USER  MOD reduce.3.24.130724 H: found=0, std=0, add=199, rem=0, adj=6
USER  MOD reduce.3.24.130724 removed 194 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 459 CYS SG  :   rot -176:sc=  -0.167
USER  MOD Set 1.2: A 462 CYS SG  :   rot  -38:sc=   0.505
USER  MOD Set 1.3: A 475 HIS     :     no HD1:sc=  -0.454  K(o=-0.12,f=-4.6!)
USER  MOD Single : A 457 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A 458 LYS NZ  :NH3+    140:sc=   0.242   (180deg=0)
USER  MOD Single : A 460 HIS     :     no HD1:sc=       0  X(o=0,f=-0.031)
USER  MOD Single : A 464 LYS NZ  :NH3+   -152:sc=  -0.188   (180deg=-0.787)
USER  MOD Single : A 469 ASN     :      amide:sc=    0.46  K(o=0.46,f=-2.6!)
USER  MOD Single : A 470 SER OG  :   rot  170:sc=  -0.743
USER  MOD Single : A 471 HIS     :     no HD1:sc=   -1.21  K(o=-1.2,f=-2)
USER  MOD Single : A 476 GLN     :      amide:sc=       0  K(o=0,f=-0.62)
USER  MOD -----------------------------------------------------------------
ATOM    124  N   PRO A 456     -13.147  -5.048  -3.583  1.00  0.00           N
ATOM    125  CA  PRO A 456     -12.525  -4.031  -2.730  1.00  0.00           C
ATOM    126  C   PRO A 456     -11.004  -4.143  -2.710  1.00  0.00           C
ATOM    127  O   PRO A 456     -10.454  -5.178  -2.335  1.00  0.00           O
ATOM    128  CB  PRO A 456     -13.102  -4.329  -1.344  1.00  0.00           C
ATOM    129  CG  PRO A 456     -13.459  -5.775  -1.386  1.00  0.00           C
ATOM    130  CD  PRO A 456     -13.881  -6.057  -2.801  1.00  0.00           C
ATOM      0  HA  PRO A 456     -12.731  -3.021  -3.084  1.00  0.00           H   new
ATOM      0  HB2 PRO A 456     -12.374  -4.123  -0.559  1.00  0.00           H   new
ATOM      0  HB3 PRO A 456     -13.976  -3.711  -1.138  1.00  0.00           H   new
ATOM      0  HG2 PRO A 456     -12.609  -6.395  -1.101  1.00  0.00           H   new
ATOM      0  HG3 PRO A 456     -14.265  -5.998  -0.687  1.00  0.00           H   new
ATOM      0  HD2 PRO A 456     -13.618  -7.070  -3.105  1.00  0.00           H   new
ATOM      0  HD3 PRO A 456     -14.959  -5.957  -2.926  1.00  0.00           H   new
ATOM    138  N   TYR A 457     -10.332  -3.071  -3.115  1.00  0.00           N
ATOM    139  CA  TYR A 457      -8.874  -3.050  -3.144  1.00  0.00           C
ATOM    140  C   TYR A 457      -8.307  -2.661  -1.783  1.00  0.00           C
ATOM    141  O   TYR A 457      -8.857  -1.806  -1.088  1.00  0.00           O
ATOM    142  CB  TYR A 457      -8.379  -2.075  -4.213  1.00  0.00           C
ATOM    143  CG  TYR A 457      -8.815  -2.440  -5.615  1.00  0.00           C
ATOM    144  CD1 TYR A 457     -10.121  -2.221  -6.036  1.00  0.00           C
ATOM    145  CD2 TYR A 457      -7.921  -3.003  -6.517  1.00  0.00           C
ATOM    146  CE1 TYR A 457     -10.524  -2.554  -7.315  1.00  0.00           C
ATOM    147  CE2 TYR A 457      -8.315  -3.337  -7.798  1.00  0.00           C
ATOM    148  CZ  TYR A 457      -9.617  -3.111  -8.192  1.00  0.00           C
ATOM    149  OH  TYR A 457     -10.014  -3.444  -9.467  1.00  0.00           O
ATOM      0  H   TYR A 457     -10.773  -2.206  -3.427  1.00  0.00           H   new
ATOM      0  HA  TYR A 457      -8.526  -4.054  -3.388  1.00  0.00           H   new
ATOM      0  HB2 TYR A 457      -8.743  -1.075  -3.977  1.00  0.00           H   new
ATOM      0  HB3 TYR A 457      -7.290  -2.034  -4.179  1.00  0.00           H   new
ATOM      0  HD1 TYR A 457     -10.833  -1.783  -5.352  1.00  0.00           H   new
ATOM      0  HD2 TYR A 457      -6.901  -3.183  -6.211  1.00  0.00           H   new
ATOM      0  HE1 TYR A 457     -11.543  -2.379  -7.626  1.00  0.00           H   new
ATOM      0  HE2 TYR A 457      -7.607  -3.773  -8.487  1.00  0.00           H   new
ATOM      0  HH  TYR A 457      -9.255  -3.824  -9.957  1.00  0.00           H   new
ATOM    159  N   LYS A 458      -7.201  -3.295  -1.407  1.00  0.00           N
ATOM    160  CA  LYS A 458      -6.555  -3.016  -0.130  1.00  0.00           C
ATOM    161  C   LYS A 458      -5.119  -2.545  -0.338  1.00  0.00           C
ATOM    162  O   LYS A 458      -4.353  -3.166  -1.075  1.00  0.00           O
