USER  MOD reduce.3.24.130724 H: found=0, std=0, add=535, rem=0, adj=9
USER  MOD reduce.3.24.130724 removed 457 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A  20 THR OG1 :   rot  180:sc=  -0.743
USER  MOD Set 1.2: A  92 SER OG  :   rot  180:sc=   -1.85!
USER  MOD Single : A  32 ASN     :      amide:sc= -0.0179  X(o=-0.018,f=-0.2)
USER  MOD Single : A  46 SER OG  :   rot  170:sc= -0.0666
USER  MOD Single : A  47 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  52 SER OG  :   rot  -74:sc=   0.429
USER  MOD Single : A  55 HIS     :     no HD1:sc=  -0.204  K(o=-0.2,f=-1.4)
USER  MOD Single : A  60 GLN     :      amide:sc=-0.000219  X(o=-0.00022,f=0)
USER  MOD Single : A  64 GLN     :      amide:sc=       0  X(o=0,f=-0.38)
USER  MOD Single : A  69 ASN     :FLIP  amide:sc=   0.399  F(o=-0.42,f=0.4)
USER  MOD Single : A  74 GLN     :      amide:sc=-0.000306  X(o=-0.00031,f=0)
USER  MOD Single : A  78 HIS     :     no HD1:sc=    -3.5! C(o=-3.5!,f=-6.1!)
USER  MOD Single : A  79 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  80 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  86 LYS NZ  :NH3+    153:sc= -0.0423   (180deg=-0.347)
USER  MOD Single : A  87 THR OG1 :   rot  -48:sc=   -0.51
USER  MOD Single : A  93 MET CE  :methyl  176:sc=       0   (180deg=-0.0143)
USER  MOD -----------------------------------------------------------------
ATOM    196  N   ARG A  17      -3.421  -5.838  12.969  1.00  0.00           N
ATOM    197  CA  ARG A  17      -3.446  -4.435  13.347  1.00  0.00           C
ATOM    198  C   ARG A  17      -4.240  -3.623  12.323  1.00  0.00           C
ATOM    199  O   ARG A  17      -4.425  -4.058  11.188  1.00  0.00           O
ATOM    200  CB  ARG A  17      -2.029  -3.868  13.450  1.00  0.00           C
ATOM    201  CG  ARG A  17      -1.195  -4.253  12.227  1.00  0.00           C
ATOM    202  CD  ARG A  17       0.073  -5.004  12.641  1.00  0.00           C
ATOM    203  NE  ARG A  17       1.106  -4.043  13.089  1.00  0.00           N
ATOM    204  CZ  ARG A  17       2.374  -4.378  13.366  1.00  0.00           C
ATOM    205  NH1 ARG A  17       2.772  -5.651  13.243  1.00  0.00           N
ATOM    206  NH2 ARG A  17       3.242  -3.440  13.766  1.00  0.00           N
ATOM      0  HA  ARG A  17      -3.926  -4.363  14.323  1.00  0.00           H   new
ATOM      0  HB2 ARG A  17      -2.073  -2.782  13.538  1.00  0.00           H   new
ATOM      0  HB3 ARG A  17      -1.549  -4.241  14.354  1.00  0.00           H   new
ATOM      0  HG2 ARG A  17      -1.789  -4.876  11.559  1.00  0.00           H   new
ATOM      0  HG3 ARG A  17      -0.925  -3.356  11.670  1.00  0.00           H   new
ATOM      0  HD2 ARG A  17      -0.155  -5.706  13.443  1.00  0.00           H   new
ATOM      0  HD3 ARG A  17       0.449  -5.590  11.802  1.00  0.00           H   new
ATOM      0  HE  ARG A  17       0.836  -3.065  13.193  1.00  0.00           H   new
ATOM      0 HH11 ARG A  17       2.110  -6.365  12.939  1.00  0.00           H   new
ATOM      0 HH12 ARG A  17       3.737  -5.906  13.454  1.00  0.00           H   new
ATOM      0 HH21 ARG A  17       2.938  -2.471  13.860  1.00  0.00           H   new
ATOM      0 HH22 ARG A  17       4.207  -3.695  13.977  1.00  0.00           H   new
ATOM    217  N   ILE A  18      -4.690  -2.456  12.761  1.00  0.00           N
ATOM    218  CA  ILE A  18      -5.461  -1.578  11.898  1.00  0.00           C
ATOM    219  C   ILE A  18      -4.635  -0.332  11.577  1.00  0.00           C
ATOM    220  O   ILE A  18      -4.370   0.485  12.458  1.00  0.00           O
ATOM    221  CB  ILE A  18      -6.823  -1.270  12.524  1.00  0.00           C
ATOM    222  CG1 ILE A  18      -7.626  -2.552  12.751  1.00  0.00           C
ATOM    223  CG2 ILE A  18      -7.594  -0.251  11.684  1.00  0.00           C
ATOM    224  CD1 ILE A  18      -8.558  -2.831  11.571  1.00  0.00           C
ATOM      0  H   ILE A  18      -4.535  -2.098  13.703  1.00  0.00           H   new
ATOM      0  HA  ILE A  18      -5.677  -2.070  10.950  1.00  0.00           H   new
ATOM      0  HB  ILE A  18      -6.655  -0.820  13.502  1.00  0.00           H   new
ATOM      0 HG12 ILE A  18      -6.945  -3.392  12.888  1.00  0.00           H   new
ATOM      0 HG13 ILE A  18      -8.210  -2.462  13.667  1.00  0.00           H   new
ATOM      0 HG21 ILE A  18      -8.558  -0.050  12.151  1.00  0.00           H   new
ATOM      0 HG22 ILE A  18      -7.022   0.675  11.619  1.00  0.00           H   new
ATOM      0 HG23 ILE A  18      -7.752  -0.650  10.682  1.00  0.00           H   new
ATOM      0 HD11 ILE A  18      -9.117  -3.748  11.758  1.00  0.00           H   new
ATOM      0 HD12 ILE A  18      -9.253  -2.000  11.452  1.00  0.00           H   new
ATOM      0 HD13 ILE A  18      -7.969  -2.944  10.661  1.00  0.00           H   new
ATOM    235  N   VAL A  19      -4.251  -0.225  10.313  1.00  0.00           N
ATOM    236  CA  VAL A  19      -3.459   0.909   9.865  1.00  0.00           C
ATOM    237  C   VAL A  19      -4.394   2.006   9.353  1.00  0.00           C
ATOM    238  O   VAL A  19      -4.815   1.979   8.197  1.00  0.00           O
ATOM    239  CB  VAL A  19      -2.440   0.455   8.818  1.00  0.00           C
ATOM    240  CG1 VAL A  19      -1.889   1.649   8.036  1.00  0.00           C
ATOM    241  CG2 VAL A  19      -1.308  -0.346   9.467  1.00  0.00           C
ATOM      0  H   VAL A  19      -4.473  -0.904   9.585  1.00  0.00           H   new
ATOM      0  HA  VAL A  19      -2.888   1.328  10.694  1.00  0.00           H   new
ATOM      0  HB  VAL A  19      -2.952  -0.199   8.113  1.00  0.00           H   new
ATOM      0 HG11 VAL A  19      -1.167   1.299   7.298  1.00  0.00           H   new
ATOM      0 HG12 VAL A  19      -2.707   2.160   7.529  1.00  0.00           H   new
ATOM      0 HG13 VAL A  19      -1.400   2.340   8.723  1.00  0.00           H   new
ATOM      0 HG21 VAL A  19      -0.597  -0.657   8.702  1.00  0.00           H   new
ATOM      0 HG22 VAL A  19      -0.799   0.275  10.204  1.00  0.00           H   new
ATOM      0 HG23 VAL A  19      -1.721  -1.227   9.958  1.00  0.00           H   new
ATOM    251  N   THR A  20      -4.691   2.947  10.236  1.00  0.00           N
ATOM    252  CA  THR A  20      -5.568   4.052   9.888  1.00  0.00           C
ATOM    253  C   THR A  20      -4.747   5.299   9.552  1.00  0.00           C
ATOM    254  O   THR A  20      -3.798   5.632  10.260  1.00  0.00           O
ATOM    255  CB  THR A  20      -6.546   4.262  11.045  1.00  0.00           C
ATOM    256  OG1 THR A  20      -6.829   2.944  11.505  1.00  0.00           O
ATOM    257  CG2 THR A  20      -7.903   4.793  10.576  1.00  0.00           C
ATOM      0  H   THR A  20      -4.340   2.967  11.193  1.00  0.00           H   new
ATOM      0  HA  THR A  20      -6.146   3.831   8.991  1.00  0.00           H   new
ATOM      0  HB  THR A  20      -6.113   4.957  11.764  1.00  0.00           H   new
ATOM      0  HG1 THR A  20      -7.456   2.988  12.257  1.00  0.00           H   new
ATOM      0 HG21 THR A  20      -8.559   4.924  11.436  1.00  0.00           H   new
ATOM      0 HG22 THR A  20      -7.765   5.751  10.075  1.00  0.00           H   new
ATOM      0 HG23 THR A  20      -8.352   4.082   9.882  1.00  0.00           H   new
ATOM    265  N   LEU A  21      -5.143   5.954   8.470  1.00  0.00           N
ATOM    266  CA  LEU A  21      -4.456   7.157   8.031  1.00  0.00           C
ATOM    267  C   LEU A  21      -5.434   8.333   8.050  1.00  0.00           C
ATOM    268  O   LEU A  21      -6.632   8.152   7.840  1.00  0.00           O
ATOM    269  CB  LEU A  21      -3.793   6.929   6.671  1.00  0.00           C
ATOM    270  CG  LEU A  21      -2.265   6.850   6.674  1.00  0.00           C
ATOM    271  CD1 LEU A  21      -1.783   5.583   7.384  1.00  0.00           C
ATOM    272  CD2 LEU A  21      -1.706   6.959   5.254  1.00  0.00           C
ATOM      0  H   LEU A  21      -5.930   5.674   7.885  1.00  0.00           H   new
ATOM      0  HA  LEU A  21      -3.646   7.405   8.717  1.00  0.00           H   new
ATOM      0  HB2 LEU A  21      -4.184   6.003   6.249  1.00  0.00           H   new
ATOM      0  HB3 LEU A  21      -4.094   7.736   6.003  1.00  0.00           H   new
ATOM      0  HG  LEU A  21      -1.881   7.701   7.237  1.00  0.00           H   new
ATOM      0 HD11 LEU A  21      -0.694   5.551   7.372  1.00  0.00           H   new
ATOM      0 HD12 LEU A  21      -2.135   5.588   8.416  1.00  0.00           H   new
ATOM      0 HD13 LEU A  21      -2.177   4.706   6.871  1.00  0.00           H   new
ATOM      0 HD21 LEU A  21      -0.618   6.900   5.286  1.00  0.00           H   new
ATOM      0 HD22 LEU A  21      -2.096   6.143   4.646  1.00  0.00           H   new
ATOM      0 HD23 LEU A  21      -2.005   7.912   4.817  1.00  0.00           H   new
ATOM    391  N   GLY A  30       1.564   7.606  -0.356  1.00  0.00           N
ATOM    392  CA  GLY A  30       2.947   7.565   0.089  1.00  0.00           C
ATOM    393  C   GLY A  30       3.500   6.140   0.029  1.00  0.00           C
ATOM    394  O   GLY A  30       4.458   5.812   0.729  1.00  0.00           O
ATOM      0  HA2 GLY A  30       3.553   8.221  -0.536  1.00  0.00           H   new
ATOM      0  HA3 GLY A  30       3.016   7.943   1.109  1.00  0.00           H   new
ATOM    398  N   PHE A  31       2.872   5.330  -0.811  1.00  0.00           N
ATOM    399  CA  PHE A  31       3.289   3.947  -0.970  1.00  0.00           C
ATOM    400  C   PHE A  31       2.612   3.306  -2.184  1.00  0.00           C
ATOM    401  O   PHE A  31       1.592   3.801  -2.663  1.00  0.00           O
ATOM    402  CB  PHE A  31       2.857   3.201   0.293  1.00  0.00           C
ATOM    403  CG  PHE A  31       1.398   3.438   0.687  1.00  0.00           C
ATOM    404  CD1 PHE A  31       1.064   4.523   1.437  1.00  0.00           C
ATOM    405  CD2 PHE A  31       0.435   2.564   0.289  1.00  0.00           C
ATOM    406  CE1 PHE A  31      -0.291   4.744   1.802  1.00  0.00           C
ATOM    407  CE2 PHE A  31      -0.919   2.785   0.655  1.00  0.00           C
ATOM    408  CZ  PHE A  31      -1.254   3.869   1.403  1.00  0.00           C
ATOM      0  H   PHE A  31       2.078   5.605  -1.389  1.00  0.00           H   new
ATOM      0  HA  PHE A  31       4.367   3.899  -1.122  1.00  0.00           H   new
ATOM      0  HB2 PHE A  31       3.013   2.133   0.143  1.00  0.00           H   new
ATOM      0  HB3 PHE A  31       3.500   3.504   1.119  1.00  0.00           H   new
ATOM      0  HD1 PHE A  31       1.829   5.216   1.755  1.00  0.00           H   new
ATOM      0  HD2 PHE A  31       0.700   1.702  -0.305  1.00  0.00           H   new
ATOM      0  HE1 PHE A  31      -0.557   5.606   2.396  1.00  0.00           H   new
ATOM      0  HE2 PHE A  31      -1.683   2.091   0.339  1.00  0.00           H   new
ATOM      0  HZ  PHE A  31      -2.284   4.036   1.681  1.00  0.00           H   new
ATOM    417  N   ASN A  32       3.205   2.216  -2.646  1.00  0.00           N
