USER  MOD reduce.3.24.130724 H: found=0, std=0, add=235, rem=0, adj=6
USER  MOD reduce.3.24.130724 removed 234 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  13 ASN     :      amide:sc=   0.582  K(o=1.5,f=-6.8!)
USER  MOD Set 1.2: A  15 THR OG1 :   rot   77:sc=   0.951
USER  MOD Single : A   8 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  10 MET CE  :methyl -130:sc=       0   (180deg=-0.00976)
USER  MOD Single : A  17 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  18 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  20 ASN     :      amide:sc=    1.05  K(o=1.1,f=-7.4!)
USER  MOD Single : A  21 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD Single : A  23 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  24 ASN     :      amide:sc=       0  X(o=0,f=-0.26)
USER  MOD Single : A  26 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  27 GLN     :      amide:sc=  0.0778  X(o=0.078,f=0)
USER  MOD -----------------------------------------------------------------
ATOM     25  N   LEU A   2      -9.051  -4.313   2.086  1.00  0.00           N
ATOM     26  CA  LEU A   2      -8.392  -3.992   0.807  1.00  0.00           C
ATOM     27  C   LEU A   2      -9.178  -4.572  -0.396  1.00  0.00           C
ATOM     28  O   LEU A   2      -9.962  -5.509  -0.203  1.00  0.00           O
ATOM     29  CB  LEU A   2      -6.938  -4.512   0.848  1.00  0.00           C
ATOM     30  CG  LEU A   2      -5.985  -3.670   1.717  1.00  0.00           C
ATOM     31  CD1 LEU A   2      -4.669  -4.413   1.939  1.00  0.00           C
ATOM     32  CD2 LEU A   2      -5.649  -2.332   1.055  1.00  0.00           C
ATOM      0  HA  LEU A   2      -8.377  -2.911   0.670  1.00  0.00           H   new
ATOM      0  HB2 LEU A   2      -6.942  -5.536   1.222  1.00  0.00           H   new
ATOM      0  HB3 LEU A   2      -6.548  -4.545  -0.169  1.00  0.00           H   new
ATOM      0  HG  LEU A   2      -6.498  -3.494   2.662  1.00  0.00           H   new
ATOM      0 HD11 LEU A   2      -4.007  -3.804   2.555  1.00  0.00           H   new
ATOM      0 HD12 LEU A   2      -4.866  -5.359   2.443  1.00  0.00           H   new
ATOM      0 HD13 LEU A   2      -4.194  -4.607   0.977  1.00  0.00           H   new
ATOM      0 HD21 LEU A   2      -4.975  -1.767   1.698  1.00  0.00           H   new
ATOM      0 HD22 LEU A   2      -5.167  -2.512   0.094  1.00  0.00           H   new
ATOM      0 HD23 LEU A   2      -6.565  -1.762   0.900  1.00  0.00           H   new
ATOM     44  N   PRO A   3      -9.000  -4.047  -1.629  1.00  0.00           N
ATOM     45  CA  PRO A   3      -9.682  -4.552  -2.828  1.00  0.00           C
ATOM     46  C   PRO A   3      -9.167  -5.946  -3.261  1.00  0.00           C
ATOM     47  O   PRO A   3      -8.163  -6.425  -2.723  1.00  0.00           O
ATOM     48  CB  PRO A   3      -9.475  -3.488  -3.920  1.00  0.00           C
ATOM     49  CG  PRO A   3      -8.866  -2.287  -3.201  1.00  0.00           C
ATOM     50  CD  PRO A   3      -8.176  -2.904  -1.992  1.00  0.00           C
ATOM      0  HA  PRO A   3     -10.743  -4.705  -2.631  1.00  0.00           H   new
ATOM      0  HB2 PRO A   3      -8.813  -3.854  -4.705  1.00  0.00           H   new
ATOM      0  HB3 PRO A   3     -10.419  -3.224  -4.396  1.00  0.00           H   new
ATOM      0  HG2 PRO A   3      -8.159  -1.755  -3.838  1.00  0.00           H   new
ATOM      0  HG3 PRO A   3      -9.630  -1.569  -2.903  1.00  0.00           H   new
ATOM      0  HD2 PRO A   3      -7.159  -3.212  -2.233  1.00  0.00           H   new
ATOM      0  HD3 PRO A   3      -8.107  -2.191  -1.171  1.00  0.00           H   new
ATOM     58  N   PRO A   4      -9.809  -6.612  -4.246  1.00  0.00           N
ATOM     59  CA  PRO A   4      -9.482  -7.985  -4.646  1.00  0.00           C
ATOM     60  C   PRO A   4      -7.996  -8.218  -4.972  1.00  0.00           C
ATOM     61  O   PRO A   4      -7.423  -7.593  -5.869  1.00  0.00           O
ATOM     62  CB  PRO A   4     -10.394  -8.293  -5.840  1.00  0.00           C
ATOM     63  CG  PRO A   4     -11.621  -7.430  -5.556  1.00  0.00           C
ATOM     64  CD  PRO A   4     -11.008  -6.170  -4.948  1.00  0.00           C
ATOM      0  HA  PRO A   4      -9.654  -8.664  -3.811  1.00  0.00           H   new
ATOM      0  HB2 PRO A   4      -9.924  -8.029  -6.787  1.00  0.00           H   new
ATOM      0  HB3 PRO A   4     -10.647  -9.352  -5.894  1.00  0.00           H   new
ATOM      0  HG2 PRO A   4     -12.181  -7.210  -6.465  1.00  0.00           H   new
ATOM      0  HG3 PRO A   4     -12.310  -7.919  -4.867  1.00  0.00           H   new
ATOM      0  HD2 PRO A   4     -10.763  -5.442  -5.721  1.00  0.00           H   new
ATOM      0  HD3 PRO A   4     -11.706  -5.686  -4.264  1.00  0.00           H   new
ATOM     72  N   GLY A   5      -7.375  -9.141  -4.232  1.00  0.00           N
ATOM     73  CA  GLY A   5      -5.973  -9.551  -4.376  1.00  0.00           C
ATOM     74  C   GLY A   5      -4.920  -8.622  -3.752  1.00  0.00           C
ATOM     75  O   GLY A   5      -3.749  -9.000  -3.715  1.00  0.00           O