ATOM    163  CB  LYS A 458      -6.571  -4.263   0.757  1.00  0.00           C
ATOM    164  CG  LYS A 458      -5.834  -4.083   2.072  1.00  0.00           C
ATOM    165  CD  LYS A 458      -5.683  -5.402   2.812  1.00  0.00           C
ATOM    166  CE  LYS A 458      -4.987  -5.215   4.151  1.00  0.00           C
ATOM    167  NZ  LYS A 458      -5.920  -4.705   5.194  1.00  0.00           N
ATOM      0  H   LYS A 458      -6.733  -4.006  -1.969  1.00  0.00           H   new
ATOM      0  HA  LYS A 458      -7.112  -2.220   0.364  1.00  0.00           H   new
ATOM      0  HB2 LYS A 458      -7.605  -4.538   0.964  1.00  0.00           H   new
ATOM      0  HB3 LYS A 458      -6.124  -5.093   0.210  1.00  0.00           H   new
ATOM      0  HG2 LYS A 458      -4.849  -3.656   1.883  1.00  0.00           H   new
ATOM      0  HG3 LYS A 458      -6.374  -3.373   2.699  1.00  0.00           H   new
ATOM      0  HD2 LYS A 458      -6.666  -5.846   2.971  1.00  0.00           H   new
ATOM      0  HD3 LYS A 458      -5.113  -6.101   2.199  1.00  0.00           H   new
ATOM      0  HE2 LYS A 458      -4.563  -6.165   4.476  1.00  0.00           H   new
ATOM      0  HE3 LYS A 458      -4.156  -4.519   4.035  1.00  0.00           H   new
ATOM      0  HZ1 LYS A 458      -5.725  -5.182   6.097  1.00  0.00           H   new
ATOM      0  HZ2 LYS A 458      -5.787  -3.680   5.308  1.00  0.00           H   new
ATOM      0  HZ3 LYS A 458      -6.901  -4.897   4.906  1.00  0.00           H   new
ATOM    181  N   CYS A 459      -4.760  -1.447   0.318  1.00  0.00           N
ATOM    182  CA  CYS A 459      -3.416  -0.894   0.206  1.00  0.00           C
ATOM    183  C   CYS A 459      -2.400  -1.788   0.911  1.00  0.00           C
ATOM    184  O   CYS A 459      -2.494  -2.023   2.116  1.00  0.00           O
ATOM    185  CB  CYS A 459      -3.370   0.515   0.800  1.00  0.00           C
ATOM    186  SG  CYS A 459      -1.964   1.520   0.225  1.00  0.00           S
ATOM      0  H   CYS A 459      -5.382  -0.922   0.933  1.00  0.00           H   new
ATOM      0  HA  CYS A 459      -3.158  -0.844  -0.852  1.00  0.00           H   new
ATOM      0  HB2 CYS A 459      -4.297   1.032   0.553  1.00  0.00           H   new
ATOM      0  HB3 CYS A 459      -3.327   0.438   1.886  1.00  0.00           H   new
ATOM      0  HG  CYS A 459      -1.965   2.663   0.845  1.00  0.00           H   new
ATOM    191  N   HIS A 460      -1.428  -2.283   0.151  1.00  0.00           N
ATOM    192  CA  HIS A 460      -0.393  -3.150   0.702  1.00  0.00           C
ATOM    193  C   HIS A 460       0.746  -2.327   1.297  1.00  0.00           C
ATOM    194  O   HIS A 460       1.716  -2.878   1.816  1.00  0.00           O
ATOM    195  CB  HIS A 460       0.148  -4.085  -0.379  1.00  0.00           C
ATOM    196  CG  HIS A 460      -0.878  -5.032  -0.921  1.00  0.00           C
ATOM    197  ND1 HIS A 460      -1.684  -5.809  -0.116  1.00  0.00           N
ATOM    198  CD2 HIS A 460      -1.228  -5.324  -2.196  1.00  0.00           C
ATOM    199  CE1 HIS A 460      -2.485  -6.539  -0.872  1.00  0.00           C
ATOM    200  NE2 HIS A 460      -2.228  -6.263  -2.138  1.00  0.00           N
ATOM      0  H   HIS A 460      -1.336  -2.098  -0.848  1.00  0.00           H   new
ATOM      0  HA  HIS A 460      -0.840  -3.747   1.497  1.00  0.00           H   new
ATOM      0  HB2 HIS A 460       0.547  -3.487  -1.198  1.00  0.00           H   new
ATOM      0  HB3 HIS A 460       0.979  -4.659   0.031  1.00  0.00           H   new
ATOM      0  HD2 HIS A 460      -0.800  -4.898  -3.091  1.00  0.00           H   new
ATOM      0  HE1 HIS A 460      -3.224  -7.242  -0.516  1.00  0.00           H   new
ATOM      0  HE2 HIS A 460      -2.697  -6.680  -2.942  1.00  0.00           H   new
ATOM    208  N   GLU A 461       0.620  -1.006   1.215  1.00  0.00           N
ATOM    209  CA  GLU A 461       1.640  -0.109   1.744  1.00  0.00           C
ATOM    210  C   GLU A 461       1.356   0.239   3.202  1.00  0.00           C
ATOM    211  O   GLU A 461       2.277   0.408   4.003  1.00  0.00           O