ATOM    418  CA  ASN A  32       2.672   1.502  -3.794  1.00  0.00           C
ATOM    419  C   ASN A  32       2.267   0.090  -3.368  1.00  0.00           C
ATOM    420  O   ASN A  32       2.896  -0.501  -2.492  1.00  0.00           O
ATOM    421  CB  ASN A  32       3.720   1.381  -4.901  1.00  0.00           C
ATOM    422  CG  ASN A  32       3.600   2.533  -5.900  1.00  0.00           C
ATOM    423  OD1 ASN A  32       2.535   2.833  -6.417  1.00  0.00           O
ATOM    424  ND2 ASN A  32       4.746   3.162  -6.142  1.00  0.00           N
ATOM      0  H   ASN A  32       4.050   1.809  -2.246  1.00  0.00           H   new
ATOM      0  HA  ASN A  32       1.814   2.059  -4.170  1.00  0.00           H   new
ATOM      0  HB2 ASN A  32       4.718   1.378  -4.463  1.00  0.00           H   new
ATOM      0  HB3 ASN A  32       3.597   0.431  -5.420  1.00  0.00           H   new
ATOM      0 HD21 ASN A  32       4.770   3.946  -6.794  1.00  0.00           H   new
ATOM      0 HD22 ASN A  32       5.602   2.860  -5.676  1.00  0.00           H   new
ATOM    430  N   ILE A  33       1.221  -0.409  -4.007  1.00  0.00           N
ATOM    431  CA  ILE A  33       0.724  -1.742  -3.706  1.00  0.00           C
ATOM    432  C   ILE A  33       1.136  -2.700  -4.826  1.00  0.00           C
ATOM    433  O   ILE A  33       1.391  -2.273  -5.951  1.00  0.00           O
ATOM    434  CB  ILE A  33      -0.784  -1.706  -3.451  1.00  0.00           C
ATOM    435  CG1 ILE A  33      -1.526  -1.081  -4.634  1.00  0.00           C
ATOM    436  CG2 ILE A  33      -1.100  -0.993  -2.134  1.00  0.00           C
ATOM    437  CD1 ILE A  33      -2.631  -2.011  -5.139  1.00  0.00           C
ATOM      0  H   ILE A  33       0.702   0.085  -4.733  1.00  0.00           H   new
ATOM      0  HA  ILE A  33       1.171  -2.117  -2.785  1.00  0.00           H   new
ATOM      0  HB  ILE A  33      -1.139  -2.732  -3.355  1.00  0.00           H   new
ATOM      0 HG12 ILE A  33      -1.958  -0.126  -4.334  1.00  0.00           H   new
ATOM      0 HG13 ILE A  33      -0.823  -0.874  -5.441  1.00  0.00           H   new
ATOM      0 HG21 ILE A  33      -2.178  -0.981  -1.976  1.00  0.00           H   new
ATOM      0 HG22 ILE A  33      -0.619  -1.520  -1.310  1.00  0.00           H   new
ATOM      0 HG23 ILE A  33      -0.728   0.031  -2.176  1.00  0.00           H   new
ATOM      0 HD11 ILE A  33      -3.144  -1.544  -5.980  1.00  0.00           H   new
ATOM      0 HD12 ILE A  33      -2.193  -2.956  -5.461  1.00  0.00           H   new
ATOM      0 HD13 ILE A  33      -3.345  -2.197  -4.337  1.00  0.00           H   new
ATOM    448  N   ARG A  34       1.189  -3.977  -4.478  1.00  0.00           N
ATOM    449  CA  ARG A  34       1.566  -4.999  -5.439  1.00  0.00           C
ATOM    450  C   ARG A  34       1.074  -6.372  -4.975  1.00  0.00           C
ATOM    451  O   ARG A  34       0.567  -6.510  -3.862  1.00  0.00           O
ATOM    452  CB  ARG A  34       3.083  -5.046  -5.628  1.00  0.00           C
ATOM    453  CG  ARG A  34       3.793  -5.318  -4.299  1.00  0.00           C
ATOM    454  CD  ARG A  34       5.274  -5.631  -4.523  1.00  0.00           C
ATOM    455  NE  ARG A  34       5.730  -6.645  -3.547  1.00  0.00           N
ATOM    456  CZ  ARG A  34       7.017  -6.923  -3.298  1.00  0.00           C
ATOM    457  NH1 ARG A  34       7.983  -6.265  -3.952  1.00  0.00           N
ATOM    458  NH2 ARG A  34       7.337  -7.861  -2.395  1.00  0.00           N
ATOM      0  H   ARG A  34       0.977  -4.327  -3.544  1.00  0.00           H   new
ATOM      0  HA  ARG A  34       1.101  -4.745  -6.391  1.00  0.00           H   new
ATOM      0  HB2 ARG A  34       3.340  -5.824  -6.347  1.00  0.00           H   new
ATOM      0  HB3 ARG A  34       3.431  -4.100  -6.043  1.00  0.00           H   new
ATOM      0  HG2 ARG A  34       3.696  -4.451  -3.646  1.00  0.00           H   new
ATOM      0  HG3 ARG A  34       3.314  -6.155  -3.791  1.00  0.00           H   new
ATOM      0  HD2 ARG A  34       5.427  -5.997  -5.538  1.00  0.00           H   new
ATOM      0  HD3 ARG A  34       5.866  -4.722  -4.419  1.00  0.00           H   new
ATOM      0  HE  ARG A  34       5.020  -7.165  -3.031  1.00  0.00           H   new
ATOM      0 HH11 ARG A  34       7.739  -5.552  -4.640  1.00  0.00           H   new
ATOM      0 HH12 ARG A  34       8.963  -6.477  -3.762  1.00  0.00           H   new
ATOM      0 HH21 ARG A  34       6.601  -8.363  -1.898  1.00  0.00           H   new
ATOM      0 HH22 ARG A  34       8.316  -8.073  -2.205  1.00  0.00           H   new
ATOM    469  N   GLY A  35       1.240  -7.352  -5.851  1.00  0.00           N
ATOM    470  CA  GLY A  35       0.819  -8.708  -5.544  1.00  0.00           C
ATOM    471  C   GLY A  35      -0.686  -8.768  -5.274  1.00  0.00           C
ATOM    472  O   GLY A  35      -1.244  -7.865  -4.652  1.00  0.00           O
ATOM      0  H   GLY A  35       1.660  -7.234  -6.773  1.00  0.00           H   new
ATOM      0  HA2 GLY A  35       1.069  -9.367  -6.375  1.00  0.00           H   new
ATOM      0  HA3 GLY A  35       1.363  -9.073  -4.673  1.00  0.00           H   new
ATOM    554  N   GLY A  42      -2.372 -11.937  -2.274  1.00  0.00           N
ATOM    555  CA  GLY A  42      -3.063 -10.793  -1.703  1.00  0.00           C
ATOM    556  C   GLY A  42      -2.309  -9.494  -1.999  1.00  0.00           C
ATOM    557  O   GLY A  42      -1.285  -9.509  -2.680  1.00  0.00           O
ATOM      0  HA2 GLY A  42      -4.072 -10.733  -2.110  1.00  0.00           H   new
ATOM      0  HA3 GLY A  42      -3.161 -10.923  -0.625  1.00  0.00           H   new
ATOM    561  N   ILE A  43      -2.847  -8.403  -1.474  1.00  0.00           N
ATOM    562  CA  ILE A  43      -2.238  -7.100  -1.673  1.00  0.00           C
ATOM    563  C   ILE A  43      -1.134  -6.891  -0.634  1.00  0.00           C
ATOM    564  O   ILE A  43      -1.374  -7.023   0.566  1.00  0.00           O
ATOM    565  CB  ILE A  43      -3.306  -6.003  -1.663  1.00  0.00           C
ATOM    566  CG1 ILE A  43      -4.229  -6.126  -2.876  1.00  0.00           C
ATOM    567  CG2 ILE A  43      -2.666  -4.616  -1.569  1.00  0.00           C
ATOM    568  CD1 ILE A  43      -3.449  -5.952  -4.181  1.00  0.00           C
ATOM      0  H   ILE A  43      -3.698  -8.395  -0.911  1.00  0.00           H   new
ATOM      0  HA  ILE A  43      -1.766  -7.047  -2.654  1.00  0.00           H   new
ATOM      0  HB  ILE A  43      -3.923  -6.135  -0.774  1.00  0.00           H   new
ATOM      0 HG12 ILE A  43      -4.718  -7.100  -2.868  1.00  0.00           H   new
ATOM      0 HG13 ILE A  43      -5.016  -5.374  -2.816  1.00  0.00           H   new
ATOM      0 HG21 ILE A  43      -3.446  -3.855  -1.564  1.00  0.00           H   new
ATOM      0 HG22 ILE A  43      -2.084  -4.545  -0.650  1.00  0.00           H   new
ATOM      0 HG23 ILE A  43      -2.011  -4.459  -2.426  1.00  0.00           H   new
ATOM      0 HD11 ILE A  43      -4.130  -6.044  -5.027  1.00  0.00           H   new
ATOM      0 HD12 ILE A  43      -2.982  -4.967  -4.197  1.00  0.00           H   new
ATOM      0 HD13 ILE A  43      -2.679  -6.720  -4.250  1.00  0.00           H   new
ATOM    579  N   PHE A  44       0.050  -6.571  -1.132  1.00  0.00           N
ATOM    580  CA  PHE A  44       1.192  -6.345  -0.262  1.00  0.00           C
ATOM    581  C   PHE A  44       1.824  -4.978  -0.532  1.00  0.00           C
ATOM    582  O   PHE A  44       1.734  -4.457  -1.643  1.00  0.00           O
ATOM    583  CB  PHE A  44       2.216  -7.437  -0.573  1.00  0.00           C
ATOM    584  CG  PHE A  44       1.807  -8.830  -0.089  1.00  0.00           C
ATOM    585  CD1 PHE A  44       2.095  -9.220   1.183  1.00  0.00           C
ATOM    586  CD2 PHE A  44       1.155  -9.678  -0.928  1.00  0.00           C
ATOM    587  CE1 PHE A  44       1.716 -10.511   1.632  1.00  0.00           C
ATOM    588  CE2 PHE A  44       0.776 -10.970  -0.478  1.00  0.00           C
ATOM    589  CZ  PHE A  44       1.064 -11.360   0.792  1.00  0.00           C
ATOM      0  H   PHE A  44       0.244  -6.463  -2.127  1.00  0.00           H   new
ATOM      0  HA  PHE A  44       0.875  -6.370   0.781  1.00  0.00           H   new
ATOM      0  HB2 PHE A  44       2.379  -7.471  -1.650  1.00  0.00           H   new
ATOM      0  HB3 PHE A  44       3.168  -7.169  -0.115  1.00  0.00           H   new
ATOM      0  HD1 PHE A  44       2.612  -8.546   1.850  1.00  0.00           H   new
ATOM      0  HD2 PHE A  44       0.925  -9.369  -1.937  1.00  0.00           H   new
ATOM      0  HE1 PHE A  44       1.945 -10.820   2.641  1.00  0.00           H   new
ATOM      0  HE2 PHE A  44       0.259 -11.643  -1.145  1.00  0.00           H   new
ATOM      0  HZ  PHE A  44       0.776 -12.343   1.134  1.00  0.00           H   new
ATOM    598  N   ILE A  45       2.450  -4.435   0.503  1.00  0.00           N
ATOM    599  CA  ILE A  45       3.096  -3.140   0.391  1.00  0.00           C
ATOM    600  C   ILE A  45       4.298  -3.253  -0.549  1.00  0.00           C
ATOM    601  O   ILE A  45       5.295  -3.892  -0.214  1.00  0.00           O
ATOM    602  CB  ILE A  45       3.449  -2.595   1.776  1.00  0.00           C
ATOM    603  CG1 ILE A  45       2.206  -2.510   2.665  1.00  0.00           C
ATOM    604  CG2 ILE A  45       4.171  -1.250   1.670  1.00  0.00           C
ATOM    605  CD1 ILE A  45       1.448  -1.204   2.424  1.00  0.00           C
ATOM      0  H   ILE A  45       2.523  -4.870   1.423  1.00  0.00           H   new
ATOM      0  HA  ILE A  45       2.414  -2.412  -0.049  1.00  0.00           H   new
ATOM      0  HB  ILE A  45       4.138  -3.293   2.251  1.00  0.00           H   new
ATOM      0 HG12 ILE A  45       1.551  -3.357   2.462  1.00  0.00           H   new
ATOM      0 HG13 ILE A  45       2.499  -2.577   3.713  1.00  0.00           H   new
ATOM      0 HG21 ILE A  45       4.410  -0.886   2.669  1.00  0.00           H   new
ATOM      0 HG22 ILE A  45       5.091  -1.375   1.099  1.00  0.00           H   new
ATOM      0 HG23 ILE A  45       3.527  -0.530   1.166  1.00  0.00           H   new
ATOM      0 HD11 ILE A  45       0.569  -1.169   3.068  1.00  0.00           H   new
ATOM      0 HD12 ILE A  45       2.098  -0.359   2.651  1.00  0.00           H   new
ATOM      0 HD13 ILE A  45       1.136  -1.152   1.381  1.00  0.00           H   new
ATOM    616  N   SER A  46       4.165  -2.624  -1.707  1.00  0.00           N
ATOM    617  CA  SER A  46       5.228  -2.647  -2.698  1.00  0.00           C
ATOM    618  C   SER A  46       6.360  -1.710  -2.273  1.00  0.00           C
ATOM    619  O   SER A  46       7.503  -2.138  -2.126  1.00  0.00           O
ATOM    620  CB  SER A  46       4.702  -2.252  -4.079  1.00  0.00           C
ATOM    621  OG  SER A  46       5.485  -1.221  -4.675  1.00  0.00           O
ATOM      0  H   SER A  46       3.337  -2.095  -1.982  1.00  0.00           H   new