ATOM      0  H   GLY A   5      -7.854  -9.644  -3.485  1.00  0.00           H   new
ATOM      0  HA2 GLY A   5      -5.860 -10.541  -3.934  1.00  0.00           H   new
ATOM      0  HA3 GLY A   5      -5.754  -9.650  -5.439  1.00  0.00           H   new
ATOM     79  N   TRP A   6      -5.286  -7.441  -3.244  1.00  0.00           N
ATOM     80  CA  TRP A   6      -4.352  -6.513  -2.589  1.00  0.00           C
ATOM     81  C   TRP A   6      -3.962  -6.909  -1.156  1.00  0.00           C
ATOM     82  O   TRP A   6      -4.816  -7.273  -0.344  1.00  0.00           O
ATOM     83  CB  TRP A   6      -4.898  -5.083  -2.610  1.00  0.00           C
ATOM     84  CG  TRP A   6      -4.930  -4.398  -3.940  1.00  0.00           C
ATOM     85  CD1 TRP A   6      -5.959  -4.449  -4.813  1.00  0.00           C
ATOM     86  CD2 TRP A   6      -3.832  -3.770  -4.672  1.00  0.00           C
ATOM     87  NE1 TRP A   6      -5.635  -3.757  -5.962  1.00  0.00           N
ATOM     88  CE2 TRP A   6      -4.316  -3.361  -5.951  1.00  0.00           C
ATOM     89  CE3 TRP A   6      -2.478  -3.496  -4.382  1.00  0.00           C
ATOM     90  CZ2 TRP A   6      -3.501  -2.730  -6.898  1.00  0.00           C
ATOM     91  CZ3 TRP A   6      -1.653  -2.844  -5.319  1.00  0.00           C
ATOM     92  CH2 TRP A   6      -2.159  -2.464  -6.576  1.00  0.00           C
ATOM      0  H   TRP A   6      -6.246  -7.097  -3.275  1.00  0.00           H   new
ATOM      0  HA  TRP A   6      -3.436  -6.569  -3.177  1.00  0.00           H   new
ATOM      0  HB2 TRP A   6      -5.912  -5.100  -2.211  1.00  0.00           H   new
ATOM      0  HB3 TRP A   6      -4.297  -4.479  -1.930  1.00  0.00           H   new
ATOM      0  HD1 TRP A   6      -6.896  -4.956  -4.638  1.00  0.00           H   new
ATOM      0  HE1 TRP A   6      -6.288  -3.564  -6.721  1.00  0.00           H   new
ATOM      0  HE3 TRP A   6      -2.068  -3.791  -3.427  1.00  0.00           H   new
ATOM      0  HZ2 TRP A   6      -3.898  -2.451  -7.863  1.00  0.00           H   new
ATOM      0  HZ3 TRP A   6      -0.623  -2.634  -5.071  1.00  0.00           H   new
ATOM      0  HH2 TRP A   6      -1.518  -1.970  -7.291  1.00  0.00           H   new
ATOM    103  N   GLU A   7      -2.678  -6.765  -0.825  1.00  0.00           N
ATOM    104  CA  GLU A   7      -2.081  -6.998   0.498  1.00  0.00           C
ATOM    105  C   GLU A   7      -0.931  -6.012   0.796  1.00  0.00           C
ATOM    106  O   GLU A   7      -0.289  -5.489  -0.119  1.00  0.00           O
ATOM    107  CB  GLU A   7      -1.574  -8.453   0.602  1.00  0.00           C
ATOM    108  CG  GLU A   7      -2.663  -9.525   0.779  1.00  0.00           C
ATOM    109  CD  GLU A   7      -3.466  -9.416   2.096  1.00  0.00           C
ATOM    110  OE1 GLU A   7      -3.091  -8.635   3.007  1.00  0.00           O
ATOM    111  OE2 GLU A   7      -4.466 -10.160   2.249  1.00  0.00           O
ATOM      0  H   GLU A   7      -1.984  -6.466  -1.510  1.00  0.00           H   new
ATOM      0  HA  GLU A   7      -2.858  -6.829   1.243  1.00  0.00           H   new
ATOM      0  HB2 GLU A   7      -1.003  -8.685  -0.297  1.00  0.00           H   new
ATOM      0  HB3 GLU A   7      -0.884  -8.519   1.443  1.00  0.00           H   new
ATOM      0  HG2 GLU A   7      -3.356  -9.462  -0.060  1.00  0.00           H   new
ATOM      0  HG3 GLU A   7      -2.196 -10.509   0.734  1.00  0.00           H   new
ATOM    118  N   LYS A   8      -0.650  -5.760   2.082  1.00  0.00           N
ATOM    119  CA  LYS A   8       0.480  -4.925   2.540  1.00  0.00           C
ATOM    120  C   LYS A   8       1.854  -5.582   2.383  1.00  0.00           C
ATOM    121  O   LYS A   8       2.004  -6.798   2.545  1.00  0.00           O
ATOM    122  CB  LYS A   8       0.276  -4.422   3.979  1.00  0.00           C
ATOM    123  CG  LYS A   8      -0.660  -3.205   4.001  1.00  0.00           C
ATOM    124  CD  LYS A   8      -0.884  -2.644   5.413  1.00  0.00           C
ATOM    125  CE  LYS A   8       0.382  -1.978   5.974  1.00  0.00           C
ATOM    126  NZ  LYS A   8       0.149  -1.422   7.332  1.00  0.00           N
ATOM      0  H   LYS A   8      -1.208  -6.135   2.849  1.00  0.00           H   new
ATOM      0  HA  LYS A   8       0.480  -4.067   1.867  1.00  0.00           H   new
ATOM      0  HB2 LYS A   8      -0.142  -5.220   4.593  1.00  0.00           H   new
ATOM      0  HB3 LYS A   8       1.238  -4.155   4.416  1.00  0.00           H   new
ATOM      0  HG2 LYS A   8      -0.244  -2.422   3.367  1.00  0.00           H   new
ATOM      0  HG3 LYS A   8      -1.622  -3.486   3.571  1.00  0.00           H   new
ATOM      0  HD2 LYS A   8      -1.696  -1.918   5.390  1.00  0.00           H   new
ATOM      0  HD3 LYS A   8      -1.195  -3.449   6.078  1.00  0.00           H   new
ATOM      0  HE2 LYS A   8       1.191  -2.707   6.012  1.00  0.00           H   new
ATOM      0  HE3 LYS A   8       0.703  -1.181   5.303  1.00  0.00           H   new
ATOM      0  HZ1 LYS A   8       1.023  -0.980   7.681  1.00  0.00           H   new