ATOM    212  CB  GLU A 461       1.709   1.171   0.907  1.00  0.00           C
ATOM    213  CG  GLU A 461       2.040   0.925  -0.555  1.00  0.00           C
ATOM    214  CD  GLU A 461       0.806   0.667  -1.398  1.00  0.00           C
ATOM    215  OE1 GLU A 461       0.387  -0.505  -1.492  1.00  0.00           O
ATOM    216  OE2 GLU A 461       0.260   1.638  -1.963  1.00  0.00           O
ATOM      0  H   GLU A 461      -0.177  -0.534   0.788  1.00  0.00           H   new
ATOM      0  HA  GLU A 461       2.600  -0.622   1.691  1.00  0.00           H   new
ATOM      0  HB2 GLU A 461       0.752   1.690   0.972  1.00  0.00           H   new
ATOM      0  HB3 GLU A 461       2.461   1.834   1.334  1.00  0.00           H   new
ATOM      0  HG2 GLU A 461       2.573   1.788  -0.953  1.00  0.00           H   new
ATOM      0  HG3 GLU A 461       2.713   0.071  -0.632  1.00  0.00           H   new
ATOM    223  N   CYS A 462       0.076   0.345   3.541  1.00  0.00           N
ATOM    224  CA  CYS A 462      -0.332   0.674   4.901  1.00  0.00           C
ATOM    225  C   CYS A 462      -1.360  -0.328   5.418  1.00  0.00           C
ATOM    226  O   CYS A 462      -1.325  -0.725   6.582  1.00  0.00           O
ATOM    227  CB  CYS A 462      -0.911   2.089   4.955  1.00  0.00           C
ATOM    228  SG  CYS A 462      -2.210   2.408   3.718  1.00  0.00           S
ATOM      0  H   CYS A 462      -0.698   0.207   2.891  1.00  0.00           H   new
ATOM      0  HA  CYS A 462       0.550   0.625   5.539  1.00  0.00           H   new
ATOM      0  HB2 CYS A 462      -1.320   2.265   5.950  1.00  0.00           H   new
ATOM      0  HB3 CYS A 462      -0.103   2.806   4.811  1.00  0.00           H   new
ATOM      0  HG  CYS A 462      -1.906   1.809   2.605  1.00  0.00           H   new
ATOM    233  N   GLY A 463      -2.274  -0.735   4.543  1.00  0.00           N
ATOM    234  CA  GLY A 463      -3.299  -1.687   4.929  1.00  0.00           C
ATOM    235  C   GLY A 463      -4.686  -1.075   4.938  1.00  0.00           C
ATOM    236  O   GLY A 463      -5.590  -1.575   5.608  1.00  0.00           O
ATOM      0  H   GLY A 463      -2.323  -0.422   3.573  1.00  0.00           H   new
ATOM      0  HA2 GLY A 463      -3.283  -2.532   4.241  1.00  0.00           H   new
ATOM      0  HA3 GLY A 463      -3.072  -2.079   5.921  1.00  0.00           H   new
ATOM    240  N   LYS A 464      -4.855   0.013   4.194  1.00  0.00           N
ATOM    241  CA  LYS A 464      -6.141   0.696   4.119  1.00  0.00           C
ATOM    242  C   LYS A 464      -6.963   0.180   2.942  1.00  0.00           C
ATOM    243  O   LYS A 464      -6.505   0.192   1.799  1.00  0.00           O
ATOM    244  CB  LYS A 464      -5.933   2.206   3.986  1.00  0.00           C
ATOM    245  CG  LYS A 464      -5.892   2.935   5.318  1.00  0.00           C
ATOM    246  CD  LYS A 464      -5.905   4.442   5.130  1.00  0.00           C
ATOM    247  CE  LYS A 464      -4.495   5.010   5.075  1.00  0.00           C
ATOM    248  NZ  LYS A 464      -3.753   4.775   6.344  1.00  0.00           N
ATOM      0  H   LYS A 464      -4.117   0.441   3.634  1.00  0.00           H   new
ATOM      0  HA  LYS A 464      -6.687   0.490   5.039  1.00  0.00           H   new
ATOM      0  HB2 LYS A 464      -5.001   2.390   3.452  1.00  0.00           H   new
ATOM      0  HB3 LYS A 464      -6.736   2.623   3.378  1.00  0.00           H   new
ATOM      0  HG2 LYS A 464      -6.747   2.636   5.924  1.00  0.00           H   new
ATOM      0  HG3 LYS A 464      -4.996   2.644   5.866  1.00  0.00           H   new
ATOM      0  HD2 LYS A 464      -6.434   4.690   4.210  1.00  0.00           H   new
ATOM      0  HD3 LYS A 464      -6.454   4.907   5.949  1.00  0.00           H   new
ATOM      0  HE2 LYS A 464      -3.952   4.554   4.247  1.00  0.00           H   new
ATOM      0  HE3 LYS A 464      -4.542   6.080   4.875  1.00  0.00           H   new
ATOM      0  HZ1 LYS A 464      -3.044   5.524   6.475  1.00  0.00           H   new
ATOM      0  HZ2 LYS A 464      -4.419   4.785   7.143  1.00  0.00           H   new