ATOM      0  HA  SER A  46       5.613  -3.665  -2.763  1.00  0.00           H   new
ATOM      0  HB2 SER A  46       4.699  -3.127  -4.729  1.00  0.00           H   new
ATOM      0  HB3 SER A  46       3.669  -1.917  -3.991  1.00  0.00           H   new
ATOM      0  HG  SER A  46       5.220  -1.109  -5.612  1.00  0.00           H   new
ATOM    626  N   LYS A  47       6.002  -0.447  -2.089  1.00  0.00           N
ATOM    627  CA  LYS A  47       6.973   0.554  -1.684  1.00  0.00           C
ATOM    628  C   LYS A  47       6.290   1.589  -0.787  1.00  0.00           C
ATOM    629  O   LYS A  47       5.113   1.895  -0.972  1.00  0.00           O
ATOM    630  CB  LYS A  47       7.659   1.162  -2.909  1.00  0.00           C
ATOM    631  CG  LYS A  47       8.399   2.450  -2.542  1.00  0.00           C
ATOM    632  CD  LYS A  47       9.862   2.387  -2.984  1.00  0.00           C
ATOM    633  CE  LYS A  47      10.801   2.397  -1.776  1.00  0.00           C
ATOM    634  NZ  LYS A  47      12.211   2.307  -2.215  1.00  0.00           N
ATOM      0  H   LYS A  47       5.053  -0.095  -2.213  1.00  0.00           H   new
ATOM      0  HA  LYS A  47       7.768   0.096  -1.096  1.00  0.00           H   new
ATOM      0  HB2 LYS A  47       8.361   0.443  -3.331  1.00  0.00           H   new
ATOM      0  HB3 LYS A  47       6.917   1.372  -3.679  1.00  0.00           H   new
ATOM      0  HG2 LYS A  47       7.909   3.302  -3.014  1.00  0.00           H   new
ATOM      0  HG3 LYS A  47       8.347   2.609  -1.465  1.00  0.00           H   new
ATOM      0  HD2 LYS A  47      10.029   1.484  -3.572  1.00  0.00           H   new
ATOM      0  HD3 LYS A  47      10.087   3.235  -3.631  1.00  0.00           H   new
ATOM      0  HE2 LYS A  47      10.651   3.310  -1.199  1.00  0.00           H   new
ATOM      0  HE3 LYS A  47      10.565   1.561  -1.117  1.00  0.00           H   new
ATOM      0  HZ1 LYS A  47      12.835   2.315  -1.383  1.00  0.00           H   new
ATOM      0  HZ2 LYS A  47      12.354   1.424  -2.746  1.00  0.00           H   new
ATOM      0  HZ3 LYS A  47      12.437   3.118  -2.825  1.00  0.00           H   new
ATOM    644  N   VAL A  48       7.057   2.097   0.166  1.00  0.00           N
ATOM    645  CA  VAL A  48       6.540   3.090   1.092  1.00  0.00           C
ATOM    646  C   VAL A  48       7.485   4.293   1.125  1.00  0.00           C
ATOM    647  O   VAL A  48       8.697   4.130   1.259  1.00  0.00           O
ATOM    648  CB  VAL A  48       6.326   2.460   2.470  1.00  0.00           C
ATOM    649  CG1 VAL A  48       6.175   3.535   3.548  1.00  0.00           C
ATOM    650  CG2 VAL A  48       5.119   1.519   2.462  1.00  0.00           C
ATOM      0  H   VAL A  48       8.032   1.840   0.317  1.00  0.00           H   new
ATOM      0  HA  VAL A  48       5.567   3.451   0.760  1.00  0.00           H   new
ATOM      0  HB  VAL A  48       7.210   1.869   2.708  1.00  0.00           H   new
ATOM      0 HG11 VAL A  48       6.024   3.060   4.517  1.00  0.00           H   new
ATOM      0 HG12 VAL A  48       7.076   4.147   3.580  1.00  0.00           H   new
ATOM      0 HG13 VAL A  48       5.317   4.165   3.316  1.00  0.00           H   new
ATOM      0 HG21 VAL A  48       4.990   1.085   3.453  1.00  0.00           H   new
ATOM      0 HG22 VAL A  48       4.223   2.078   2.191  1.00  0.00           H   new
ATOM      0 HG23 VAL A  48       5.283   0.723   1.736  1.00  0.00           H   new
ATOM    660  N   ILE A  49       6.896   5.472   1.001  1.00  0.00           N
ATOM    661  CA  ILE A  49       7.671   6.702   1.015  1.00  0.00           C
ATOM    662  C   ILE A  49       8.303   6.886   2.396  1.00  0.00           C
ATOM    663  O   ILE A  49       7.606   6.862   3.409  1.00  0.00           O
ATOM    664  CB  ILE A  49       6.807   7.884   0.570  1.00  0.00           C
ATOM    665  CG1 ILE A  49       6.289   7.680  -0.854  1.00  0.00           C
ATOM    666  CG2 ILE A  49       7.566   9.204   0.721  1.00  0.00           C
ATOM    667  CD1 ILE A  49       7.442   7.410  -1.824  1.00  0.00           C
ATOM      0  H   ILE A  49       5.891   5.603   0.890  1.00  0.00           H   new
ATOM      0  HA  ILE A  49       8.488   6.646   0.296  1.00  0.00           H   new
ATOM      0  HB  ILE A  49       5.936   7.936   1.224  1.00  0.00           H   new
ATOM      0 HG12 ILE A  49       5.589   6.845  -0.874  1.00  0.00           H   new
ATOM      0 HG13 ILE A  49       5.739   8.565  -1.175  1.00  0.00           H   new
ATOM      0 HG21 ILE A  49       6.930  10.028   0.398  1.00  0.00           H   new
ATOM      0 HG22 ILE A  49       7.843   9.347   1.765  1.00  0.00           H   new
ATOM      0 HG23 ILE A  49       8.466   9.178   0.107  1.00  0.00           H   new
ATOM      0 HD11 ILE A  49       7.046   7.269  -2.830  1.00  0.00           H   new
ATOM      0 HD12 ILE A  49       8.127   8.258  -1.820  1.00  0.00           H   new
ATOM      0 HD13 ILE A  49       7.975   6.511  -1.514  1.00  0.00           H   new
ATOM    678  N   PRO A  50       9.650   7.071   2.391  1.00  0.00           N
ATOM    679  CA  PRO A  50      10.383   7.258   3.632  1.00  0.00           C
ATOM    680  C   PRO A  50      10.158   8.663   4.195  1.00  0.00           C
ATOM    681  O   PRO A  50      11.110   9.417   4.393  1.00  0.00           O
ATOM    682  CB  PRO A  50      11.836   6.988   3.274  1.00  0.00           C
ATOM    683  CG  PRO A  50      11.924   7.114   1.762  1.00  0.00           C
ATOM    684  CD  PRO A  50      10.508   7.105   1.211  1.00  0.00           C
ATOM      0  HA  PRO A  50      10.049   6.587   4.423  1.00  0.00           H   new
ATOM      0  HB2 PRO A  50      12.498   7.702   3.764  1.00  0.00           H   new
ATOM      0  HB3 PRO A  50      12.140   5.994   3.601  1.00  0.00           H   new
ATOM      0  HG2 PRO A  50      12.436   8.036   1.485  1.00  0.00           H   new
ATOM      0  HG3 PRO A  50      12.502   6.290   1.343  1.00  0.00           H   new
ATOM      0  HD2 PRO A  50      10.313   7.990   0.606  1.00  0.00           H   new
ATOM      0  HD3 PRO A  50      10.337   6.238   0.572  1.00  0.00           H   new
ATOM    689  N   ASP A  51       8.893   8.973   4.435  1.00  0.00           N
ATOM    690  CA  ASP A  51       8.530  10.274   4.971  1.00  0.00           C
ATOM    691  C   ASP A  51       7.075  10.581   4.613  1.00  0.00           C
ATOM    692  O   ASP A  51       6.761  11.686   4.172  1.00  0.00           O
ATOM    693  CB  ASP A  51       9.407  11.378   4.379  1.00  0.00           C
ATOM    694  CG  ASP A  51       9.715  11.228   2.887  1.00  0.00           C
ATOM    695  OD1 ASP A  51       8.754  11.340   2.096  1.00  0.00           O
ATOM    696  OD2 ASP A  51      10.904  11.005   2.573  1.00  0.00           O
ATOM      0  H   ASP A  51       8.106   8.346   4.268  1.00  0.00           H   new
ATOM      0  HA  ASP A  51       8.670  10.244   6.052  1.00  0.00           H   new
ATOM      0  HB2 ASP A  51       8.915  12.337   4.539  1.00  0.00           H   new
ATOM      0  HB3 ASP A  51      10.348  11.407   4.928  1.00  0.00           H   new
ATOM    700  N   SER A  52       6.226   9.585   4.812  1.00  0.00           N
ATOM    701  CA  SER A  52       4.812   9.734   4.516  1.00  0.00           C
ATOM    702  C   SER A  52       3.977   9.386   5.750  1.00  0.00           C
ATOM    703  O   SER A  52       4.521   9.194   6.836  1.00  0.00           O
ATOM    704  CB  SER A  52       4.402   8.854   3.333  1.00  0.00           C
ATOM    705  OG  SER A  52       4.649   7.474   3.583  1.00  0.00           O
ATOM      0  H   SER A  52       6.491   8.669   5.175  1.00  0.00           H   new
ATOM      0  HA  SER A  52       4.628  10.773   4.244  1.00  0.00           H   new
ATOM      0  HB2 SER A  52       3.343   9.000   3.123  1.00  0.00           H   new
ATOM      0  HB3 SER A  52       4.950   9.165   2.443  1.00  0.00           H   new
ATOM      0  HG  SER A  52       5.611   7.297   3.521  1.00  0.00           H   new
ATOM    710  N   ASP A  53       2.671   9.316   5.541  1.00  0.00           N
ATOM    711  CA  ASP A  53       1.756   8.995   6.623  1.00  0.00           C
ATOM    712  C   ASP A  53       1.819   7.493   6.909  1.00  0.00           C
ATOM    713  O   ASP A  53       1.618   7.064   8.045  1.00  0.00           O
ATOM    714  CB  ASP A  53       0.315   9.345   6.249  1.00  0.00           C
ATOM    715  CG  ASP A  53       0.107  10.775   5.748  1.00  0.00           C
ATOM    716  OD1 ASP A  53       0.774  11.131   4.754  1.00  0.00           O
ATOM    717  OD2 ASP A  53      -0.717  11.480   6.372  1.00  0.00           O
ATOM      0  H   ASP A  53       2.224   9.476   4.638  1.00  0.00           H   new
ATOM      0  HA  ASP A  53       2.052   9.575   7.498  1.00  0.00           H   new
ATOM      0  HB2 ASP A  53      -0.023   8.653   5.478  1.00  0.00           H   new
ATOM      0  HB3 ASP A  53      -0.320   9.185   7.121  1.00  0.00           H   new
ATOM    721  N   ALA A  54       2.098   6.734   5.859  1.00  0.00           N
ATOM    722  CA  ALA A  54       2.189   5.289   5.983  1.00  0.00           C
ATOM    723  C   ALA A  54       3.462   4.927   6.752  1.00  0.00           C
ATOM    724  O   ALA A  54       3.439   4.060   7.624  1.00  0.00           O
ATOM    725  CB  ALA A  54       2.149   4.654   4.592  1.00  0.00           C
ATOM      0  H   ALA A  54       2.264   7.093   4.919  1.00  0.00           H   new
ATOM      0  HA  ALA A  54       1.341   4.898   6.545  1.00  0.00           H   new
ATOM      0  HB1 ALA A  54       2.217   3.570   4.685  1.00  0.00           H   new
ATOM      0  HB2 ALA A  54       1.214   4.918   4.098  1.00  0.00           H   new
ATOM      0  HB3 ALA A  54       2.988   5.021   4.000  1.00  0.00           H   new
ATOM    731  N   HIS A  55       4.542   5.610   6.401  1.00  0.00           N
ATOM    732  CA  HIS A  55       5.821   5.372   7.048  1.00  0.00           C
ATOM    733  C   HIS A  55       5.666   5.518   8.563  1.00  0.00           C
ATOM    734  O   HIS A  55       6.175   4.698   9.325  1.00  0.00           O
ATOM    735  CB  HIS A  55       6.901   6.289   6.470  1.00  0.00           C
ATOM    736  CG  HIS A  55       8.292   5.994   6.978  1.00  0.00           C
ATOM    737  ND1 HIS A  55       9.332   6.904   6.888  1.00  0.00           N
ATOM    738  CD2 HIS A  55       8.804   4.883   7.581  1.00  0.00           C
ATOM    739  CE1 HIS A  55      10.415   6.355   7.416  1.00  0.00           C
ATOM    740  NE2 HIS A  55      10.087   5.103   7.845  1.00  0.00           N
ATOM      0  H   HIS A  55       4.557   6.328   5.677  1.00  0.00           H   new
ATOM      0  HA  HIS A  55       6.149   4.352   6.849  1.00  0.00           H   new
ATOM      0  HB2 HIS A  55       6.895   6.200   5.384  1.00  0.00           H   new
ATOM      0  HB3 HIS A  55       6.650   7.323   6.707  1.00  0.00           H   new
ATOM      0  HD2 HIS A  55       8.259   3.978   7.806  1.00  0.00           H   new