ATOM      0  HZ2 LYS A   8      -0.607  -0.709   7.290  1.00  0.00           H   new
ATOM      0  HZ3 LYS A   8      -0.133  -2.188   7.977  1.00  0.00           H   new
ATOM    140  N   ARG A   9       2.856  -4.756   2.080  1.00  0.00           N
ATOM    141  CA  ARG A   9       4.293  -5.078   1.982  1.00  0.00           C
ATOM    142  C   ARG A   9       5.154  -3.992   2.641  1.00  0.00           C
ATOM    143  O   ARG A   9       4.666  -2.902   2.948  1.00  0.00           O
ATOM    144  CB  ARG A   9       4.695  -5.222   0.501  1.00  0.00           C
ATOM    145  CG  ARG A   9       3.969  -6.304  -0.306  1.00  0.00           C
ATOM    146  CD  ARG A   9       4.250  -7.713   0.234  1.00  0.00           C
ATOM    147  NE  ARG A   9       3.537  -8.746  -0.540  1.00  0.00           N
ATOM    148  CZ  ARG A   9       2.489  -9.451  -0.148  1.00  0.00           C
ATOM    149  NH1 ARG A   9       1.832  -9.191   0.946  1.00  0.00           N
ATOM    150  NH2 ARG A   9       2.076 -10.457  -0.864  1.00  0.00           N
ATOM      0  H   ARG A   9       2.679  -3.771   1.881  1.00  0.00           H   new
ATOM      0  HA  ARG A   9       4.464  -6.018   2.507  1.00  0.00           H   new
ATOM      0  HB2 ARG A   9       4.532  -4.263   0.009  1.00  0.00           H   new
ATOM      0  HB3 ARG A   9       5.765  -5.425   0.457  1.00  0.00           H   new
ATOM      0  HG2 ARG A   9       2.896  -6.115  -0.282  1.00  0.00           H   new
ATOM      0  HG3 ARG A   9       4.280  -6.247  -1.349  1.00  0.00           H   new
ATOM      0  HD2 ARG A   9       5.322  -7.908   0.201  1.00  0.00           H   new
ATOM      0  HD3 ARG A   9       3.948  -7.769   1.280  1.00  0.00           H   new
ATOM      0  HE  ARG A   9       3.890  -8.937  -1.478  1.00  0.00           H   new
ATOM      0 HH11 ARG A   9       2.120  -8.415   1.542  1.00  0.00           H   new
ATOM      0 HH12 ARG A   9       1.029  -9.763   1.207  1.00  0.00           H   new
ATOM      0 HH21 ARG A   9       2.561 -10.702  -1.727  1.00  0.00           H   new
ATOM      0 HH22 ARG A   9       1.268 -11.001  -0.561  1.00  0.00           H   new
ATOM    164  N   MET A  10       6.450  -4.263   2.811  1.00  0.00           N
ATOM    165  CA  MET A  10       7.418  -3.301   3.350  1.00  0.00           C
ATOM    166  C   MET A  10       8.849  -3.605   2.878  1.00  0.00           C
ATOM    167  O   MET A  10       9.301  -4.753   2.904  1.00  0.00           O
ATOM    168  CB  MET A  10       7.339  -3.284   4.889  1.00  0.00           C
ATOM    169  CG  MET A  10       8.126  -2.118   5.504  1.00  0.00           C
ATOM    170  SD  MET A  10       8.164  -2.082   7.317  1.00  0.00           S
ATOM    171  CE  MET A  10       9.353  -3.416   7.635  1.00  0.00           C
ATOM      0  H   MET A  10       6.863  -5.166   2.576  1.00  0.00           H   new
ATOM      0  HA  MET A  10       7.160  -2.313   2.970  1.00  0.00           H   new
ATOM      0  HB2 MET A  10       6.295  -3.216   5.196  1.00  0.00           H   new
ATOM      0  HB3 MET A  10       7.725  -4.225   5.280  1.00  0.00           H   new
ATOM      0  HG2 MET A  10       9.151  -2.159   5.136  1.00  0.00           H   new
ATOM      0  HG3 MET A  10       7.696  -1.182   5.147  1.00  0.00           H   new
ATOM      0  HE1 MET A  10       8.939  -4.105   8.371  1.00  0.00           H   new
ATOM      0  HE2 MET A  10       9.554  -3.953   6.708  1.00  0.00           H   new
ATOM      0  HE3 MET A  10      10.282  -2.992   8.017  1.00  0.00           H   new
ATOM    181  N   PHE A  11       9.559  -2.561   2.451  1.00  0.00           N
ATOM    182  CA  PHE A  11      10.975  -2.575   2.079  1.00  0.00           C
ATOM    183  C   PHE A  11      11.958  -2.738   3.252  1.00  0.00           C
ATOM    184  O   PHE A  11      11.626  -2.421   4.398  1.00  0.00           O
ATOM    185  CB  PHE A  11      11.294  -1.324   1.246  1.00  0.00           C
ATOM    186  CG  PHE A  11      10.660  -1.282  -0.132  1.00  0.00           C
ATOM    187  CD1 PHE A  11      11.170  -2.075  -1.177  1.00  0.00           C
ATOM    188  CD2 PHE A  11       9.573  -0.422  -0.384  1.00  0.00           C
ATOM    189  CE1 PHE A  11      10.605  -2.000  -2.465  1.00  0.00           C
ATOM    190  CE2 PHE A  11       9.015  -0.339  -1.670  1.00  0.00           C
ATOM    191  CZ  PHE A  11       9.530  -1.128  -2.712  1.00  0.00           C
ATOM      0  H   PHE A  11       9.142  -1.636   2.350  1.00  0.00           H   new
ATOM      0  HA  PHE A  11      11.127  -3.476   1.484  1.00  0.00           H   new
ATOM      0  HB2 PHE A  11      10.971  -0.445   1.803  1.00  0.00           H   new
ATOM      0  HB3 PHE A  11      12.376  -1.250   1.132  1.00  0.00           H   new
ATOM      0  HD1 PHE A  11      11.998  -2.743  -0.991  1.00  0.00           H   new
ATOM      0  HD2 PHE A  11       9.166   0.177   0.417  1.00  0.00           H   new
ATOM      0  HE1 PHE A  11      10.998  -2.612  -3.263  1.00  0.00           H   new
ATOM      0  HE2 PHE A  11       8.190   0.332  -1.858  1.00  0.00           H   new
ATOM      0  HZ  PHE A  11       9.101  -1.065  -3.701  1.00  0.00           H   new