ATOM      0  HZ3 LYS A 464      -3.277   3.851   6.302  1.00  0.00           H   new
ATOM    262  N   VAL A 465      -8.180  -0.272   3.229  1.00  0.00           N
ATOM    263  CA  VAL A 465      -9.067  -0.790   2.194  1.00  0.00           C
ATOM    264  C   VAL A 465     -10.007   0.296   1.682  1.00  0.00           C
ATOM    265  O   VAL A 465     -10.420   1.179   2.434  1.00  0.00           O
ATOM    266  CB  VAL A 465      -9.903  -1.975   2.712  1.00  0.00           C
ATOM    267  CG1 VAL A 465     -10.741  -2.568   1.590  1.00  0.00           C
ATOM    268  CG2 VAL A 465      -9.000  -3.032   3.330  1.00  0.00           C
ATOM      0  H   VAL A 465      -8.574  -0.290   4.170  1.00  0.00           H   new
ATOM      0  HA  VAL A 465      -8.433  -1.133   1.376  1.00  0.00           H   new
ATOM      0  HB  VAL A 465     -10.580  -1.610   3.485  1.00  0.00           H   new
ATOM      0 HG11 VAL A 465     -11.325  -3.404   1.975  1.00  0.00           H   new
ATOM      0 HG12 VAL A 465     -11.414  -1.806   1.197  1.00  0.00           H   new
ATOM      0 HG13 VAL A 465     -10.086  -2.920   0.793  1.00  0.00           H   new
ATOM      0 HG21 VAL A 465      -9.606  -3.863   3.691  1.00  0.00           H   new
ATOM      0 HG22 VAL A 465      -8.298  -3.395   2.579  1.00  0.00           H   new
ATOM      0 HG23 VAL A 465      -8.448  -2.597   4.163  1.00  0.00           H   new
ATOM    278  N   PHE A 466     -10.343   0.223   0.398  1.00  0.00           N
ATOM    279  CA  PHE A 466     -11.235   1.200  -0.215  1.00  0.00           C
ATOM    280  C   PHE A 466     -12.428   0.511  -0.870  1.00  0.00           C
ATOM    281  O   PHE A 466     -12.585  -0.706  -0.774  1.00  0.00           O
ATOM    282  CB  PHE A 466     -10.479   2.032  -1.253  1.00  0.00           C
ATOM    283  CG  PHE A 466      -9.463   2.961  -0.652  1.00  0.00           C
ATOM    284  CD1 PHE A 466      -8.176   2.523  -0.384  1.00  0.00           C
ATOM    285  CD2 PHE A 466      -9.795   4.273  -0.356  1.00  0.00           C
ATOM    286  CE1 PHE A 466      -7.240   3.376   0.169  1.00  0.00           C
ATOM    287  CE2 PHE A 466      -8.863   5.131   0.197  1.00  0.00           C
ATOM    288  CZ  PHE A 466      -7.584   4.682   0.459  1.00  0.00           C
ATOM      0  H   PHE A 466     -10.011  -0.502  -0.238  1.00  0.00           H   new
ATOM      0  HA  PHE A 466     -11.605   1.860   0.570  1.00  0.00           H   new
ATOM      0  HB2 PHE A 466      -9.978   1.360  -1.950  1.00  0.00           H   new
ATOM      0  HB3 PHE A 466     -11.196   2.615  -1.831  1.00  0.00           H   new
ATOM      0  HD1 PHE A 466      -7.901   1.503  -0.610  1.00  0.00           H   new
ATOM      0  HD2 PHE A 466     -10.794   4.630  -0.560  1.00  0.00           H   new
ATOM      0  HE1 PHE A 466      -6.241   3.022   0.374  1.00  0.00           H   new
ATOM      0  HE2 PHE A 466      -9.135   6.151   0.424  1.00  0.00           H   new
ATOM      0  HZ  PHE A 466      -6.854   5.351   0.890  1.00  0.00           H   new
ATOM    298  N   ARG A 467     -13.266   1.299  -1.536  1.00  0.00           N
ATOM    299  CA  ARG A 467     -14.447   0.766  -2.206  1.00  0.00           C
ATOM    300  C   ARG A 467     -14.186   0.576  -3.697  1.00  0.00           C
ATOM    301  O   ARG A 467     -14.456  -0.488  -4.254  1.00  0.00           O
ATOM    302  CB  ARG A 467     -15.641   1.699  -2.000  1.00  0.00           C
ATOM    303  CG  ARG A 467     -16.383   1.461  -0.695  1.00  0.00           C
ATOM    304  CD  ARG A 467     -15.568   1.927   0.501  1.00  0.00           C
ATOM    305  NE  ARG A 467     -15.202   3.337   0.400  1.00  0.00           N
ATOM    306  CZ  ARG A 467     -16.070   4.333   0.543  1.00  0.00           C
ATOM    307  NH1 ARG A 467     -17.346   4.075   0.793  1.00  0.00           N
ATOM    308  NH2 ARG A 467     -15.661   5.591   0.436  1.00  0.00           N
ATOM      0  H   ARG A 467     -13.149   2.308  -1.626  1.00  0.00           H   new
ATOM      0  HA  ARG A 467     -14.675  -0.206  -1.768  1.00  0.00           H   new
ATOM      0  HB2 ARG A 467     -15.293   2.732  -2.027  1.00  0.00           H   new