ATOM      0  HE1 HIS A  55      11.388   6.818   7.493  1.00  0.00           H   new
ATOM      0  HE2 HIS A  55      10.722   4.444   8.295  1.00  0.00           H   new
ATOM    747  N   ARG A  56       4.961   6.569   8.954  1.00  0.00           N
ATOM    748  CA  ARG A  56       4.732   6.834  10.364  1.00  0.00           C
ATOM    749  C   ARG A  56       3.647   5.904  10.910  1.00  0.00           C
ATOM    750  O   ARG A  56       3.806   5.318  11.980  1.00  0.00           O
ATOM    751  CB  ARG A  56       4.310   8.287  10.590  1.00  0.00           C
ATOM    752  CG  ARG A  56       5.530   9.209  10.661  1.00  0.00           C
ATOM    753  CD  ARG A  56       5.594  10.126   9.438  1.00  0.00           C
ATOM    754  NE  ARG A  56       5.777  11.531   9.869  1.00  0.00           N
ATOM    755  CZ  ARG A  56       5.454  12.594   9.120  1.00  0.00           C
ATOM    756  NH1 ARG A  56       4.931  12.421   7.899  1.00  0.00           N
ATOM    757  NH2 ARG A  56       5.656  13.832   9.593  1.00  0.00           N
ATOM      0  H   ARG A  56       4.541   7.247   8.319  1.00  0.00           H   new
ATOM      0  HA  ARG A  56       5.669   6.654  10.891  1.00  0.00           H   new
ATOM      0  HB2 ARG A  56       3.654   8.609   9.781  1.00  0.00           H   new
ATOM      0  HB3 ARG A  56       3.738   8.363  11.515  1.00  0.00           H   new
ATOM      0  HG2 ARG A  56       5.484   9.810  11.569  1.00  0.00           H   new
ATOM      0  HG3 ARG A  56       6.440   8.611  10.720  1.00  0.00           H   new
ATOM      0  HD2 ARG A  56       6.417   9.825   8.790  1.00  0.00           H   new
ATOM      0  HD3 ARG A  56       4.678  10.032   8.854  1.00  0.00           H   new
ATOM      0  HE  ARG A  56       6.174  11.700  10.793  1.00  0.00           H   new
ATOM      0 HH11 ARG A  56       4.778  11.479   7.538  1.00  0.00           H   new
ATOM      0 HH12 ARG A  56       4.686  13.231   7.330  1.00  0.00           H   new
ATOM      0 HH21 ARG A  56       6.055  13.964  10.522  1.00  0.00           H   new
ATOM      0 HH22 ARG A  56       5.410  14.642   9.024  1.00  0.00           H   new
ATOM    768  N   ALA A  57       2.566   5.797  10.150  1.00  0.00           N
ATOM    769  CA  ALA A  57       1.456   4.949  10.544  1.00  0.00           C
ATOM    770  C   ALA A  57       1.996   3.607  11.044  1.00  0.00           C
ATOM    771  O   ALA A  57       1.439   3.014  11.967  1.00  0.00           O
ATOM    772  CB  ALA A  57       0.494   4.786   9.365  1.00  0.00           C
ATOM      0  H   ALA A  57       2.437   6.284   9.263  1.00  0.00           H   new
ATOM      0  HA  ALA A  57       0.897   5.405  11.361  1.00  0.00           H   new
ATOM      0  HB1 ALA A  57      -0.340   4.149   9.661  1.00  0.00           H   new
ATOM      0  HB2 ALA A  57       0.116   5.764   9.066  1.00  0.00           H   new
ATOM      0  HB3 ALA A  57       1.020   4.329   8.527  1.00  0.00           H   new
ATOM    778  N   GLY A  58       3.075   3.168  10.412  1.00  0.00           N
ATOM    779  CA  GLY A  58       3.697   1.908  10.781  1.00  0.00           C
ATOM    780  C   GLY A  58       3.676   0.922   9.610  1.00  0.00           C
ATOM    781  O   GLY A  58       3.536  -0.282   9.812  1.00  0.00           O
ATOM      0  H   GLY A  58       3.534   3.663   9.647  1.00  0.00           H   new
ATOM      0  HA2 GLY A  58       4.726   2.084  11.094  1.00  0.00           H   new
ATOM      0  HA3 GLY A  58       3.174   1.476  11.634  1.00  0.00           H   new
ATOM    785  N   LEU A  59       3.817   1.473   8.414  1.00  0.00           N
ATOM    786  CA  LEU A  59       3.817   0.657   7.212  1.00  0.00           C
ATOM    787  C   LEU A  59       5.259   0.317   6.831  1.00  0.00           C
ATOM    788  O   LEU A  59       6.139   1.174   6.889  1.00  0.00           O
ATOM    789  CB  LEU A  59       3.033   1.351   6.094  1.00  0.00           C
ATOM    790  CG  LEU A  59       1.527   1.084   6.067  1.00  0.00           C
ATOM    791  CD1 LEU A  59       0.834   1.965   5.025  1.00  0.00           C
ATOM    792  CD2 LEU A  59       1.237  -0.401   5.846  1.00  0.00           C
ATOM      0  H   LEU A  59       3.932   2.473   8.251  1.00  0.00           H   new
ATOM      0  HA  LEU A  59       3.304  -0.287   7.393  1.00  0.00           H   new
ATOM      0  HB2 LEU A  59       3.190   2.426   6.180  1.00  0.00           H   new
ATOM      0  HB3 LEU A  59       3.454   1.043   5.137  1.00  0.00           H   new
ATOM      0  HG  LEU A  59       1.115   1.350   7.040  1.00  0.00           H   new
ATOM      0 HD11 LEU A  59      -0.236   1.756   5.025  1.00  0.00           H   new
ATOM      0 HD12 LEU A  59       0.999   3.015   5.268  1.00  0.00           H   new
ATOM      0 HD13 LEU A  59       1.245   1.753   4.038  1.00  0.00           H   new
ATOM      0 HD21 LEU A  59       0.159  -0.563   5.831  1.00  0.00           H   new
ATOM      0 HD22 LEU A  59       1.665  -0.718   4.895  1.00  0.00           H   new
ATOM      0 HD23 LEU A  59       1.680  -0.982   6.654  1.00  0.00           H   new
ATOM    803  N   GLN A  60       5.456  -0.937   6.449  1.00  0.00           N
ATOM    804  CA  GLN A  60       6.776  -1.401   6.059  1.00  0.00           C
ATOM    805  C   GLN A  60       6.669  -2.397   4.902  1.00  0.00           C
ATOM    806  O   GLN A  60       5.789  -3.256   4.898  1.00  0.00           O
ATOM    807  CB  GLN A  60       7.514  -2.020   7.248  1.00  0.00           C
ATOM    808  CG  GLN A  60       6.731  -3.201   7.825  1.00  0.00           C
ATOM    809  CD  GLN A  60       7.671  -4.220   8.470  1.00  0.00           C
ATOM    810  OE1 GLN A  60       7.773  -4.330   9.681  1.00  0.00           O
ATOM    811  NE2 GLN A  60       8.351  -4.958   7.597  1.00  0.00           N
ATOM      0  H   GLN A  60       4.723  -1.645   6.402  1.00  0.00           H   new
ATOM      0  HA  GLN A  60       7.356  -0.542   5.721  1.00  0.00           H   new
ATOM      0  HB2 GLN A  60       8.503  -2.354   6.933  1.00  0.00           H   new
ATOM      0  HB3 GLN A  60       7.663  -1.266   8.021  1.00  0.00           H   new
ATOM      0  HG2 GLN A  60       6.016  -2.841   8.565  1.00  0.00           H   new
ATOM      0  HG3 GLN A  60       6.156  -3.682   7.034  1.00  0.00           H   new
ATOM      0 HE21 GLN A  60       8.219  -4.815   6.596  1.00  0.00           H   new
ATOM      0 HE22 GLN A  60       9.005  -5.667   7.929  1.00  0.00           H   new
ATOM    818  N   GLU A  61       7.577  -2.248   3.948  1.00  0.00           N
ATOM    819  CA  GLU A  61       7.594  -3.123   2.789  1.00  0.00           C
ATOM    820  C   GLU A  61       7.526  -4.588   3.228  1.00  0.00           C
ATOM    821  O   GLU A  61       8.457  -5.098   3.849  1.00  0.00           O
ATOM    822  CB  GLU A  61       8.832  -2.867   1.927  1.00  0.00           C
ATOM    823  CG  GLU A  61       8.489  -1.994   0.719  1.00  0.00           C
ATOM    824  CD  GLU A  61       9.608  -0.991   0.431  1.00  0.00           C
ATOM    825  OE1 GLU A  61       9.602   0.071   1.090  1.00  0.00           O
ATOM    826  OE2 GLU A  61      10.444  -1.310  -0.442  1.00  0.00           O
ATOM      0  H   GLU A  61       8.306  -1.534   3.955  1.00  0.00           H   new
ATOM      0  HA  GLU A  61       6.716  -2.905   2.181  1.00  0.00           H   new
ATOM      0  HB2 GLU A  61       9.602  -2.379   2.526  1.00  0.00           H   new
ATOM      0  HB3 GLU A  61       9.246  -3.817   1.588  1.00  0.00           H   new
ATOM      0  HG2 GLU A  61       8.327  -2.624  -0.155  1.00  0.00           H   new
ATOM      0  HG3 GLU A  61       7.557  -1.461   0.904  1.00  0.00           H   new
ATOM    831  N   GLY A  62       6.413  -5.222   2.888  1.00  0.00           N
ATOM    832  CA  GLY A  62       6.210  -6.617   3.240  1.00  0.00           C
ATOM    833  C   GLY A  62       4.876  -6.812   3.961  1.00  0.00           C
ATOM    834  O   GLY A  62       4.322  -7.911   3.966  1.00  0.00           O
ATOM      0  H   GLY A  62       5.643  -4.795   2.373  1.00  0.00           H   new
ATOM      0  HA2 GLY A  62       6.233  -7.230   2.339  1.00  0.00           H   new
ATOM      0  HA3 GLY A  62       7.025  -6.957   3.878  1.00  0.00           H   new
ATOM    838  N   ASP A  63       4.394  -5.729   4.554  1.00  0.00           N
ATOM    839  CA  ASP A  63       3.135  -5.767   5.277  1.00  0.00           C
ATOM    840  C   ASP A  63       2.004  -6.109   4.304  1.00  0.00           C
ATOM    841  O   ASP A  63       1.859  -5.467   3.266  1.00  0.00           O
ATOM    842  CB  ASP A  63       2.821  -4.409   5.908  1.00  0.00           C
ATOM    843  CG  ASP A  63       3.382  -4.205   7.317  1.00  0.00           C
ATOM    844  OD1 ASP A  63       3.657  -5.234   7.972  1.00  0.00           O
ATOM    845  OD2 ASP A  63       3.523  -3.026   7.707  1.00  0.00           O
ATOM      0  H   ASP A  63       4.854  -4.819   4.548  1.00  0.00           H   new
ATOM      0  HA  ASP A  63       3.219  -6.519   6.062  1.00  0.00           H   new
ATOM      0  HB2 ASP A  63       3.213  -3.625   5.260  1.00  0.00           H   new
ATOM      0  HB3 ASP A  63       1.739  -4.283   5.942  1.00  0.00           H   new
ATOM    849  N   GLN A  64       1.233  -7.121   4.676  1.00  0.00           N
ATOM    850  CA  GLN A  64       0.120  -7.557   3.850  1.00  0.00           C
ATOM    851  C   GLN A  64      -1.126  -6.724   4.158  1.00  0.00           C
ATOM    852  O   GLN A  64      -1.308  -6.265   5.285  1.00  0.00           O
ATOM    853  CB  GLN A  64      -0.154  -9.049   4.043  1.00  0.00           C
ATOM    854  CG  GLN A  64      -1.570  -9.409   3.587  1.00  0.00           C
ATOM    855  CD  GLN A  64      -1.672 -10.896   3.240  1.00  0.00           C
ATOM    856  OE1 GLN A  64      -0.909 -11.723   3.710  1.00  0.00           O
ATOM    857  NE2 GLN A  64      -2.656 -11.188   2.395  1.00  0.00           N
ATOM      0  H   GLN A  64       1.357  -7.651   5.538  1.00  0.00           H   new
ATOM      0  HA  GLN A  64       0.386  -7.404   2.804  1.00  0.00           H   new
ATOM      0  HB2 GLN A  64       0.573  -9.632   3.478  1.00  0.00           H   new
ATOM      0  HB3 GLN A  64      -0.028  -9.313   5.093  1.00  0.00           H   new
ATOM      0  HG2 GLN A  64      -2.283  -9.166   4.375  1.00  0.00           H   new
ATOM      0  HG3 GLN A  64      -1.840  -8.809   2.717  1.00  0.00           H   new
ATOM      0 HE21 GLN A  64      -3.259 -10.447   2.039  1.00  0.00           H   new
ATOM      0 HE22 GLN A  64      -2.808 -12.153   2.103  1.00  0.00           H   new
ATOM    864  N   VAL A  65      -1.955  -6.557   3.138  1.00  0.00           N
ATOM    865  CA  VAL A  65      -3.179  -5.790   3.284  1.00  0.00           C
ATOM    866  C   VAL A  65      -4.379  -6.736   3.229  1.00  0.00           C
ATOM    867  O   VAL A  65      -4.880  -7.047   2.150  1.00  0.00           O
ATOM    868  CB  VAL A  65      -3.237  -4.688   2.225  1.00  0.00           C