ATOM    201  N   ALA A  12      13.197  -3.158   2.975  1.00  0.00           N
ATOM    202  CA  ALA A  12      14.248  -3.336   3.988  1.00  0.00           C
ATOM    203  C   ALA A  12      14.647  -2.032   4.724  1.00  0.00           C
ATOM    204  O   ALA A  12      15.150  -2.085   5.850  1.00  0.00           O
ATOM    205  CB  ALA A  12      15.461  -3.973   3.297  1.00  0.00           C
ATOM      0  H   ALA A  12      13.504  -3.387   2.030  1.00  0.00           H   new
ATOM      0  HA  ALA A  12      13.854  -3.982   4.772  1.00  0.00           H   new
ATOM      0  HB1 ALA A  12      16.260  -4.118   4.025  1.00  0.00           H   new
ATOM      0  HB2 ALA A  12      15.175  -4.937   2.875  1.00  0.00           H   new
ATOM      0  HB3 ALA A  12      15.811  -3.318   2.500  1.00  0.00           H   new
ATOM    211  N   ASN A  13      14.399  -0.865   4.116  1.00  0.00           N
ATOM    212  CA  ASN A  13      14.596   0.463   4.718  1.00  0.00           C
ATOM    213  C   ASN A  13      13.441   0.920   5.649  1.00  0.00           C
ATOM    214  O   ASN A  13      13.523   2.005   6.233  1.00  0.00           O
ATOM    215  CB  ASN A  13      14.870   1.488   3.592  1.00  0.00           C
ATOM    216  CG  ASN A  13      13.722   1.663   2.607  1.00  0.00           C
ATOM    217  OD1 ASN A  13      12.588   1.282   2.889  1.00  0.00           O
ATOM    218  ND2 ASN A  13      13.990   2.266   1.461  1.00  0.00           N
ATOM      0  H   ASN A  13      14.044  -0.816   3.161  1.00  0.00           H   new
ATOM      0  HA  ASN A  13      15.459   0.396   5.380  1.00  0.00           H   new
ATOM      0  HB2 ASN A  13      15.095   2.454   4.044  1.00  0.00           H   new
ATOM      0  HB3 ASN A  13      15.759   1.178   3.043  1.00  0.00           H   new
ATOM      0 HD21 ASN A  13      13.245   2.426   0.783  1.00  0.00           H   new
ATOM      0 HD22 ASN A  13      14.941   2.571   1.255  1.00  0.00           H   new
ATOM    224  N   GLY A  14      12.366   0.131   5.783  1.00  0.00           N
ATOM    225  CA  GLY A  14      11.185   0.458   6.596  1.00  0.00           C
ATOM    226  C   GLY A  14      10.076   1.236   5.868  1.00  0.00           C
ATOM    227  O   GLY A  14       9.238   1.856   6.527  1.00  0.00           O
ATOM      0  H   GLY A  14      12.291  -0.774   5.318  1.00  0.00           H   new
ATOM      0  HA2 GLY A  14      10.762  -0.470   6.980  1.00  0.00           H   new
ATOM      0  HA3 GLY A  14      11.509   1.042   7.458  1.00  0.00           H   new
ATOM    231  N   THR A  15      10.037   1.208   4.531  1.00  0.00           N
ATOM    232  CA  THR A  15       9.018   1.889   3.707  1.00  0.00           C
ATOM    233  C   THR A  15       7.882   0.929   3.362  1.00  0.00           C
ATOM    234  O   THR A  15       8.130  -0.137   2.803  1.00  0.00           O
ATOM    235  CB  THR A  15       9.644   2.406   2.402  1.00  0.00           C
ATOM    236  OG1 THR A  15      10.712   3.282   2.674  1.00  0.00           O
ATOM    237  CG2 THR A  15       8.658   3.125   1.491  1.00  0.00           C
ATOM      0  H   THR A  15      10.726   0.702   3.975  1.00  0.00           H   new
ATOM      0  HA  THR A  15       8.625   2.727   4.282  1.00  0.00           H   new
ATOM      0  HB  THR A  15       9.992   1.515   1.880  1.00  0.00           H   new
ATOM      0  HG1 THR A  15      11.501   2.764   2.938  1.00  0.00           H   new
ATOM      0 HG21 THR A  15       9.173   3.461   0.591  1.00  0.00           H   new
ATOM      0 HG22 THR A  15       7.853   2.443   1.216  1.00  0.00           H   new
ATOM      0 HG23 THR A  15       8.241   3.986   2.013  1.00  0.00           H   new
ATOM    245  N   VAL A  16       6.633   1.302   3.651  1.00  0.00           N
ATOM    246  CA  VAL A  16       5.448   0.438   3.468  1.00  0.00           C
ATOM    247  C   VAL A  16       4.816   0.733   2.104  1.00  0.00           C
ATOM    248  O   VAL A  16       4.769   1.883   1.657  1.00  0.00           O
ATOM    249  CB  VAL A  16       4.431   0.684   4.605  1.00  0.00           C
ATOM    250  CG1 VAL A  16       3.049   0.053   4.372  1.00  0.00           C
ATOM    251  CG2 VAL A  16       4.964   0.119   5.928  1.00  0.00           C
ATOM      0  H   VAL A  16       6.406   2.224   4.024  1.00  0.00           H   new
ATOM      0  HA  VAL A  16       5.749  -0.609   3.502  1.00  0.00           H   new
ATOM      0  HB  VAL A  16       4.308   1.767   4.634  1.00  0.00           H   new
ATOM      0 HG11 VAL A  16       2.400   0.276   5.219  1.00  0.00           H   new
ATOM      0 HG12 VAL A  16       2.611   0.462   3.462  1.00  0.00           H   new
ATOM      0 HG13 VAL A  16       3.155  -1.027   4.270  1.00  0.00           H   new
ATOM      0 HG21 VAL A  16       4.237   0.300   6.720  1.00  0.00           H   new
ATOM      0 HG22 VAL A  16       5.130  -0.953   5.825  1.00  0.00           H   new
ATOM      0 HG23 VAL A  16       5.904   0.609   6.180  1.00  0.00           H   new
ATOM    261  N   TYR A  17       4.313  -0.316   1.449  1.00  0.00           N