ATOM      0  HB3 ARG A 467     -16.336   1.575  -2.831  1.00  0.00           H   new
ATOM      0  HG2 ARG A 467     -17.336   1.989  -0.715  1.00  0.00           H   new
ATOM      0  HG3 ARG A 467     -16.609   0.400  -0.592  1.00  0.00           H   new
ATOM      0  HD2 ARG A 467     -16.141   1.766   1.414  1.00  0.00           H   new
ATOM      0  HD3 ARG A 467     -14.664   1.323   0.581  1.00  0.00           H   new
ATOM      0  HE  ARG A 467     -14.227   3.570   0.209  1.00  0.00           H   new
ATOM      0 HH11 ARG A 467     -17.664   3.110   0.876  1.00  0.00           H   new
ATOM      0 HH12 ARG A 467     -18.010   4.842   0.902  1.00  0.00           H   new
ATOM      0 HH21 ARG A 467     -14.680   5.794   0.244  1.00  0.00           H   new
ATOM      0 HH22 ARG A 467     -16.328   6.355   0.546  1.00  0.00           H   new
ATOM    322  N   ARG A 468     -13.661   1.616  -4.338  1.00  0.00           N
ATOM    323  CA  ARG A 468     -13.366   1.564  -5.765  1.00  0.00           C
ATOM    324  C   ARG A 468     -11.877   1.780  -6.020  1.00  0.00           C
ATOM    325  O   ARG A 468     -11.209   2.500  -5.280  1.00  0.00           O
ATOM    326  CB  ARG A 468     -14.181   2.620  -6.514  1.00  0.00           C
ATOM    327  CG  ARG A 468     -14.183   3.981  -5.838  1.00  0.00           C
ATOM    328  CD  ARG A 468     -14.947   5.009  -6.657  1.00  0.00           C
ATOM    329  NE  ARG A 468     -16.239   4.499  -7.109  1.00  0.00           N
ATOM    330  CZ  ARG A 468     -17.271   4.290  -6.300  1.00  0.00           C
ATOM    331  NH1 ARG A 468     -17.163   4.546  -5.003  1.00  0.00           N
ATOM    332  NH2 ARG A 468     -18.413   3.823  -6.786  1.00  0.00           N
ATOM      0  H   ARG A 468     -13.431   2.504  -3.892  1.00  0.00           H   new
ATOM      0  HA  ARG A 468     -13.640   0.575  -6.132  1.00  0.00           H   new
ATOM      0  HB2 ARG A 468     -13.783   2.726  -7.523  1.00  0.00           H   new
ATOM      0  HB3 ARG A 468     -15.209   2.271  -6.612  1.00  0.00           H   new
ATOM      0  HG2 ARG A 468     -14.632   3.896  -4.848  1.00  0.00           H   new
ATOM      0  HG3 ARG A 468     -13.157   4.319  -5.694  1.00  0.00           H   new
ATOM      0  HD2 ARG A 468     -15.101   5.907  -6.059  1.00  0.00           H   new
ATOM      0  HD3 ARG A 468     -14.350   5.300  -7.521  1.00  0.00           H   new
ATOM      0  HE  ARG A 468     -16.355   4.292  -8.101  1.00  0.00           H   new
ATOM      0 HH11 ARG A 468     -16.286   4.904  -4.625  1.00  0.00           H   new
ATOM      0 HH12 ARG A 468     -17.957   4.385  -4.383  1.00  0.00           H   new
ATOM      0 HH21 ARG A 468     -18.500   3.624  -7.783  1.00  0.00           H   new
ATOM      0 HH22 ARG A 468     -19.205   3.663  -6.163  1.00  0.00           H   new
ATOM    346  N   ASN A 469     -11.366   1.150  -7.073  1.00  0.00           N
ATOM    347  CA  ASN A 469      -9.956   1.272  -7.425  1.00  0.00           C
ATOM    348  C   ASN A 469      -9.543   2.738  -7.517  1.00  0.00           C
ATOM    349  O   ASN A 469      -8.452   3.114  -7.089  1.00  0.00           O
ATOM    350  CB  ASN A 469      -9.679   0.568  -8.755  1.00  0.00           C
ATOM    351  CG  ASN A 469     -10.785   0.789  -9.768  1.00  0.00           C
ATOM    352  OD1 ASN A 469     -11.885   0.255  -9.630  1.00  0.00           O
ATOM    353  ND2 ASN A 469     -10.497   1.581 -10.795  1.00  0.00           N
ATOM      0  H   ASN A 469     -11.907   0.551  -7.697  1.00  0.00           H   new
ATOM      0  HA  ASN A 469      -9.368   0.796  -6.640  1.00  0.00           H   new
ATOM      0  HB2 ASN A 469      -8.737   0.931  -9.165  1.00  0.00           H   new
ATOM      0  HB3 ASN A 469      -9.560  -0.501  -8.579  1.00  0.00           H   new
ATOM      0 HD21 ASN A 469     -11.201   1.767 -11.509  1.00  0.00           H   new
ATOM      0 HD22 ASN A 469      -9.571   2.003 -10.870  1.00  0.00           H   new
ATOM    360  N   SER A 470     -10.423   3.561  -8.078  1.00  0.00           N
ATOM    361  CA  SER A 470     -10.150   4.985  -8.230  1.00  0.00           C