ATOM    869  CG1 VAL A  65      -4.441  -3.771   2.452  1.00  0.00           C
ATOM    870  CG2 VAL A  65      -1.934  -3.886   2.196  1.00  0.00           C
ATOM      0  H   VAL A  65      -1.802  -6.941   2.205  1.00  0.00           H   new
ATOM      0  HA  VAL A  65      -3.203  -5.291   4.253  1.00  0.00           H   new
ATOM      0  HB  VAL A  65      -3.358  -5.165   1.252  1.00  0.00           H   new
ATOM      0 HG11 VAL A  65      -4.458  -2.997   1.685  1.00  0.00           H   new
ATOM      0 HG12 VAL A  65      -5.359  -4.356   2.398  1.00  0.00           H   new
ATOM      0 HG13 VAL A  65      -4.364  -3.307   3.435  1.00  0.00           H   new
ATOM      0 HG21 VAL A  65      -2.002  -3.109   1.434  1.00  0.00           H   new
ATOM      0 HG22 VAL A  65      -1.768  -3.426   3.170  1.00  0.00           H   new
ATOM      0 HG23 VAL A  65      -1.103  -4.551   1.963  1.00  0.00           H   new
ATOM    880  N   LEU A  66      -4.806  -7.168   4.406  1.00  0.00           N
ATOM    881  CA  LEU A  66      -5.938  -8.074   4.506  1.00  0.00           C
ATOM    882  C   LEU A  66      -7.146  -7.452   3.802  1.00  0.00           C
ATOM    883  O   LEU A  66      -7.604  -7.962   2.780  1.00  0.00           O
ATOM    884  CB  LEU A  66      -6.202  -8.445   5.967  1.00  0.00           C
ATOM    885  CG  LEU A  66      -5.004  -8.990   6.747  1.00  0.00           C
ATOM    886  CD1 LEU A  66      -5.327  -9.105   8.237  1.00  0.00           C
ATOM    887  CD2 LEU A  66      -4.527 -10.320   6.160  1.00  0.00           C
ATOM      0  H   LEU A  66      -4.388  -6.907   5.299  1.00  0.00           H   new
ATOM      0  HA  LEU A  66      -5.720  -9.013   3.998  1.00  0.00           H   new
ATOM      0  HB2 LEU A  66      -6.575  -7.561   6.484  1.00  0.00           H   new
ATOM      0  HB3 LEU A  66      -6.997  -9.190   5.994  1.00  0.00           H   new
ATOM      0  HG  LEU A  66      -4.182  -8.281   6.649  1.00  0.00           H   new
ATOM      0 HD11 LEU A  66      -4.459  -9.495   8.768  1.00  0.00           H   new
ATOM      0 HD12 LEU A  66      -5.582  -8.121   8.631  1.00  0.00           H   new
ATOM      0 HD13 LEU A  66      -6.171  -9.781   8.375  1.00  0.00           H   new
ATOM      0 HD21 LEU A  66      -3.675 -10.686   6.733  1.00  0.00           H   new
ATOM      0 HD22 LEU A  66      -5.336 -11.049   6.207  1.00  0.00           H   new
ATOM      0 HD23 LEU A  66      -4.230 -10.174   5.121  1.00  0.00           H   new
ATOM    898  N   ALA A  67      -7.628  -6.360   4.376  1.00  0.00           N
ATOM    899  CA  ALA A  67      -8.774  -5.663   3.817  1.00  0.00           C
ATOM    900  C   ALA A  67      -8.542  -4.153   3.910  1.00  0.00           C
ATOM    901  O   ALA A  67      -7.674  -3.700   4.653  1.00  0.00           O
ATOM    902  CB  ALA A  67     -10.045  -6.104   4.545  1.00  0.00           C
ATOM      0  H   ALA A  67      -7.246  -5.940   5.223  1.00  0.00           H   new
ATOM      0  HA  ALA A  67      -8.899  -5.913   2.763  1.00  0.00           H   new
ATOM      0  HB1 ALA A  67     -10.905  -5.581   4.126  1.00  0.00           H   new
ATOM      0  HB2 ALA A  67     -10.179  -7.179   4.424  1.00  0.00           H   new
ATOM      0  HB3 ALA A  67      -9.958  -5.867   5.605  1.00  0.00           H   new
ATOM    908  N   VAL A  68      -9.335  -3.417   3.145  1.00  0.00           N
ATOM    909  CA  VAL A  68      -9.227  -1.968   3.131  1.00  0.00           C
ATOM    910  C   VAL A  68     -10.622  -1.356   3.273  1.00  0.00           C
ATOM    911  O   VAL A  68     -11.408  -1.369   2.327  1.00  0.00           O
ATOM    912  CB  VAL A  68      -8.498  -1.510   1.866  1.00  0.00           C
ATOM    913  CG1 VAL A  68      -8.555   0.013   1.723  1.00  0.00           C
ATOM    914  CG2 VAL A  68      -7.052  -2.008   1.855  1.00  0.00           C
ATOM      0  H   VAL A  68     -10.055  -3.797   2.530  1.00  0.00           H   new
ATOM      0  HA  VAL A  68      -8.632  -1.621   3.976  1.00  0.00           H   new
ATOM      0  HB  VAL A  68      -9.008  -1.947   1.008  1.00  0.00           H   new
ATOM      0 HG11 VAL A  68      -8.030   0.313   0.816  1.00  0.00           H   new
ATOM      0 HG12 VAL A  68      -9.595   0.334   1.663  1.00  0.00           H   new
ATOM      0 HG13 VAL A  68      -8.081   0.478   2.588  1.00  0.00           H   new
ATOM      0 HG21 VAL A  68      -6.557  -1.668   0.945  1.00  0.00           H   new
ATOM      0 HG22 VAL A  68      -6.525  -1.614   2.724  1.00  0.00           H   new
ATOM      0 HG23 VAL A  68      -7.042  -3.097   1.888  1.00  0.00           H   new
ATOM    924  N   ASN A  69     -10.886  -0.835   4.463  1.00  0.00           N
ATOM    925  CA  ASN A  69     -12.172  -0.219   4.740  1.00  0.00           C
ATOM    926  C   ASN A  69     -13.288  -1.232   4.470  1.00  0.00           C
ATOM    927  O   ASN A  69     -14.258  -0.924   3.780  1.00  0.00           O
ATOM    928  CB  ASN A  69     -12.409   0.994   3.839  1.00  0.00           C
ATOM    929  CG  ASN A  69     -11.561   2.186   4.289  1.00  0.00           C
ATOM    930  OD1 ASN A  69     -10.618   2.539   3.420  1.00  0.00           O   flip
ATOM    931  ND2 ASN A  69     -11.750   2.747   5.357  1.00  0.00           N   flip
ATOM      0  H   ASN A  69     -10.231  -0.827   5.245  1.00  0.00           H   new
ATOM      0  HA  ASN A  69     -12.174   0.100   5.782  1.00  0.00           H   new
ATOM      0  HB2 ASN A  69     -12.165   0.739   2.808  1.00  0.00           H   new
ATOM      0  HB3 ASN A  69     -13.464   1.266   3.859  1.00  0.00           H   new
ATOM      0 HD21 ASN A  69     -12.492   2.425   5.978  1.00  0.00           H   new
ATOM      0 HD22 ASN A  69     -11.166   3.538   5.628  1.00  0.00           H   new
ATOM    937  N   ASP A  70     -13.111  -2.421   5.029  1.00  0.00           N
ATOM    938  CA  ASP A  70     -14.089  -3.481   4.856  1.00  0.00           C
ATOM    939  C   ASP A  70     -13.799  -4.231   3.555  1.00  0.00           C
ATOM    940  O   ASP A  70     -13.779  -5.461   3.535  1.00  0.00           O
ATOM    941  CB  ASP A  70     -15.508  -2.913   4.768  1.00  0.00           C
ATOM    942  CG  ASP A  70     -16.611  -3.852   5.256  1.00  0.00           C
ATOM    943  OD1 ASP A  70     -16.665  -4.076   6.485  1.00  0.00           O
ATOM    944  OD2 ASP A  70     -17.379  -4.325   4.390  1.00  0.00           O
ATOM      0  H   ASP A  70     -12.305  -2.673   5.602  1.00  0.00           H   new
ATOM      0  HA  ASP A  70     -14.019  -4.147   5.716  1.00  0.00           H   new
ATOM      0  HB2 ASP A  70     -15.551  -1.992   5.350  1.00  0.00           H   new
ATOM      0  HB3 ASP A  70     -15.712  -2.645   3.731  1.00  0.00           H   new
ATOM    948  N   VAL A  71     -13.581  -3.459   2.500  1.00  0.00           N
ATOM    949  CA  VAL A  71     -13.292  -4.036   1.198  1.00  0.00           C
ATOM    950  C   VAL A  71     -12.118  -5.008   1.325  1.00  0.00           C
ATOM    951  O   VAL A  71     -11.062  -4.649   1.842  1.00  0.00           O
ATOM    952  CB  VAL A  71     -13.039  -2.923   0.179  1.00  0.00           C
ATOM    953  CG1 VAL A  71     -12.790  -3.504  -1.215  1.00  0.00           C
ATOM    954  CG2 VAL A  71     -14.198  -1.925   0.157  1.00  0.00           C
ATOM      0  H   VAL A  71     -13.599  -2.439   2.520  1.00  0.00           H   new
ATOM      0  HA  VAL A  71     -14.147  -4.605   0.833  1.00  0.00           H   new
ATOM      0  HB  VAL A  71     -12.141  -2.386   0.485  1.00  0.00           H   new
ATOM      0 HG11 VAL A  71     -12.613  -2.693  -1.921  1.00  0.00           H   new
ATOM      0 HG12 VAL A  71     -11.918  -4.157  -1.186  1.00  0.00           H   new
ATOM      0 HG13 VAL A  71     -13.662  -4.077  -1.532  1.00  0.00           H   new
ATOM      0 HG21 VAL A  71     -13.992  -1.145  -0.576  1.00  0.00           H   new
ATOM      0 HG22 VAL A  71     -15.119  -2.442  -0.113  1.00  0.00           H   new
ATOM      0 HG23 VAL A  71     -14.310  -1.476   1.144  1.00  0.00           H   new
ATOM    964  N   ASP A  72     -12.343  -6.222   0.844  1.00  0.00           N
ATOM    965  CA  ASP A  72     -11.317  -7.251   0.897  1.00  0.00           C
ATOM    966  C   ASP A  72     -10.275  -6.981  -0.191  1.00  0.00           C
ATOM    967  O   ASP A  72     -10.625  -6.651  -1.323  1.00  0.00           O
ATOM    968  CB  ASP A  72     -11.913  -8.637   0.647  1.00  0.00           C
ATOM    969  CG  ASP A  72     -13.227  -8.918   1.380  1.00  0.00           C
ATOM    970  OD1 ASP A  72     -13.144  -9.300   2.568  1.00  0.00           O
ATOM    971  OD2 ASP A  72     -14.283  -8.742   0.736  1.00  0.00           O
ATOM      0  H   ASP A  72     -13.221  -6.517   0.416  1.00  0.00           H   new
ATOM      0  HA  ASP A  72     -10.866  -7.227   1.889  1.00  0.00           H   new
ATOM      0  HB2 ASP A  72     -12.079  -8.757  -0.424  1.00  0.00           H   new
ATOM      0  HB3 ASP A  72     -11.182  -9.389   0.942  1.00  0.00           H   new
ATOM    975  N   PHE A  73      -9.015  -7.133   0.190  1.00  0.00           N
ATOM    976  CA  PHE A  73      -7.920  -6.911  -0.739  1.00  0.00           C
ATOM    977  C   PHE A  73      -7.238  -8.230  -1.108  1.00  0.00           C
ATOM    978  O   PHE A  73      -6.554  -8.315  -2.127  1.00  0.00           O
ATOM    979  CB  PHE A  73      -6.909  -6.009  -0.030  1.00  0.00           C
ATOM    980  CG  PHE A  73      -6.949  -4.549  -0.486  1.00  0.00           C
ATOM    981  CD1 PHE A  73      -8.144  -3.928  -0.675  1.00  0.00           C
ATOM    982  CD2 PHE A  73      -5.789  -3.873  -0.705  1.00  0.00           C
ATOM    983  CE1 PHE A  73      -8.182  -2.574  -1.099  1.00  0.00           C
ATOM    984  CE2 PHE A  73      -5.828  -2.518  -1.130  1.00  0.00           C
ATOM    985  CZ  PHE A  73      -7.023  -1.898  -1.318  1.00  0.00           C
ATOM      0  H   PHE A  73      -8.728  -7.407   1.130  1.00  0.00           H   new
ATOM      0  HA  PHE A  73      -8.296  -6.459  -1.657  1.00  0.00           H   new
ATOM      0  HB2 PHE A  73      -7.093  -6.049   1.044  1.00  0.00           H   new
ATOM      0  HB3 PHE A  73      -5.907  -6.403  -0.196  1.00  0.00           H   new
ATOM      0  HD1 PHE A  73      -9.065  -4.465  -0.502  1.00  0.00           H   new
ATOM      0  HD2 PHE A  73      -4.840  -4.366  -0.556  1.00  0.00           H   new
ATOM      0  HE1 PHE A  73      -9.131  -2.081  -1.248  1.00  0.00           H   new
ATOM      0  HE2 PHE A  73      -4.908  -1.980  -1.304  1.00  0.00           H   new
ATOM      0  HZ  PHE A  73      -7.052  -0.868  -1.641  1.00  0.00           H   new
ATOM    994  N   GLN A  74      -7.449  -9.226  -0.260  1.00  0.00           N
ATOM    995  CA  GLN A  74      -6.863 -10.537  -0.485  1.00  0.00           C
ATOM    996  C   GLN A  74      -6.949 -10.910  -1.966  1.00  0.00           C
ATOM    997  O   GLN A  74      -6.070 -11.592  -2.490  1.00  0.00           O
ATOM    998  CB  GLN A  74      -7.538 -11.596   0.389  1.00  0.00           C
