26396 1.59482 -1.32106
LEU_67 -2.98277 0.36488 2.2871 -0.4804 0.20693 0.10789 1.11791 -1.07819 -0 -0 -0.41609 0.19035 0 0 0 0 0 -0.04508 0.17701 0.36953 0 -0.28424 0 0.18072 0.33163 0.67257 0.71975
LEU_68 -7.9498 1.10131 4.08241 -0.53719 0.1402 0.13456 2.13144 -2.66439 -0.04084 -0.19143 0.44407 0.30707 0 0 0 0 0 -0.07319 0.52328 0.58156 0 -0.07182 0 0.18072 -0.41643 0.83599 -1.48249
MET_69 -1.64996 0.07583 1.72447 -0.68246 0.17129 0.19139 0.56731 -0.83259 -4e-05 -0.00023 0.49663 -0.00225 0 0 0 0 0 -0.10032 0.01441 0.87657 0 -0.08067 0 0.60916 -0.45787 0.60531 1.52598
ASN_70 -3.27858 0.44519 3.14378 -0.19371 0.03968 0.31515 1.15033 -1.44744 -4e-05 -0.00023 -1.37251 -0.42885 0 0 0 -0.57444 0 -0.05544 0.02545 0 1.97803 -0.48079 0 -0.93687 -0.54868 0.31208 -1.90791
ALA:CtermProteinFull_71 -3.53587 0.28305 1.91017 -0.03421 0.00528 0 0.9891 -1.32451 -0.00976 -0.051 -0.72911 -0.11157 0 0 0 0 0 0 0 0 0 0 0 1.8394 -0.40271 0.32002 -0.85172
#END_POSE_ENERGIES_TABLE best_scoring0001_0001.pdb

ENDMDL