ATOM    362  C   SER A 470      -9.831   5.623  -6.881  1.00  0.00           C
ATOM    363  O   SER A 470      -8.951   6.478  -6.778  1.00  0.00           O
ATOM    364  CB  SER A 470     -11.346   5.691  -8.870  1.00  0.00           C
ATOM    365  OG  SER A 470     -12.252   6.155  -7.885  1.00  0.00           O
ATOM      0  H   SER A 470     -11.332   3.266  -8.435  1.00  0.00           H   new
ATOM      0  HA  SER A 470      -9.282   5.096  -8.880  1.00  0.00           H   new
ATOM      0  HB2 SER A 470     -10.997   6.530  -9.472  1.00  0.00           H   new
ATOM      0  HB3 SER A 470     -11.858   5.006  -9.545  1.00  0.00           H   new
ATOM      0  HG  SER A 470     -12.919   6.738  -8.303  1.00  0.00           H   new
ATOM    371  N   HIS A 471     -10.554   5.201  -5.848  1.00  0.00           N
ATOM    372  CA  HIS A 471     -10.349   5.730  -4.504  1.00  0.00           C
ATOM    373  C   HIS A 471      -8.994   5.298  -3.951  1.00  0.00           C
ATOM    374  O   HIS A 471      -8.381   6.010  -3.155  1.00  0.00           O
ATOM    375  CB  HIS A 471     -11.467   5.262  -3.573  1.00  0.00           C
ATOM    376  CG  HIS A 471     -12.731   6.053  -3.709  1.00  0.00           C
ATOM    377  ND1 HIS A 471     -13.910   5.702  -3.085  1.00  0.00           N
ATOM    378  CD2 HIS A 471     -12.997   7.185  -4.402  1.00  0.00           C
ATOM    379  CE1 HIS A 471     -14.846   6.583  -3.389  1.00  0.00           C
ATOM    380  NE2 HIS A 471     -14.317   7.494  -4.187  1.00  0.00           N
ATOM      0  H   HIS A 471     -11.287   4.495  -5.916  1.00  0.00           H   new
ATOM      0  HA  HIS A 471     -10.367   6.818  -4.561  1.00  0.00           H   new
ATOM      0  HB2 HIS A 471     -11.681   4.213  -3.775  1.00  0.00           H   new
ATOM      0  HB3 HIS A 471     -11.119   5.323  -2.542  1.00  0.00           H   new
ATOM      0  HD2 HIS A 471     -12.300   7.742  -5.011  1.00  0.00           H   new
ATOM      0  HE1 HIS A 471     -15.869   6.562  -3.044  1.00  0.00           H   new
ATOM      0  HE2 HIS A 471     -14.810   8.296  -4.579  1.00  0.00           H   new
ATOM    388  N   LEU A 472      -8.534   4.127  -4.376  1.00  0.00           N
ATOM    389  CA  LEU A 472      -7.252   3.598  -3.923  1.00  0.00           C
ATOM    390  C   LEU A 472      -6.098   4.230  -4.695  1.00  0.00           C
ATOM    391  O   LEU A 472      -5.049   4.531  -4.127  1.00  0.00           O
ATOM    392  CB  LEU A 472      -7.218   2.078  -4.087  1.00  0.00           C
ATOM    393  CG  LEU A 472      -5.901   1.393  -3.721  1.00  0.00           C
ATOM    394  CD1 LEU A 472      -5.802   1.192  -2.217  1.00  0.00           C
ATOM    395  CD2 LEU A 472      -5.772   0.062  -4.448  1.00  0.00           C
ATOM      0  H   LEU A 472      -9.029   3.525  -5.034  1.00  0.00           H   new
ATOM      0  HA  LEU A 472      -7.138   3.846  -2.868  1.00  0.00           H   new
ATOM      0  HB2 LEU A 472      -8.010   1.649  -3.474  1.00  0.00           H   new
ATOM      0  HB3 LEU A 472      -7.453   1.839  -5.124  1.00  0.00           H   new
ATOM      0  HG  LEU A 472      -5.080   2.038  -4.035  1.00  0.00           H   new
ATOM      0 HD11 LEU A 472      -4.858   0.703  -1.977  1.00  0.00           H   new
ATOM      0 HD12 LEU A 472      -5.847   2.159  -1.717  1.00  0.00           H   new
ATOM      0 HD13 LEU A 472      -6.630   0.569  -1.878  1.00  0.00           H   new
ATOM      0 HD21 LEU A 472      -4.829  -0.411  -4.176  1.00  0.00           H   new
ATOM      0 HD22 LEU A 472      -6.600  -0.589  -4.165  1.00  0.00           H   new
ATOM      0 HD23 LEU A 472      -5.795   0.232  -5.524  1.00  0.00           H   new
ATOM    407  N   ALA A 473      -6.301   4.430  -5.993  1.00  0.00           N
ATOM    408  CA  ALA A 473      -5.280   5.031  -6.842  1.00  0.00           C
ATOM    409  C   ALA A 473      -4.848   6.390  -6.304  1.00  0.00           C
ATOM    410  O   ALA A 473      -3.655   6.673  -6.190  1.00  0.00           O
ATOM    411  CB  ALA A 473      -5.792   5.164  -8.269  1.00  0.00           C
ATOM      0  H   ALA A 473      -7.163   4.185  -6.479  1.00  0.00           H   new