ATOM    999  CG  GLN A  74      -7.117 -11.450   1.852  1.00  0.00           C
ATOM   1000  CD  GLN A  74      -6.418 -12.717   2.350  1.00  0.00           C
ATOM   1001  OE1 GLN A  74      -5.307 -13.039   1.959  1.00  0.00           O
ATOM   1002  NE2 GLN A  74      -7.126 -13.415   3.232  1.00  0.00           N
ATOM      0  H   GLN A  74      -8.017  -9.152   0.584  1.00  0.00           H   new
ATOM      0  HA  GLN A  74      -5.811 -10.497  -0.202  1.00  0.00           H   new
ATOM      0  HB2 GLN A  74      -8.621 -11.503   0.308  1.00  0.00           H   new
ATOM      0  HB3 GLN A  74      -7.275 -12.591   0.029  1.00  0.00           H   new
ATOM      0  HG2 GLN A  74      -6.448 -10.596   1.958  1.00  0.00           H   new
ATOM      0  HG3 GLN A  74      -7.993 -11.248   2.468  1.00  0.00           H   new
ATOM      0 HE21 GLN A  74      -8.050 -13.089   3.517  1.00  0.00           H   new
ATOM      0 HE22 GLN A  74      -6.746 -14.276   3.624  1.00  0.00           H   new
ATOM   1009  N   ASP A  75      -8.017 -10.447  -2.598  1.00  0.00           N
ATOM   1010  CA  ASP A  75      -8.230 -10.724  -4.009  1.00  0.00           C
ATOM   1011  C   ASP A  75      -8.855  -9.497  -4.677  1.00  0.00           C
ATOM   1012  O   ASP A  75     -10.065  -9.454  -4.895  1.00  0.00           O
ATOM   1013  CB  ASP A  75      -9.184 -11.904  -4.200  1.00  0.00           C
ATOM   1014  CG  ASP A  75     -10.466 -11.842  -3.368  1.00  0.00           C
ATOM   1015  OD1 ASP A  75     -10.338 -11.894  -2.126  1.00  0.00           O
ATOM   1016  OD2 ASP A  75     -11.543 -11.744  -3.992  1.00  0.00           O
ATOM      0  H   ASP A  75      -8.744  -9.882  -2.160  1.00  0.00           H   new
ATOM      0  HA  ASP A  75      -7.265 -10.965  -4.455  1.00  0.00           H   new
ATOM      0  HB2 ASP A  75      -9.456 -11.965  -5.254  1.00  0.00           H   new
ATOM      0  HB3 ASP A  75      -8.654 -12.824  -3.954  1.00  0.00           H   new
ATOM   1020  N   ILE A  76      -8.002  -8.530  -4.982  1.00  0.00           N
ATOM   1021  CA  ILE A  76      -8.456  -7.307  -5.619  1.00  0.00           C
ATOM   1022  C   ILE A  76      -7.426  -6.866  -6.661  1.00  0.00           C
ATOM   1023  O   ILE A  76      -6.276  -7.302  -6.624  1.00  0.00           O
ATOM   1024  CB  ILE A  76      -8.764  -6.237  -4.569  1.00  0.00           C
ATOM   1025  CG1 ILE A  76      -9.592  -5.100  -5.171  1.00  0.00           C
ATOM   1026  CG2 ILE A  76      -7.479  -5.725  -3.914  1.00  0.00           C
ATOM   1027  CD1 ILE A  76     -10.587  -4.545  -4.148  1.00  0.00           C
ATOM      0  H   ILE A  76      -6.999  -8.569  -4.800  1.00  0.00           H   new
ATOM      0  HA  ILE A  76      -9.393  -7.480  -6.149  1.00  0.00           H   new
ATOM      0  HB  ILE A  76      -9.366  -6.693  -3.783  1.00  0.00           H   new
ATOM      0 HG12 ILE A  76      -8.930  -4.303  -5.509  1.00  0.00           H   new
ATOM      0 HG13 ILE A  76     -10.130  -5.461  -6.048  1.00  0.00           H   new
ATOM      0 HG21 ILE A  76      -7.726  -4.966  -3.172  1.00  0.00           H   new
ATOM      0 HG22 ILE A  76      -6.964  -6.553  -3.428  1.00  0.00           H   new
ATOM      0 HG23 ILE A  76      -6.831  -5.291  -4.675  1.00  0.00           H   new
ATOM      0 HD11 ILE A  76     -11.163  -3.738  -4.601  1.00  0.00           H   new
ATOM      0 HD12 ILE A  76     -11.263  -5.339  -3.830  1.00  0.00           H   new
ATOM      0 HD13 ILE A  76     -10.045  -4.162  -3.283  1.00  0.00           H   new
ATOM   1038  N   GLU A  77      -7.875  -6.009  -7.566  1.00  0.00           N
ATOM   1039  CA  GLU A  77      -7.006  -5.506  -8.616  1.00  0.00           C
ATOM   1040  C   GLU A  77      -6.134  -4.368  -8.084  1.00  0.00           C
ATOM   1041  O   GLU A  77      -6.590  -3.555  -7.280  1.00  0.00           O
ATOM   1042  CB  GLU A  77      -7.818  -5.053  -9.830  1.00  0.00           C
ATOM   1043  CG  GLU A  77      -8.135  -6.233 -10.750  1.00  0.00           C
ATOM   1044  CD  GLU A  77      -6.851  -6.898 -11.251  1.00  0.00           C
ATOM   1045  OE1 GLU A  77      -6.095  -6.206 -11.964  1.00  0.00           O
ATOM   1046  OE2 GLU A  77      -6.657  -8.085 -10.908  1.00  0.00           O
ATOM      0  H   GLU A  77      -8.829  -5.650  -7.594  1.00  0.00           H   new
ATOM      0  HA  GLU A  77      -6.353  -6.317  -8.939  1.00  0.00           H   new
ATOM      0  HB2 GLU A  77      -8.746  -4.587  -9.498  1.00  0.00           H   new
ATOM      0  HB3 GLU A  77      -7.261  -4.296 -10.382  1.00  0.00           H   new
ATOM      0  HG2 GLU A  77      -8.742  -6.963 -10.215  1.00  0.00           H   new
ATOM      0  HG3 GLU A  77      -8.726  -5.888 -11.599  1.00  0.00           H   new
ATOM   1051  N   HIS A  78      -4.895  -4.345  -8.552  1.00  0.00           N
ATOM   1052  CA  HIS A  78      -3.955  -3.319  -8.132  1.00  0.00           C
ATOM   1053  C   HIS A  78      -4.590  -1.938  -8.309  1.00  0.00           C
ATOM   1054  O   HIS A  78      -4.712  -1.180  -7.348  1.00  0.00           O
ATOM   1055  CB  HIS A  78      -2.627  -3.461  -8.880  1.00  0.00           C
ATOM   1056  CG  HIS A  78      -1.620  -2.384  -8.552  1.00  0.00           C
ATOM   1057  ND1 HIS A  78      -1.619  -1.146  -9.171  1.00  0.00           N
ATOM   1058  CD2 HIS A  78      -0.584  -2.372  -7.665  1.00  0.00           C
ATOM   1059  CE1 HIS A  78      -0.622  -0.430  -8.671  1.00  0.00           C
ATOM   1060  NE2 HIS A  78       0.017  -1.192  -7.739  1.00  0.00           N
ATOM      0  H   HIS A  78      -4.520  -5.020  -9.218  1.00  0.00           H   new
ATOM      0  HA  HIS A  78      -3.725  -3.442  -7.074  1.00  0.00           H   new
ATOM      0  HB2 HIS A  78      -2.193  -4.433  -8.647  1.00  0.00           H   new
ATOM      0  HB3 HIS A  78      -2.822  -3.447  -9.952  1.00  0.00           H   new
ATOM      0  HD2 HIS A  78      -0.301  -3.185  -7.013  1.00  0.00           H   new
ATOM      0  HE1 HIS A  78      -0.362   0.580  -8.953  1.00  0.00           H   new
ATOM      0  HE2 HIS A  78       0.825  -0.902  -7.188  1.00  0.00           H   new
ATOM   1067  N   SER A  79      -4.978  -1.654  -9.543  1.00  0.00           N
ATOM   1068  CA  SER A  79      -5.597  -0.377  -9.858  1.00  0.00           C
ATOM   1069  C   SER A  79      -6.737  -0.094  -8.878  1.00  0.00           C
ATOM   1070  O   SER A  79      -6.911   1.040  -8.434  1.00  0.00           O
ATOM   1071  CB  SER A  79      -6.117  -0.358 -11.297  1.00  0.00           C
ATOM   1072  OG  SER A  79      -6.067   0.949 -11.864  1.00  0.00           O
ATOM      0  H   SER A  79      -4.876  -2.286 -10.337  1.00  0.00           H   new
ATOM      0  HA  SER A  79      -4.842   0.403  -9.763  1.00  0.00           H   new
ATOM      0  HB2 SER A  79      -5.524  -1.041 -11.906  1.00  0.00           H   new
ATOM      0  HB3 SER A  79      -7.144  -0.723 -11.317  1.00  0.00           H   new
ATOM      0  HG  SER A  79      -6.405   0.920 -12.783  1.00  0.00           H   new
ATOM   1077  N   LYS A  80      -7.484  -1.143  -8.569  1.00  0.00           N
ATOM   1078  CA  LYS A  80      -8.602  -1.021  -7.650  1.00  0.00           C
ATOM   1079  C   LYS A  80      -8.075  -0.683  -6.254  1.00  0.00           C
ATOM   1080  O   LYS A  80      -8.500   0.299  -5.647  1.00  0.00           O
ATOM   1081  CB  LYS A  80      -9.470  -2.281  -7.690  1.00  0.00           C
ATOM   1082  CG  LYS A  80     -10.880  -1.993  -7.172  1.00  0.00           C
ATOM   1083  CD  LYS A  80     -11.939  -2.465  -8.172  1.00  0.00           C
ATOM   1084  CE  LYS A  80     -13.218  -2.898  -7.452  1.00  0.00           C
ATOM   1085  NZ  LYS A  80     -14.190  -1.782  -7.406  1.00  0.00           N
ATOM      0  H   LYS A  80      -7.337  -2.082  -8.939  1.00  0.00           H   new
ATOM      0  HA  LYS A  80      -9.255  -0.202  -7.953  1.00  0.00           H   new
ATOM      0  HB2 LYS A  80      -9.524  -2.657  -8.712  1.00  0.00           H   new
ATOM      0  HB3 LYS A  80      -9.010  -3.063  -7.086  1.00  0.00           H   new
ATOM      0  HG2 LYS A  80     -11.029  -2.494  -6.215  1.00  0.00           H   new
ATOM      0  HG3 LYS A  80     -10.994  -0.924  -6.993  1.00  0.00           H   new
ATOM      0  HD2 LYS A  80     -12.166  -1.662  -8.873  1.00  0.00           H   new
ATOM      0  HD3 LYS A  80     -11.547  -3.297  -8.757  1.00  0.00           H   new
ATOM      0  HE2 LYS A  80     -13.660  -3.752  -7.965  1.00  0.00           H   new
ATOM      0  HE3 LYS A  80     -12.980  -3.223  -6.439  1.00  0.00           H   new
ATOM      0  HZ1 LYS A  80     -15.052  -2.093  -6.914  1.00  0.00           H   new
ATOM      0  HZ2 LYS A  80     -13.771  -0.978  -6.896  1.00  0.00           H   new
ATOM      0  HZ3 LYS A  80     -14.430  -1.491  -8.375  1.00  0.00           H   new
ATOM   1095  N   ALA A  81      -7.157  -1.515  -5.785  1.00  0.00           N
ATOM   1096  CA  ALA A  81      -6.567  -1.317  -4.472  1.00  0.00           C
ATOM   1097  C   ALA A  81      -6.111   0.137  -4.337  1.00  0.00           C
ATOM   1098  O   ALA A  81      -6.381   0.785  -3.326  1.00  0.00           O
ATOM   1099  CB  ALA A  81      -5.420  -2.309  -4.272  1.00  0.00           C
ATOM      0  H   ALA A  81      -6.807  -2.328  -6.291  1.00  0.00           H   new
ATOM      0  HA  ALA A  81      -7.301  -1.506  -3.689  1.00  0.00           H   new
ATOM      0  HB1 ALA A  81      -4.978  -2.160  -3.287  1.00  0.00           H   new
ATOM      0  HB2 ALA A  81      -5.802  -3.327  -4.348  1.00  0.00           H   new
ATOM      0  HB3 ALA A  81      -4.662  -2.148  -5.038  1.00  0.00           H   new
ATOM   1105  N   VAL A  82      -5.428   0.608  -5.370  1.00  0.00           N
ATOM   1106  CA  VAL A  82      -4.932   1.974  -5.379  1.00  0.00           C
ATOM   1107  C   VAL A  82      -6.115   2.941  -5.320  1.00  0.00           C
ATOM   1108  O   VAL A  82      -6.251   3.702  -4.363  1.00  0.00           O
ATOM   1109  CB  VAL A  82      -4.037   2.197  -6.601  1.00  0.00           C
ATOM   1110  CG1 VAL A  82      -3.684   3.677  -6.758  1.00  0.00           C
ATOM   1111  CG2 VAL A  82      -2.774   1.337  -6.520  1.00  0.00           C
ATOM      0  H   VAL A  82      -5.206   0.068  -6.207  1.00  0.00           H   new
ATOM      0  HA  VAL A  82      -4.314   2.163  -4.501  1.00  0.00           H   new
ATOM      0  HB  VAL A  82      -4.595   1.890  -7.486  1.00  0.00           H   new
ATOM      0 HG11 VAL A  82      -3.048   3.808  -7.633  1.00  0.00           H   new
ATOM      0 HG12 VAL A  82      -4.598   4.258  -6.883  1.00  0.00           H   new
ATOM      0 HG13 VAL A  82      -3.155   4.021  -5.869  1.00  0.00           H   new
ATOM      0 HG21 VAL A  82      -2.156   1.514  -7.400  1.00  0.00           H   new
ATOM      0 HG22 VAL A  82      -2.212   1.599  -5.623  1.00  0.00           H   new
ATOM      0 HG23 VAL A  82      -3.053   0.284  -6.479  1.00  0.00           H   new