ATOM    262  CA  TYR A  17       3.587  -0.235   0.177  1.00  0.00           C
ATOM    263  C   TYR A  17       2.500  -1.325   0.109  1.00  0.00           C
ATOM    264  O   TYR A  17       2.327  -2.128   1.032  1.00  0.00           O
ATOM    265  CB  TYR A  17       4.586  -0.339  -0.996  1.00  0.00           C
ATOM    266  CG  TYR A  17       5.331  -1.654  -1.173  1.00  0.00           C
ATOM    267  CD1 TYR A  17       6.474  -1.925  -0.394  1.00  0.00           C
ATOM    268  CD2 TYR A  17       4.941  -2.564  -2.181  1.00  0.00           C
ATOM    269  CE1 TYR A  17       7.249  -3.075  -0.645  1.00  0.00           C
ATOM    270  CE2 TYR A  17       5.714  -3.715  -2.434  1.00  0.00           C
ATOM    271  CZ  TYR A  17       6.879  -3.964  -1.678  1.00  0.00           C
ATOM    272  OH  TYR A  17       7.628  -5.071  -1.932  1.00  0.00           O
ATOM      0  H   TYR A  17       4.401  -1.271   1.797  1.00  0.00           H   new
ATOM      0  HA  TYR A  17       3.081   0.728   0.103  1.00  0.00           H   new
ATOM      0  HB2 TYR A  17       4.043  -0.134  -1.919  1.00  0.00           H   new
ATOM      0  HB3 TYR A  17       5.326   0.453  -0.878  1.00  0.00           H   new
ATOM      0  HD1 TYR A  17       6.757  -1.248   0.399  1.00  0.00           H   new
ATOM      0  HD2 TYR A  17       4.048  -2.377  -2.759  1.00  0.00           H   new
ATOM      0  HE1 TYR A  17       8.126  -3.276  -0.047  1.00  0.00           H   new
ATOM      0  HE2 TYR A  17       5.414  -4.407  -3.207  1.00  0.00           H   new
ATOM      0  HH  TYR A  17       7.230  -5.572  -2.674  1.00  0.00           H   new
ATOM    282  N   TYR A  18       1.766  -1.354  -0.999  1.00  0.00           N
ATOM    283  CA  TYR A  18       0.694  -2.303  -1.296  1.00  0.00           C
ATOM    284  C   TYR A  18       1.010  -3.090  -2.569  1.00  0.00           C
ATOM    285  O   TYR A  18       1.548  -2.538  -3.533  1.00  0.00           O
ATOM    286  CB  TYR A  18      -0.647  -1.560  -1.399  1.00  0.00           C
ATOM    287  CG  TYR A  18      -1.054  -0.838  -0.126  1.00  0.00           C
ATOM    288  CD1 TYR A  18      -1.845  -1.491   0.840  1.00  0.00           C
ATOM    289  CD2 TYR A  18      -0.628   0.488   0.094  1.00  0.00           C
ATOM    290  CE1 TYR A  18      -2.207  -0.822   2.025  1.00  0.00           C
ATOM    291  CE2 TYR A  18      -0.972   1.152   1.287  1.00  0.00           C
ATOM    292  CZ  TYR A  18      -1.765   0.499   2.254  1.00  0.00           C
ATOM    293  OH  TYR A  18      -2.104   1.148   3.401  1.00  0.00           O
ATOM      0  H   TYR A  18       1.909  -0.683  -1.754  1.00  0.00           H   new
ATOM      0  HA  TYR A  18       0.616  -3.025  -0.483  1.00  0.00           H   new
ATOM      0  HB2 TYR A  18      -0.588  -0.836  -2.212  1.00  0.00           H   new
ATOM      0  HB3 TYR A  18      -1.427  -2.274  -1.664  1.00  0.00           H   new
ATOM      0  HD1 TYR A  18      -2.174  -2.506   0.671  1.00  0.00           H   new
ATOM      0  HD2 TYR A  18      -0.037   0.995  -0.654  1.00  0.00           H   new
ATOM      0  HE1 TYR A  18      -2.823  -1.320   2.759  1.00  0.00           H   new
ATOM      0  HE2 TYR A  18      -0.629   2.161   1.462  1.00  0.00           H   new
ATOM      0  HH  TYR A  18      -1.715   2.047   3.395  1.00  0.00           H   new
ATOM    303  N   PHE A  19       0.668  -4.377  -2.586  1.00  0.00           N
ATOM    304  CA  PHE A  19       0.941  -5.297  -3.687  1.00  0.00           C
ATOM    305  C   PHE A  19      -0.236  -6.235  -3.971  1.00  0.00           C
ATOM    306  O   PHE A  19      -0.846  -6.765  -3.041  1.00  0.00           O
ATOM    307  CB  PHE A  19       2.230  -6.073  -3.404  1.00  0.00           C
ATOM    308  CG  PHE A  19       2.555  -7.091  -4.472  1.00  0.00           C
ATOM    309  CD1 PHE A  19       3.057  -6.629  -5.698  1.00  0.00           C
ATOM    310  CD2 PHE A  19       2.310  -8.465  -4.284  1.00  0.00           C
ATOM    311  CE1 PHE A  19       3.302  -7.525  -6.745  1.00  0.00           C
ATOM    312  CE2 PHE A  19       2.585  -9.370  -5.325  1.00  0.00           C
ATOM    313  CZ  PHE A  19       3.078  -8.901  -6.559  1.00  0.00           C
ATOM      0  H   PHE A  19       0.178  -4.821  -1.810  1.00  0.00           H   new
ATOM      0  HA  PHE A  19       1.078  -4.708  -4.594  1.00  0.00           H   new
ATOM      0  HB2 PHE A  19       3.058  -5.370  -3.316  1.00  0.00           H   new
ATOM      0  HB3 PHE A  19       2.139  -6.580  -2.443  1.00  0.00           H   new
ATOM      0  HD1 PHE A  19       3.255  -5.576  -5.835  1.00  0.00           H   new
ATOM      0  HD2 PHE A  19       1.913  -8.822  -3.345  1.00  0.00           H   new
ATOM      0  HE1 PHE A  19       3.663  -7.160  -7.695  1.00  0.00           H   new
ATOM      0  HE2 PHE A  19       2.418 -10.427  -5.178  1.00  0.00           H   new
ATOM      0  HZ  PHE A  19       3.283  -9.596  -7.360  1.00  0.00           H   new
ATOM    323  N   ASN A  20      -0.559  -6.450  -5.245  1.00  0.00           N
ATOM    324  CA  ASN A  20      -1.638  -7.332  -5.666  1.00  0.00           C