ATOM      0  HA  ALA A 473      -4.409   4.376  -6.839  1.00  0.00           H   new
ATOM      0  HB1 ALA A 473      -5.019   5.614  -8.892  1.00  0.00           H   new
ATOM      0  HB2 ALA A 473      -6.043   4.178  -8.659  1.00  0.00           H   new
ATOM      0  HB3 ALA A 473      -6.680   5.796  -8.279  1.00  0.00           H   new
ATOM    417  N   ARG A 474      -5.825   7.229  -5.975  1.00  0.00           N
ATOM    418  CA  ARG A 474      -5.545   8.560  -5.450  1.00  0.00           C
ATOM    419  C   ARG A 474      -4.812   8.475  -4.114  1.00  0.00           C
ATOM    420  O   ARG A 474      -4.047   9.371  -3.756  1.00  0.00           O
ATOM    421  CB  ARG A 474      -6.844   9.349  -5.282  1.00  0.00           C
ATOM    422  CG  ARG A 474      -7.446   9.819  -6.596  1.00  0.00           C
ATOM    423  CD  ARG A 474      -6.874  11.162  -7.022  1.00  0.00           C
ATOM    424  NE  ARG A 474      -7.216  12.226  -6.082  1.00  0.00           N
ATOM    425  CZ  ARG A 474      -8.394  12.839  -6.062  1.00  0.00           C
ATOM    426  NH1 ARG A 474      -9.338  12.495  -6.927  1.00  0.00           N
ATOM    427  NH2 ARG A 474      -8.629  13.798  -5.176  1.00  0.00           N
ATOM      0  H   ARG A 474      -6.817   7.010  -6.063  1.00  0.00           H   new
ATOM      0  HA  ARG A 474      -4.904   9.077  -6.164  1.00  0.00           H   new
ATOM      0  HB2 ARG A 474      -7.572   8.727  -4.761  1.00  0.00           H   new
ATOM      0  HB3 ARG A 474      -6.653  10.216  -4.649  1.00  0.00           H   new
ATOM      0  HG2 ARG A 474      -7.253   9.078  -7.372  1.00  0.00           H   new
ATOM      0  HG3 ARG A 474      -8.528   9.899  -6.494  1.00  0.00           H   new
ATOM      0  HD2 ARG A 474      -5.790  11.085  -7.103  1.00  0.00           H   new
ATOM      0  HD3 ARG A 474      -7.250  11.419  -8.012  1.00  0.00           H   new
ATOM      0  HE  ARG A 474      -6.511  12.514  -5.403  1.00  0.00           H   new
ATOM      0 HH11 ARG A 474      -9.160  11.758  -7.610  1.00  0.00           H   new
ATOM      0 HH12 ARG A 474     -10.242  12.967  -6.910  1.00  0.00           H   new
ATOM      0 HH21 ARG A 474      -7.905  14.065  -4.509  1.00  0.00           H   new
ATOM      0 HH22 ARG A 474      -9.534  14.268  -5.161  1.00  0.00           H   new
ATOM    441  N   HIS A 475      -5.052   7.392  -3.382  1.00  0.00           N
ATOM    442  CA  HIS A 475      -4.415   7.189  -2.086  1.00  0.00           C
ATOM    443  C   HIS A 475      -2.950   6.797  -2.255  1.00  0.00           C
ATOM    444  O   HIS A 475      -2.089   7.238  -1.494  1.00  0.00           O
ATOM    445  CB  HIS A 475      -5.155   6.111  -1.293  1.00  0.00           C
ATOM    446  CG  HIS A 475      -4.451   5.703  -0.036  1.00  0.00           C
ATOM    447  ND1 HIS A 475      -4.390   6.501   1.087  1.00  0.00           N
ATOM    448  CD2 HIS A 475      -3.776   4.571   0.273  1.00  0.00           C
ATOM    449  CE1 HIS A 475      -3.707   5.879   2.031  1.00  0.00           C
ATOM    450  NE2 HIS A 475      -3.324   4.705   1.562  1.00  0.00           N
ATOM      0  H   HIS A 475      -5.683   6.642  -3.664  1.00  0.00           H   new
ATOM      0  HA  HIS A 475      -4.460   8.129  -1.536  1.00  0.00           H   new
ATOM      0  HB2 HIS A 475      -6.150   6.477  -1.040  1.00  0.00           H   new
ATOM      0  HB3 HIS A 475      -5.289   5.234  -1.926  1.00  0.00           H   new
ATOM      0  HD2 HIS A 475      -3.622   3.720  -0.374  1.00  0.00           H   new
ATOM      0  HE1 HIS A 475      -3.497   6.264   3.018  1.00  0.00           H   new
ATOM      0  HE2 HIS A 475      -2.780   4.011   2.075  1.00  0.00           H   new
ATOM    458  N   GLN A 476      -2.677   5.967  -3.257  1.00  0.00           N
ATOM    459  CA  GLN A 476      -1.317   5.515  -3.524  1.00  0.00           C
ATOM    460  C   GLN A 476      -0.379   6.701  -3.724  1.00  0.00           C
ATOM    461  O   GLN A 476       0.828   6.597  -3.500  1.00  0.00           O
ATOM    462  CB  GLN A 476      -1.290   4.615  -4.760  1.00  0.00           C