ATOM   1121  N   GLU A  83      -6.940   2.882  -6.355  1.00  0.00           N
ATOM   1122  CA  GLU A  83      -8.106   3.745  -6.432  1.00  0.00           C
ATOM   1123  C   GLU A  83      -8.886   3.703  -5.117  1.00  0.00           C
ATOM   1124  O   GLU A  83      -9.156   4.742  -4.517  1.00  0.00           O
ATOM   1125  CB  GLU A  83      -9.000   3.354  -7.612  1.00  0.00           C
ATOM   1126  CG  GLU A  83      -9.033   4.462  -8.666  1.00  0.00           C
ATOM   1127  CD  GLU A  83      -9.776   5.693  -8.143  1.00  0.00           C
ATOM   1128  OE1 GLU A  83      -9.192   6.385  -7.281  1.00  0.00           O
ATOM   1129  OE2 GLU A  83     -10.911   5.915  -8.618  1.00  0.00           O
ATOM      0  H   GLU A  83      -6.824   2.250  -7.147  1.00  0.00           H   new
ATOM      0  HA  GLU A  83      -7.767   4.767  -6.598  1.00  0.00           H   new
ATOM      0  HB2 GLU A  83      -8.633   2.431  -8.061  1.00  0.00           H   new
ATOM      0  HB3 GLU A  83     -10.011   3.155  -7.257  1.00  0.00           H   new
ATOM      0  HG2 GLU A  83      -8.015   4.737  -8.942  1.00  0.00           H   new
ATOM      0  HG3 GLU A  83      -9.520   4.095  -9.570  1.00  0.00           H   new
ATOM   1134  N   ILE A  84      -9.226   2.489  -4.706  1.00  0.00           N
ATOM   1135  CA  ILE A  84      -9.969   2.298  -3.472  1.00  0.00           C
ATOM   1136  C   ILE A  84      -9.432   3.255  -2.405  1.00  0.00           C
ATOM   1137  O   ILE A  84     -10.170   4.092  -1.889  1.00  0.00           O
ATOM   1138  CB  ILE A  84      -9.940   0.828  -3.051  1.00  0.00           C
ATOM   1139  CG1 ILE A  84     -10.793  -0.028  -3.989  1.00  0.00           C
ATOM   1140  CG2 ILE A  84     -10.359   0.668  -1.588  1.00  0.00           C
ATOM   1141  CD1 ILE A  84     -10.326  -1.485  -3.979  1.00  0.00           C
ATOM      0  H   ILE A  84      -9.000   1.629  -5.206  1.00  0.00           H   new
ATOM      0  HA  ILE A  84     -11.021   2.542  -3.619  1.00  0.00           H   new
ATOM      0  HB  ILE A  84      -8.914   0.470  -3.133  1.00  0.00           H   new
ATOM      0 HG12 ILE A  84     -11.838   0.025  -3.685  1.00  0.00           H   new
ATOM      0 HG13 ILE A  84     -10.735   0.369  -5.002  1.00  0.00           H   new
ATOM      0 HG21 ILE A  84     -10.330  -0.387  -1.314  1.00  0.00           H   new
ATOM      0 HG22 ILE A  84      -9.675   1.227  -0.950  1.00  0.00           H   new
ATOM      0 HG23 ILE A  84     -11.372   1.049  -1.456  1.00  0.00           H   new
ATOM      0 HD11 ILE A  84     -10.949  -2.071  -4.654  1.00  0.00           H   new
ATOM      0 HD12 ILE A  84      -9.288  -1.537  -4.307  1.00  0.00           H   new
ATOM      0 HD13 ILE A  84     -10.408  -1.886  -2.969  1.00  0.00           H   new
ATOM   1152  N   LEU A  85      -8.151   3.097  -2.106  1.00  0.00           N
ATOM   1153  CA  LEU A  85      -7.507   3.936  -1.110  1.00  0.00           C
ATOM   1154  C   LEU A  85      -7.894   5.396  -1.351  1.00  0.00           C
ATOM   1155  O   LEU A  85      -8.576   6.004  -0.529  1.00  0.00           O
ATOM   1156  CB  LEU A  85      -5.996   3.694  -1.102  1.00  0.00           C
ATOM   1157  CG  LEU A  85      -5.532   2.373  -0.482  1.00  0.00           C
ATOM   1158  CD1 LEU A  85      -4.071   2.087  -0.834  1.00  0.00           C
ATOM   1159  CD2 LEU A  85      -5.771   2.362   1.029  1.00  0.00           C
ATOM      0  H   LEU A  85      -7.542   2.401  -2.536  1.00  0.00           H   new
ATOM      0  HA  LEU A  85      -7.854   3.675  -0.110  1.00  0.00           H   new
ATOM      0  HB2 LEU A  85      -5.636   3.737  -2.130  1.00  0.00           H   new
ATOM      0  HB3 LEU A  85      -5.520   4.513  -0.563  1.00  0.00           H   new
ATOM      0  HG  LEU A  85      -6.130   1.567  -0.907  1.00  0.00           H   new
ATOM      0 HD11 LEU A  85      -3.766   1.143  -0.382  1.00  0.00           H   new
ATOM      0 HD12 LEU A  85      -3.964   2.022  -1.917  1.00  0.00           H   new
ATOM      0 HD13 LEU A  85      -3.441   2.892  -0.455  1.00  0.00           H   new
ATOM      0 HD21 LEU A  85      -5.433   1.413   1.444  1.00  0.00           H   new
ATOM      0 HD22 LEU A  85      -5.216   3.178   1.491  1.00  0.00           H   new
ATOM      0 HD23 LEU A  85      -6.835   2.487   1.230  1.00  0.00           H   new
ATOM   1170  N   LYS A  86      -7.440   5.915  -2.483  1.00  0.00           N
ATOM   1171  CA  LYS A  86      -7.730   7.294  -2.842  1.00  0.00           C
ATOM   1172  C   LYS A  86      -9.199   7.596  -2.537  1.00  0.00           C
ATOM   1173  O   LYS A  86      -9.503   8.334  -1.601  1.00  0.00           O
ATOM   1174  CB  LYS A  86      -7.336   7.561  -4.296  1.00  0.00           C
ATOM   1175  CG  LYS A  86      -5.888   8.043  -4.391  1.00  0.00           C
ATOM   1176  CD  LYS A  86      -4.955   6.900  -4.798  1.00  0.00           C
ATOM   1177  CE  LYS A  86      -4.473   7.072  -6.240  1.00  0.00           C
ATOM   1178  NZ  LYS A  86      -3.602   8.263  -6.357  1.00  0.00           N
ATOM      0  H   LYS A  86      -6.874   5.407  -3.163  1.00  0.00           H   new
ATOM      0  HA  LYS A  86      -7.132   7.980  -2.242  1.00  0.00           H   new
ATOM      0  HB2 LYS A  86      -7.459   6.651  -4.883  1.00  0.00           H   new
ATOM      0  HB3 LYS A  86      -8.001   8.310  -4.725  1.00  0.00           H   new
ATOM      0  HG2 LYS A  86      -5.817   8.852  -5.118  1.00  0.00           H   new
ATOM      0  HG3 LYS A  86      -5.573   8.450  -3.430  1.00  0.00           H   new
ATOM      0  HD2 LYS A  86      -4.098   6.869  -4.126  1.00  0.00           H   new
ATOM      0  HD3 LYS A  86      -5.475   5.948  -4.696  1.00  0.00           H   new
ATOM      0  HE2 LYS A  86      -3.927   6.183  -6.556  1.00  0.00           H   new
ATOM      0  HE3 LYS A  86      -5.330   7.174  -6.906  1.00  0.00           H   new
ATOM      0  HZ1 LYS A  86      -2.940   8.133  -7.148  1.00  0.00           H   new
ATOM      0  HZ2 LYS A  86      -4.187   9.105  -6.530  1.00  0.00           H   new
ATOM      0  HZ3 LYS A  86      -3.066   8.389  -5.475  1.00  0.00           H   new
ATOM   1188  N   THR A  87     -10.071   7.013  -3.346  1.00  0.00           N
ATOM   1189  CA  THR A  87     -11.499   7.212  -3.174  1.00  0.00           C
ATOM   1190  C   THR A  87     -11.868   7.184  -1.689  1.00  0.00           C
ATOM   1191  O   THR A  87     -12.578   8.064  -1.206  1.00  0.00           O
ATOM   1192  CB  THR A  87     -12.227   6.149  -4.000  1.00  0.00           C
ATOM   1193  OG1 THR A  87     -11.782   4.914  -3.447  1.00  0.00           O
ATOM   1194  CG2 THR A  87     -11.746   6.104  -5.452  1.00  0.00           C
ATOM      0  H   THR A  87      -9.816   6.403  -4.122  1.00  0.00           H   new
ATOM      0  HA  THR A  87     -11.807   8.193  -3.534  1.00  0.00           H   new
ATOM      0  HB  THR A  87     -13.299   6.345  -3.980  1.00  0.00           H   new
ATOM      0  HG1 THR A  87     -10.806   4.929  -3.355  1.00  0.00           H   new
ATOM      0 HG21 THR A  87     -12.295   5.333  -5.993  1.00  0.00           H   new
ATOM      0 HG22 THR A  87     -11.920   7.072  -5.923  1.00  0.00           H   new
ATOM      0 HG23 THR A  87     -10.681   5.875  -5.475  1.00  0.00           H   new
ATOM   1202  N   ALA A  88     -11.367   6.165  -1.008  1.00  0.00           N
ATOM   1203  CA  ALA A  88     -11.633   6.012   0.413  1.00  0.00           C
ATOM   1204  C   ALA A  88     -11.120   7.244   1.160  1.00  0.00           C
ATOM   1205  O   ALA A  88      -9.915   7.396   1.360  1.00  0.00           O
ATOM   1206  CB  ALA A  88     -10.994   4.716   0.915  1.00  0.00           C
ATOM      0  H   ALA A  88     -10.778   5.437  -1.413  1.00  0.00           H   new
ATOM      0  HA  ALA A  88     -12.705   5.939   0.597  1.00  0.00           H   new
ATOM      0  HB1 ALA A  88     -11.193   4.601   1.980  1.00  0.00           H   new
ATOM      0  HB2 ALA A  88     -11.415   3.869   0.374  1.00  0.00           H   new
ATOM      0  HB3 ALA A  88      -9.917   4.753   0.749  1.00  0.00           H   new
ATOM   1212  N   ARG A  89     -12.058   8.093   1.552  1.00  0.00           N
ATOM   1213  CA  ARG A  89     -11.714   9.308   2.273  1.00  0.00           C
ATOM   1214  C   ARG A  89     -10.681   9.005   3.359  1.00  0.00           C
ATOM   1215  O   ARG A  89      -9.670   9.697   3.469  1.00  0.00           O
ATOM   1216  CB  ARG A  89     -12.953   9.934   2.916  1.00  0.00           C
ATOM   1217  CG  ARG A  89     -13.757   8.888   3.691  1.00  0.00           C
ATOM   1218  CD  ARG A  89     -15.259   9.162   3.582  1.00  0.00           C
ATOM   1219  NE  ARG A  89     -15.820   9.447   4.922  1.00  0.00           N
ATOM   1220  CZ  ARG A  89     -17.127   9.409   5.212  1.00  0.00           C
ATOM   1221  NH1 ARG A  89     -18.017   9.097   4.260  1.00  0.00           N
ATOM   1222  NH2 ARG A  89     -17.546   9.682   6.456  1.00  0.00           N
ATOM      0  H   ARG A  89     -13.056   7.964   1.384  1.00  0.00           H   new
ATOM      0  HA  ARG A  89     -11.295  10.014   1.556  1.00  0.00           H   new
ATOM      0  HB2 ARG A  89     -12.652  10.737   3.588  1.00  0.00           H   new
ATOM      0  HB3 ARG A  89     -13.580  10.382   2.145  1.00  0.00           H   new
ATOM      0  HG2 ARG A  89     -13.536   7.893   3.304  1.00  0.00           H   new
ATOM      0  HG3 ARG A  89     -13.457   8.896   4.739  1.00  0.00           H   new
ATOM      0  HD2 ARG A  89     -15.435  10.008   2.917  1.00  0.00           H   new
ATOM      0  HD3 ARG A  89     -15.763   8.301   3.143  1.00  0.00           H   new
ATOM      0  HE  ARG A  89     -15.171   9.687   5.671  1.00  0.00           H   new
ATOM      0 HH11 ARG A  89     -17.699   8.888   3.314  1.00  0.00           H   new
ATOM      0 HH12 ARG A  89     -19.012   9.068   4.482  1.00  0.00           H   new
ATOM      0 HH21 ARG A  89     -16.869   9.919   7.182  1.00  0.00           H   new
ATOM      0 HH22 ARG A  89     -18.541   9.653   6.677  1.00  0.00           H   new
ATOM   1233  N   GLU A  90     -10.970   7.970   4.135  1.00  0.00           N
ATOM   1234  CA  GLU A  90     -10.078   7.569   5.209  1.00  0.00           C
ATOM   1235  C   GLU A  90      -9.591   6.135   4.986  1.00  0.00           C
ATOM   1236  O   GLU A  90     -10.394   5.231   4.761  1.00  0.00           O
ATOM   1237  CB  GLU A  90     -10.761   7.711   6.571  1.00  0.00           C
ATOM   1238  CG  GLU A  90     -11.736   6.558   6.818  1.00  0.00           C
ATOM   1239  CD  GLU A  90     -12.588   6.818   8.062  1.00  0.00           C
ATOM   1240  OE1 GLU A  90     -13.121   7.944   8.159  1.00  0.00           O
ATOM   1241  OE2 GLU A  90     -12.688   5.884   8.886  1.00  0.00           O
ATOM      0  H   GLU A  90     -11.809   7.398   4.041  1.00  0.00           H   new
ATOM      0  HA  GLU A  90      -9.212   8.231   5.203  1.00  0.00           H   new
ATOM      0  HB2 GLU A  90     -10.008   7.731   7.359  1.00  0.00           H   new