ATOM    325  C   ASN A  20      -1.083  -8.699  -6.102  1.00  0.00           C
ATOM    326  O   ASN A  20      -0.408  -8.800  -7.127  1.00  0.00           O
ATOM    327  CB  ASN A  20      -2.439  -6.631  -6.769  1.00  0.00           C
ATOM    328  CG  ASN A  20      -3.770  -7.324  -6.973  1.00  0.00           C
ATOM    329  OD1 ASN A  20      -3.837  -8.528  -7.160  1.00  0.00           O
ATOM    330  ND2 ASN A  20      -4.859  -6.597  -6.946  1.00  0.00           N
ATOM      0  H   ASN A  20      -0.069  -6.008  -6.023  1.00  0.00           H   new
ATOM      0  HA  ASN A  20      -2.313  -7.535  -4.835  1.00  0.00           H   new
ATOM      0  HB2 ASN A  20      -2.602  -5.587  -6.502  1.00  0.00           H   new
ATOM      0  HB3 ASN A  20      -1.872  -6.637  -7.700  1.00  0.00           H   new
ATOM      0 HD21 ASN A  20      -5.769  -7.037  -7.082  1.00  0.00           H   new
ATOM      0 HD22 ASN A  20      -4.797  -5.591  -6.789  1.00  0.00           H   new
ATOM    337  N   HIS A  21      -1.384  -9.766  -5.354  1.00  0.00           N
ATOM    338  CA  HIS A  21      -0.863 -11.113  -5.647  1.00  0.00           C
ATOM    339  C   HIS A  21      -1.562 -11.799  -6.839  1.00  0.00           C
ATOM    340  O   HIS A  21      -1.014 -12.740  -7.419  1.00  0.00           O
ATOM    341  CB  HIS A  21      -0.893 -11.970  -4.368  1.00  0.00           C
ATOM    342  CG  HIS A  21      -2.163 -12.754  -4.122  1.00  0.00           C
ATOM    343  ND1 HIS A  21      -2.359 -14.095  -4.471  1.00  0.00           N
ATOM    344  CD2 HIS A  21      -3.283 -12.301  -3.487  1.00  0.00           C
ATOM    345  CE1 HIS A  21      -3.588 -14.418  -4.030  1.00  0.00           C
ATOM    346  NE2 HIS A  21      -4.164 -13.359  -3.435  1.00  0.00           N
ATOM      0  H   HIS A  21      -1.990  -9.725  -4.535  1.00  0.00           H   new
ATOM      0  HA  HIS A  21       0.173 -11.004  -5.969  1.00  0.00           H   new
ATOM      0  HB2 HIS A  21      -0.059 -12.671  -4.405  1.00  0.00           H   new
ATOM      0  HB3 HIS A  21      -0.722 -11.316  -3.513  1.00  0.00           H   new
ATOM      0  HD2 HIS A  21      -3.447 -11.306  -3.100  1.00  0.00           H   new
ATOM      0  HE1 HIS A  21      -4.047 -15.390  -4.138  1.00  0.00           H   new
ATOM      0  HE2 HIS A  21      -5.094 -13.342  -3.017  1.00  0.00           H   new
ATOM    354  N   ILE A  22      -2.747 -11.316  -7.230  1.00  0.00           N
ATOM    355  CA  ILE A  22      -3.559 -11.827  -8.346  1.00  0.00           C
ATOM    356  C   ILE A  22      -3.110 -11.209  -9.682  1.00  0.00           C
ATOM    357  O   ILE A  22      -3.040 -11.903 -10.700  1.00  0.00           O
ATOM    358  CB  ILE A  22      -5.051 -11.514  -8.065  1.00  0.00           C
ATOM    359  CG1 ILE A  22      -5.537 -12.078  -6.704  1.00  0.00           C
ATOM    360  CG2 ILE A  22      -5.963 -11.982  -9.211  1.00  0.00           C
ATOM    361  CD1 ILE A  22      -5.681 -13.601  -6.634  1.00  0.00           C
ATOM      0  H   ILE A  22      -3.187 -10.525  -6.759  1.00  0.00           H   new
ATOM      0  HA  ILE A  22      -3.424 -12.906  -8.427  1.00  0.00           H   new
ATOM      0  HB  ILE A  22      -5.121 -10.428  -8.003  1.00  0.00           H   new
ATOM      0 HG12 ILE A  22      -4.839 -11.761  -5.929  1.00  0.00           H   new
ATOM      0 HG13 ILE A  22      -6.501 -11.628  -6.468  1.00  0.00           H   new
ATOM      0 HG21 ILE A  22      -6.999 -11.743  -8.972  1.00  0.00           H   new
ATOM      0 HG22 ILE A  22      -5.677 -11.476 -10.133  1.00  0.00           H   new
ATOM      0 HG23 ILE A  22      -5.860 -13.059  -9.341  1.00  0.00           H   new
ATOM      0 HD11 ILE A  22      -6.026 -13.889  -5.641  1.00  0.00           H   new
ATOM      0 HD12 ILE A  22      -6.404 -13.933  -7.379  1.00  0.00           H   new
ATOM      0 HD13 ILE A  22      -4.716 -14.067  -6.832  1.00  0.00           H   new
ATOM    373  N   THR A  23      -2.789  -9.911  -9.676  1.00  0.00           N
ATOM    374  CA  THR A  23      -2.491  -9.087 -10.869  1.00  0.00           C
ATOM    375  C   THR A  23      -1.040  -8.623 -11.033  1.00  0.00           C
ATOM    376  O   THR A  23      -0.678  -8.086 -12.082  1.00  0.00           O
ATOM    377  CB  THR A  23      -3.458  -7.895 -10.978  1.00  0.00           C
ATOM    378  OG1 THR A  23      -3.048  -6.875 -10.097  1.00  0.00           O
ATOM    379  CG2 THR A  23      -4.912  -8.205 -10.630  1.00  0.00           C
ATOM      0  H   THR A  23      -2.725  -9.377  -8.809  1.00  0.00           H   new
ATOM      0  HA  THR A  23      -2.646  -9.776 -11.700  1.00  0.00           H   new
ATOM      0  HB  THR A  23      -3.421  -7.607 -12.029  1.00  0.00           H   new
ATOM      0  HG1 THR A  23      -3.663  -6.115 -10.168  1.00  0.00           H   new
ATOM      0 HG21 THR A  23      -5.512  -7.302 -10.737  1.00  0.00           H   new
ATOM      0 HG22 THR A  23      -5.291  -8.975 -11.302  1.00  0.00           H   new
ATOM      0 HG23 THR A  23      -4.972  -8.560  -9.601  1.00  0.00           H   new