ATOM    463  CG  GLN A 476      -1.740   3.189  -4.484  1.00  0.00           C
ATOM    464  CD  GLN A 476      -1.419   2.244  -5.625  1.00  0.00           C
ATOM    465  OE1 GLN A 476      -1.173   2.675  -6.753  1.00  0.00           O
ATOM    466  NE2 GLN A 476      -1.420   0.948  -5.339  1.00  0.00           N
ATOM      0  H   GLN A 476      -3.379   5.594  -3.896  1.00  0.00           H   new
ATOM      0  HA  GLN A 476      -0.974   4.945  -2.660  1.00  0.00           H   new
ATOM      0  HB2 GLN A 476      -1.931   5.047  -5.528  1.00  0.00           H   new
ATOM      0  HB3 GLN A 476      -0.278   4.596  -5.163  1.00  0.00           H   new
ATOM      0  HG2 GLN A 476      -1.259   2.830  -3.574  1.00  0.00           H   new
ATOM      0  HG3 GLN A 476      -2.815   3.180  -4.301  1.00  0.00           H   new
ATOM      0 HE21 GLN A 476      -1.629   0.635  -4.391  1.00  0.00           H   new
ATOM      0 HE22 GLN A 476      -1.211   0.265  -6.067  1.00  0.00           H   new
ATOM    475  N   LEU A 477      -0.940   7.828  -4.148  1.00  0.00           N
ATOM    476  CA  LEU A 477      -0.154   9.035  -4.379  1.00  0.00           C
ATOM    477  C   LEU A 477       0.638   9.416  -3.131  1.00  0.00           C
ATOM    478  O   LEU A 477       1.735   9.968  -3.225  1.00  0.00           O
ATOM    479  CB  LEU A 477      -1.066  10.191  -4.790  1.00  0.00           C
ATOM    480  CG  LEU A 477      -2.008   9.918  -5.963  1.00  0.00           C
ATOM    481  CD1 LEU A 477      -2.794  11.170  -6.320  1.00  0.00           C
ATOM    482  CD2 LEU A 477      -1.227   9.416  -7.169  1.00  0.00           C
ATOM      0  H   LEU A 477      -1.937   7.931  -4.339  1.00  0.00           H   new
ATOM      0  HA  LEU A 477       0.550   8.831  -5.186  1.00  0.00           H   new
ATOM      0  HB2 LEU A 477      -1.667  10.478  -3.927  1.00  0.00           H   new
ATOM      0  HB3 LEU A 477      -0.442  11.048  -5.043  1.00  0.00           H   new
ATOM      0  HG  LEU A 477      -2.714   9.143  -5.663  1.00  0.00           H   new
ATOM      0 HD11 LEU A 477      -3.459  10.956  -7.157  1.00  0.00           H   new
ATOM      0 HD12 LEU A 477      -3.384  11.487  -5.460  1.00  0.00           H   new
ATOM      0 HD13 LEU A 477      -2.104  11.966  -6.600  1.00  0.00           H   new
ATOM      0 HD21 LEU A 477      -1.914   9.227  -7.994  1.00  0.00           H   new
ATOM      0 HD22 LEU A 477      -0.498  10.168  -7.469  1.00  0.00           H   new
ATOM      0 HD23 LEU A 477      -0.710   8.493  -6.909  1.00  0.00           H   new
ATOM    494  N   ILE A 478       0.076   9.116  -1.966  1.00  0.00           N
ATOM    495  CA  ILE A 478       0.731   9.424  -0.700  1.00  0.00           C
ATOM    496  C   ILE A 478       1.963   8.550  -0.492  1.00  0.00           C
ATOM    497  O   ILE A 478       2.893   8.929   0.220  1.00  0.00           O
ATOM    498  CB  ILE A 478      -0.227   9.234   0.490  1.00  0.00           C
ATOM    499  CG1 ILE A 478       0.294   9.985   1.717  1.00  0.00           C
ATOM    500  CG2 ILE A 478      -0.398   7.754   0.802  1.00  0.00           C
ATOM    501  CD1 ILE A 478      -0.663   9.966   2.889  1.00  0.00           C
ATOM      0  H   ILE A 478      -0.831   8.660  -1.872  1.00  0.00           H   new
ATOM      0  HA  ILE A 478       1.035  10.470  -0.748  1.00  0.00           H   new
ATOM      0  HB  ILE A 478      -1.201   9.644   0.222  1.00  0.00           H   new
ATOM      0 HG12 ILE A 478       1.243   9.546   2.026  1.00  0.00           H   new
ATOM      0 HG13 ILE A 478       0.497  11.020   1.441  1.00  0.00           H   new
ATOM      0 HG21 ILE A 478      -1.078   7.636   1.646  1.00  0.00           H   new
ATOM      0 HG22 ILE A 478      -0.809   7.244  -0.069  1.00  0.00           H   new
ATOM      0 HG23 ILE A 478       0.570   7.321   1.053  1.00  0.00           H   new
ATOM      0 HD11 ILE A 478      -0.228  10.517   3.723  1.00  0.00           H   new
ATOM      0 HD12 ILE A 478      -1.604  10.432   2.598  1.00  0.00           H   new
ATOM      0 HD13 ILE A 478      -0.847   8.935   3.192  1.00  0.00           H   new