ATOM      0  HB3 GLU A  90     -11.295   8.660   6.617  1.00  0.00           H   new
ATOM      0  HG2 GLU A  90     -12.383   6.431   5.950  1.00  0.00           H   new
ATOM      0  HG3 GLU A  90     -11.181   5.628   6.941  1.00  0.00           H   new
ATOM   1246  N   ILE A  91      -8.278   5.972   5.057  1.00  0.00           N
ATOM   1247  CA  ILE A  91      -7.675   4.665   4.866  1.00  0.00           C
ATOM   1248  C   ILE A  91      -7.719   3.890   6.185  1.00  0.00           C
ATOM   1249  O   ILE A  91      -7.223   4.365   7.205  1.00  0.00           O
ATOM   1250  CB  ILE A  91      -6.268   4.803   4.281  1.00  0.00           C
ATOM   1251  CG1 ILE A  91      -6.319   5.372   2.861  1.00  0.00           C
ATOM   1252  CG2 ILE A  91      -5.516   3.471   4.338  1.00  0.00           C
ATOM   1253  CD1 ILE A  91      -5.059   6.184   2.552  1.00  0.00           C
ATOM      0  H   ILE A  91      -7.615   6.724   5.244  1.00  0.00           H   new
ATOM      0  HA  ILE A  91      -8.243   4.087   4.137  1.00  0.00           H   new
ATOM      0  HB  ILE A  91      -5.712   5.512   4.893  1.00  0.00           H   new
ATOM      0 HG12 ILE A  91      -6.417   4.558   2.142  1.00  0.00           H   new
ATOM      0 HG13 ILE A  91      -7.200   6.004   2.750  1.00  0.00           H   new
ATOM      0 HG21 ILE A  91      -4.519   3.598   3.916  1.00  0.00           H   new
ATOM      0 HG22 ILE A  91      -5.432   3.144   5.375  1.00  0.00           H   new
ATOM      0 HG23 ILE A  91      -6.060   2.721   3.764  1.00  0.00           H   new
ATOM      0 HD11 ILE A  91      -5.119   6.578   1.537  1.00  0.00           H   new
ATOM      0 HD12 ILE A  91      -4.977   7.011   3.258  1.00  0.00           H   new
ATOM      0 HD13 ILE A  91      -4.182   5.543   2.641  1.00  0.00           H   new
ATOM   1264  N   SER A  92      -8.317   2.709   6.121  1.00  0.00           N
ATOM   1265  CA  SER A  92      -8.431   1.865   7.298  1.00  0.00           C
ATOM   1266  C   SER A  92      -8.379   0.390   6.891  1.00  0.00           C
ATOM   1267  O   SER A  92      -9.398  -0.297   6.902  1.00  0.00           O
ATOM   1268  CB  SER A  92      -9.724   2.157   8.063  1.00  0.00           C
ATOM   1269  OG  SER A  92      -9.486   2.364   9.453  1.00  0.00           O
ATOM      0  H   SER A  92      -8.727   2.317   5.273  1.00  0.00           H   new
ATOM      0  HA  SER A  92      -7.592   2.085   7.958  1.00  0.00           H   new
ATOM      0  HB2 SER A  92     -10.203   3.041   7.642  1.00  0.00           H   new
ATOM      0  HB3 SER A  92     -10.418   1.326   7.934  1.00  0.00           H   new
ATOM      0  HG  SER A  92     -10.335   2.549   9.906  1.00  0.00           H   new
ATOM   1274  N   MET A  93      -7.180  -0.051   6.542  1.00  0.00           N
ATOM   1275  CA  MET A  93      -6.981  -1.431   6.131  1.00  0.00           C
ATOM   1276  C   MET A  93      -6.413  -2.268   7.280  1.00  0.00           C
ATOM   1277  O   MET A  93      -5.877  -1.724   8.244  1.00  0.00           O
ATOM   1278  CB  MET A  93      -6.018  -1.477   4.942  1.00  0.00           C
ATOM   1279  CG  MET A  93      -4.702  -0.770   5.275  1.00  0.00           C
ATOM   1280  SD  MET A  93      -3.326  -1.711   4.640  1.00  0.00           S
ATOM   1281  CE  MET A  93      -2.839  -0.668   3.275  1.00  0.00           C
ATOM      0  H   MET A  93      -6.336   0.522   6.535  1.00  0.00           H   new
ATOM      0  HA  MET A  93      -7.946  -1.848   5.844  1.00  0.00           H   new
ATOM      0  HB2 MET A  93      -5.819  -2.514   4.670  1.00  0.00           H   new
ATOM      0  HB3 MET A  93      -6.481  -1.003   4.076  1.00  0.00           H   new
ATOM      0  HG2 MET A  93      -4.698   0.231   4.844  1.00  0.00           H   new
ATOM      0  HG3 MET A  93      -4.606  -0.653   6.354  1.00  0.00           H   new
ATOM      0  HE1 MET A  93      -1.942  -1.075   2.808  1.00  0.00           H   new
ATOM      0  HE2 MET A  93      -3.644  -0.630   2.541  1.00  0.00           H   new
ATOM      0  HE3 MET A  93      -2.633   0.338   3.641  1.00  0.00           H   new
ATOM   1289  N   ARG A  94      -6.552  -3.578   7.140  1.00  0.00           N
ATOM   1290  CA  ARG A  94      -6.060  -4.496   8.153  1.00  0.00           C
ATOM   1291  C   ARG A  94      -4.816  -5.228   7.648  1.00  0.00           C
ATOM   1292  O   ARG A  94      -4.893  -6.015   6.706  1.00  0.00           O
ATOM   1293  CB  ARG A  94      -7.130  -5.523   8.531  1.00  0.00           C
ATOM   1294  CG  ARG A  94      -7.321  -5.582  10.049  1.00  0.00           C
ATOM   1295  CD  ARG A  94      -8.607  -6.327  10.411  1.00  0.00           C
ATOM   1296  NE  ARG A  94      -8.292  -7.715  10.817  1.00  0.00           N
ATOM   1297  CZ  ARG A  94      -9.201  -8.595  11.257  1.00  0.00           C
ATOM   1298  NH1 ARG A  94     -10.488  -8.235  11.352  1.00  0.00           N
ATOM   1299  NH2 ARG A  94      -8.824  -9.832  11.603  1.00  0.00           N
ATOM      0  H   ARG A  94      -6.999  -4.026   6.340  1.00  0.00           H   new
ATOM      0  HA  ARG A  94      -5.806  -3.910   9.036  1.00  0.00           H   new
ATOM      0  HB2 ARG A  94      -8.074  -5.263   8.052  1.00  0.00           H   new
ATOM      0  HB3 ARG A  94      -6.843  -6.506   8.158  1.00  0.00           H   new
ATOM      0  HG2 ARG A  94      -6.467  -6.080  10.508  1.00  0.00           H   new
ATOM      0  HG3 ARG A  94      -7.356  -4.571  10.454  1.00  0.00           H   new
ATOM      0  HD2 ARG A  94      -9.120  -5.810  11.222  1.00  0.00           H   new
ATOM      0  HD3 ARG A  94      -9.285  -6.334   9.558  1.00  0.00           H   new
ATOM      0  HE  ARG A  94      -7.321  -8.021  10.758  1.00  0.00           H   new
ATOM      0 HH11 ARG A  94     -10.774  -7.292  11.089  1.00  0.00           H   new
ATOM      0 HH12 ARG A  94     -11.181  -8.904  11.687  1.00  0.00           H   new
ATOM      0 HH21 ARG A  94      -7.844 -10.105  11.532  1.00  0.00           H   new
ATOM      0 HH22 ARG A  94      -9.517 -10.501  11.938  1.00  0.00           H   new
ATOM   1310  N   VAL A  95      -3.696  -4.943   8.297  1.00  0.00           N
ATOM   1311  CA  VAL A  95      -2.436  -5.565   7.926  1.00  0.00           C
ATOM   1312  C   VAL A  95      -1.987  -6.507   9.044  1.00  0.00           C
ATOM   1313  O   VAL A  95      -2.517  -6.455  10.153  1.00  0.00           O
ATOM   1314  CB  VAL A  95      -1.399  -4.489   7.597  1.00  0.00           C
ATOM   1315  CG1 VAL A  95      -1.871  -3.607   6.440  1.00  0.00           C
ATOM   1316  CG2 VAL A  95      -1.074  -3.646   8.832  1.00  0.00           C
ATOM      0  H   VAL A  95      -3.635  -4.289   9.078  1.00  0.00           H   new
ATOM      0  HA  VAL A  95      -2.558  -6.167   7.025  1.00  0.00           H   new
ATOM      0  HB  VAL A  95      -0.484  -4.991   7.283  1.00  0.00           H   new
ATOM      0 HG11 VAL A  95      -1.115  -2.851   6.227  1.00  0.00           H   new
ATOM      0 HG12 VAL A  95      -2.028  -4.222   5.554  1.00  0.00           H   new
ATOM      0 HG13 VAL A  95      -2.806  -3.118   6.713  1.00  0.00           H   new
ATOM      0 HG21 VAL A  95      -0.335  -2.889   8.571  1.00  0.00           H   new
ATOM      0 HG22 VAL A  95      -1.981  -3.159   9.189  1.00  0.00           H   new
ATOM      0 HG23 VAL A  95      -0.674  -4.289   9.616  1.00  0.00           H   new
ATOM   1326  N   ARG A  96      -1.016  -7.345   8.714  1.00  0.00           N
ATOM   1327  CA  ARG A  96      -0.490  -8.297   9.678  1.00  0.00           C
ATOM   1328  C   ARG A  96       0.942  -8.689   9.309  1.00  0.00           C
ATOM   1329  O   ARG A  96       1.213  -9.063   8.169  1.00  0.00           O
ATOM   1330  CB  ARG A  96      -1.358  -9.556   9.738  1.00  0.00           C
ATOM   1331  CG  ARG A  96      -0.824 -10.540  10.780  1.00  0.00           C
ATOM   1332  CD  ARG A  96      -1.561 -11.878  10.699  1.00  0.00           C
ATOM   1333  NE  ARG A  96      -0.587 -12.993  10.680  1.00  0.00           N
ATOM   1334  CZ  ARG A  96      -0.898 -14.256  10.361  1.00  0.00           C
ATOM   1335  NH1 ARG A  96      -2.158 -14.574  10.034  1.00  0.00           N
ATOM   1336  NH2 ARG A  96       0.051 -15.203  10.370  1.00  0.00           N
ATOM      0  H   ARG A  96      -0.580  -7.385   7.793  1.00  0.00           H   new
ATOM      0  HA  ARG A  96      -0.498  -7.818  10.657  1.00  0.00           H   new
ATOM      0  HB2 ARG A  96      -2.385  -9.283   9.983  1.00  0.00           H   new
ATOM      0  HB3 ARG A  96      -1.380 -10.034   8.759  1.00  0.00           H   new
ATOM      0  HG2 ARG A  96       0.243 -10.698  10.623  1.00  0.00           H   new
ATOM      0  HG3 ARG A  96      -0.940 -10.117  11.778  1.00  0.00           H   new
ATOM      0  HD2 ARG A  96      -2.232 -11.985  11.551  1.00  0.00           H   new
ATOM      0  HD3 ARG A  96      -2.179 -11.909   9.801  1.00  0.00           H   new
ATOM      0  HE  ARG A  96       0.381 -12.786  10.925  1.00  0.00           H   new
ATOM      0 HH11 ARG A  96      -2.881 -13.854  10.028  1.00  0.00           H   new
ATOM      0 HH12 ARG A  96      -2.395 -15.536   9.791  1.00  0.00           H   new
ATOM      0 HH21 ARG A  96       1.010 -14.962  10.620  1.00  0.00           H   new
ATOM      0 HH22 ARG A  96      -0.186 -16.165  10.127  1.00  0.00           H   new
ATOM   1347  N   PHE A  97       1.821  -8.592  10.295  1.00  0.00           N
ATOM   1348  CA  PHE A  97       3.219  -8.932  10.087  1.00  0.00           C
ATOM   1349  C   PHE A  97       3.356 -10.151   9.172  1.00  0.00           C
ATOM   1350  O   PHE A  97       2.861 -11.230   9.491  1.00  0.00           O
ATOM   1351  CB  PHE A  97       3.804  -9.271  11.460  1.00  0.00           C
ATOM   1352  CG  PHE A  97       3.458 -10.676  11.954  1.00  0.00           C
ATOM   1353  CD1 PHE A  97       2.174 -10.984  12.282  1.00  0.00           C
ATOM   1354  CD2 PHE A  97       4.432 -11.618  12.067  1.00  0.00           C
ATOM   1355  CE1 PHE A  97       1.853 -12.289  12.742  1.00  0.00           C
ATOM   1356  CE2 PHE A  97       4.111 -12.922  12.526  1.00  0.00           C
ATOM   1357  CZ  PHE A  97       2.828 -13.231  12.854  1.00  0.00           C
ATOM      0  H   PHE A  97       1.593  -8.283  11.240  1.00  0.00           H   new
ATOM      0  HA  PHE A  97       3.740  -8.098   9.617  1.00  0.00           H   new
ATOM      0  HB2 PHE A  97       4.888  -9.169  11.417  1.00  0.00           H   new
ATOM      0  HB3 PHE A  97       3.444  -8.543  12.187  1.00  0.00           H   new
ATOM      0  HD1 PHE A  97       1.399 -10.237  12.193  1.00  0.00           H   new
ATOM      0  HD2 PHE A  97       5.451 -11.374  11.807  1.00  0.00           H   new
ATOM      0  HE1 PHE A  97       0.834 -12.534  13.003  1.00  0.00           H   new
ATOM      0  HE2 PHE A  97       4.886 -13.669  12.615  1.00  0.00           H   new
ATOM      0  HZ  PHE A  97       2.583 -14.223  13.203  1.00  0.00           H   new