ATOM    387  N   ASN A  24      -0.203  -8.829 -10.011  1.00  0.00           N
ATOM    388  CA  ASN A  24       1.175  -8.330  -9.887  1.00  0.00           C
ATOM    389  C   ASN A  24       1.321  -6.789  -9.888  1.00  0.00           C
ATOM    390  O   ASN A  24       2.437  -6.276 -10.020  1.00  0.00           O
ATOM    391  CB  ASN A  24       2.115  -9.062 -10.869  1.00  0.00           C
ATOM    392  CG  ASN A  24       2.110 -10.570 -10.669  1.00  0.00           C
ATOM    393  OD1 ASN A  24       2.482 -11.085  -9.623  1.00  0.00           O
ATOM    394  ND2 ASN A  24       1.734 -11.330 -11.674  1.00  0.00           N
ATOM      0  H   ASN A  24      -0.483  -9.380  -9.200  1.00  0.00           H   new
ATOM      0  HA  ASN A  24       1.502  -8.585  -8.879  1.00  0.00           H   new
ATOM      0  HB2 ASN A  24       1.815  -8.834 -11.892  1.00  0.00           H   new
ATOM      0  HB3 ASN A  24       3.130  -8.686 -10.743  1.00  0.00           H   new
ATOM      0 HD21 ASN A  24       1.753 -12.346 -11.580  1.00  0.00           H   new
ATOM      0 HD22 ASN A  24       1.423 -10.904 -12.547  1.00  0.00           H   new
ATOM    401  N   ALA A  25       0.225  -6.035  -9.726  1.00  0.00           N
ATOM    402  CA  ALA A  25       0.264  -4.580  -9.545  1.00  0.00           C
ATOM    403  C   ALA A  25       0.877  -4.165  -8.185  1.00  0.00           C
ATOM    404  O   ALA A  25       0.839  -4.925  -7.215  1.00  0.00           O
ATOM    405  CB  ALA A  25      -1.157  -4.029  -9.716  1.00  0.00           C
ATOM      0  H   ALA A  25      -0.719  -6.421  -9.717  1.00  0.00           H   new
ATOM      0  HA  ALA A  25       0.920  -4.151 -10.302  1.00  0.00           H   new
ATOM      0  HB1 ALA A  25      -1.146  -2.947  -9.584  1.00  0.00           H   new
ATOM      0  HB2 ALA A  25      -1.523  -4.269 -10.714  1.00  0.00           H   new
ATOM      0  HB3 ALA A  25      -1.814  -4.478  -8.971  1.00  0.00           H   new
ATOM    411  N   SER A  26       1.405  -2.941  -8.096  1.00  0.00           N
ATOM    412  CA  SER A  26       1.967  -2.348  -6.866  1.00  0.00           C
ATOM    413  C   SER A  26       1.646  -0.853  -6.735  1.00  0.00           C
ATOM    414  O   SER A  26       1.607  -0.139  -7.740  1.00  0.00           O
ATOM    415  CB  SER A  26       3.486  -2.560  -6.771  1.00  0.00           C
ATOM    416  OG  SER A  26       4.168  -2.106  -7.934  1.00  0.00           O
ATOM      0  H   SER A  26       1.458  -2.312  -8.897  1.00  0.00           H   new
ATOM      0  HA  SER A  26       1.487  -2.872  -6.040  1.00  0.00           H   new
ATOM      0  HB2 SER A  26       3.870  -2.033  -5.898  1.00  0.00           H   new
ATOM      0  HB3 SER A  26       3.694  -3.619  -6.621  1.00  0.00           H   new
ATOM      0  HG  SER A  26       5.130  -2.259  -7.829  1.00  0.00           H   new
ATOM    422  N   GLN A  27       1.468  -0.365  -5.503  1.00  0.00           N
ATOM    423  CA  GLN A  27       1.224   1.051  -5.187  1.00  0.00           C
ATOM    424  C   GLN A  27       1.847   1.504  -3.860  1.00  0.00           C
ATOM    425  O   GLN A  27       1.794   0.787  -2.862  1.00  0.00           O
ATOM    426  CB  GLN A  27      -0.286   1.349  -5.108  1.00  0.00           C
ATOM    427  CG  GLN A  27      -0.989   1.441  -6.466  1.00  0.00           C
ATOM    428  CD  GLN A  27      -2.454   1.889  -6.398  1.00  0.00           C
ATOM    429  OE1 GLN A  27      -3.179   1.833  -7.384  1.00  0.00           O
ATOM    430  NE2 GLN A  27      -2.948   2.428  -5.300  1.00  0.00           N
ATOM      0  H   GLN A  27       1.490  -0.958  -4.674  1.00  0.00           H   new
ATOM      0  HA  GLN A  27       1.697   1.601  -6.001  1.00  0.00           H   new
ATOM      0  HB2 GLN A  27      -0.767   0.569  -4.517  1.00  0.00           H   new
ATOM      0  HB3 GLN A  27      -0.430   2.288  -4.574  1.00  0.00           H   new
ATOM      0  HG2 GLN A  27      -0.439   2.138  -7.099  1.00  0.00           H   new
ATOM      0  HG3 GLN A  27      -0.943   0.466  -6.951  1.00  0.00           H   new
ATOM      0 HE21 GLN A  27      -2.373   2.491  -4.460  1.00  0.00           H   new
ATOM      0 HE22 GLN A  27      -3.905   2.781  -5.291  1.00  0.00           H   new
ATOM    439  N   PHE A  28       2.371   2.732  -3.831  1.00  0.00           N
ATOM    440  CA  PHE A  28       2.798   3.403  -2.595  1.00  0.00           C
ATOM    441  C   PHE A  28       1.656   3.991  -1.743  1.00  0.00           C
ATOM    442  O   PHE A  28       1.818   4.244  -0.548  1.00  0.00           O
ATOM    443  CB  PHE A  28       3.918   4.414  -2.877  1.00  0.00           C
ATOM    444  CG  PHE A  28       5.281   3.786  -3.117  1.00  0.00           C
ATOM    445  CD1 PHE A  28       6.139   3.521  -2.032  1.00  0.00           C
ATOM    446  CD2 PHE A  28       5.698   3.479  -4.428  1.00  0.00           C
ATOM    447  CE1 PHE A  28       7.412   2.966  -2.259  1.00  0.00           C
ATOM    448  CE2 PHE A  28       6.968   2.916  -4.652  1.00  0.00           C
ATOM    449  CZ  PHE A  28       7.826   2.662  -3.568  1.00  0.00           C
ATOM      0  H   PHE A  28       2.513   3.295  -4.670  1.00  0.00           H   new
ATOM      0  HA  PHE A  28       3.205   2.617  -1.959  1.00  0.00           H   new
ATOM      0  HB2 PHE A  28       3.645   5.007  -3.750  1.00  0.00           H   new
ATOM      0  HB3 PHE A  28       3.991   5.102  -2.035  1.00  0.00           H   new
ATOM      0  HD1 PHE A  28       5.820   3.744  -1.025  1.00  0.00           H   new
ATOM      0  HD2 PHE A  28       5.041   3.676  -5.262  1.00  0.00           H   new
ATOM      0  HE1 PHE A  28       8.072   2.773  -1.426  1.00  0.00           H   new
ATOM      0  HE2 PHE A  28       7.284   2.679  -5.657  1.00  0.00           H   new
ATOM      0  HZ  PHE A  28       8.802   2.234  -3.740  1.00  0.00           H   new
ATOM    459  N   GLU A  29       0.489   4.192  -2.369  1.00  0.00           N
ATOM    460  CA  GLU A  29      -0.757   4.682  -1.762  1.00  0.00           C
ATOM    461  C   GLU A  29      -1.831   3.582  -1.687  1.00  0.00           C
ATOM    462  O   GLU A  29      -1.902   2.707  -2.558  1.00  0.00           O
ATOM    463  CB  GLU A  29      -1.227   5.937  -2.530  1.00  0.00           C
ATOM    464  CG  GLU A  29      -2.656   6.461  -2.282  1.00  0.00           C
ATOM    465  CD  GLU A  29      -2.986   6.887  -0.834  1.00  0.00           C
ATOM    466  OE1 GLU A  29      -3.986   7.622  -0.644  1.00  0.00           O
ATOM    467  OE2 GLU A  29      -2.282   6.487   0.123  1.00  0.00           O
ATOM      0  H   GLU A  29       0.382   4.007  -3.366  1.00  0.00           H   new
ATOM      0  HA  GLU A  29      -0.571   4.965  -0.726  1.00  0.00           H   new
ATOM      0  HB2 GLU A  29      -0.533   6.745  -2.300  1.00  0.00           H   new
ATOM      0  HB3 GLU A  29      -1.131   5.729  -3.596  1.00  0.00           H   new
ATOM      0  HG2 GLU A  29      -2.826   7.315  -2.937  1.00  0.00           H   new
ATOM      0  HG3 GLU A  29      -3.362   5.685  -2.580  1.00  0.00           H   new
ATOM    474  N   ARG A  30      -2.682   3.635  -0.654  1.00  0.00           N
ATOM    475  CA  ARG A  30      -3.716   2.631  -0.352  1.00  0.00           C
ATOM    476  C   ARG A  30      -4.687   2.421  -1.542  1.00  0.00           C
ATOM    477  O   ARG A  30      -5.307   3.393  -1.988  1.00  0.00           O
ATOM    478  CB  ARG A  30      -4.388   3.023   0.980  1.00  0.00           C
ATOM    479  CG  ARG A  30      -5.508   2.075   1.435  1.00  0.00           C
ATOM    480  CD  ARG A  30      -6.896   2.560   0.986  1.00  0.00           C
ATOM    481  NE  ARG A  30      -7.737   1.455   0.504  1.00  0.00           N
ATOM    482  CZ  ARG A  30      -8.404   0.562   1.204  1.00  0.00           C
ATOM    483  NH1 ARG A  30      -8.377   0.501   2.504  1.00  0.00           N
ATOM    484  NH2 ARG A  30      -9.124  -0.324   0.589  1.00  0.00           N
ATOM      0  H   ARG A  30      -2.671   4.402   0.018  1.00  0.00           H   new
ATOM      0  HA  ARG A  30      -3.273   1.644  -0.217  1.00  0.00           H   new
ATOM      0  HB2 ARG A  30      -3.626   3.063   1.758  1.00  0.00           H   new
ATOM      0  HB3 ARG A  30      -4.798   4.028   0.883  1.00  0.00           H   new
ATOM      0  HG2 ARG A  30      -5.325   1.079   1.032  1.00  0.00           H   new
ATOM      0  HG3 ARG A  30      -5.489   1.988   2.521  1.00  0.00           H   new
ATOM      0  HD2 ARG A  30      -7.393   3.057   1.819  1.00  0.00           H   new
ATOM      0  HD3 ARG A  30      -6.782   3.301   0.195  1.00  0.00           H   new
ATOM      0  HE  ARG A  30      -7.814   1.369  -0.509  1.00  0.00           H   new
ATOM      0 HH11 ARG A  30      -7.817   1.169   3.034  1.00  0.00           H   new
ATOM      0 HH12 ARG A  30      -8.916  -0.214   2.992  1.00  0.00           H   new
ATOM      0 HH21 ARG A  30      -9.170  -0.325  -0.430  1.00  0.00           H   new
ATOM      0 HH22 ARG A  30      -9.644  -1.019   1.124  1.00  0.00           H   new
ATOM    498  N   PRO A  31      -4.824   1.191  -2.081  1.00  0.00           N
ATOM    499  CA  PRO A  31      -5.540   0.911  -3.333  1.00  0.00           C
ATOM    500  C   PRO A  31      -7.071   0.917  -3.203  1.00  0.00           C
ATOM    501  O   PRO A  31      -7.626   0.588  -2.153  1.00  0.00           O
ATOM    502  CB  PRO A  31      -5.021  -0.457  -3.796  1.00  0.00           C
ATOM    503  CG  PRO A  31      -4.704  -1.154  -2.477  1.00  0.00           C
ATOM    504  CD  PRO A  31      -4.157  -0.019  -1.623  1.00  0.00           C
ATOM      0  HA  PRO A  31      -5.346   1.704  -4.055  1.00  0.00           H   new
ATOM      0  HB2 PRO A  31      -5.769  -1.001  -4.373  1.00  0.00           H   new
ATOM      0  HB3 PRO A  31      -4.138  -0.363  -4.428  1.00  0.00           H   new
ATOM      0  HG2 PRO A  31      -5.592  -1.604  -2.033  1.00  0.00           H   new
ATOM      0  HG3 PRO A  31      -3.973  -1.952  -2.606  1.00  0.00           H   new
ATOM      0  HD2 PRO A  31      -4.355  -0.197  -0.566  1.00  0.00           H   new
ATOM      0  HD3 PRO A  31      -3.076   0.066  -1.735  1.00  0.00           H   new