USER  MOD reduce.3.24.130724 H: found=0, std=0, add=262, rem=0, adj=8
USER  MOD reduce.3.24.130724 removed 262 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  10 LYS NZ  :NH3+    171:sc= -0.0588   (180deg=-0.377)
USER  MOD Set 1.2: A  13 ASN     :      amide:sc=  -0.125  K(o=-0.18,f=-2.2!)
USER  MOD Single : A   1 GLU N   :NH3+   -147:sc=    -1.3   (180deg=-3.04!)
USER  MOD Single : A   4 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A   6 MET CE  :methyl -128:sc=    -5.8!  (180deg=-12.8!)
USER  MOD Single : A   8 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  11 ASN     :      amide:sc=       0  X(o=0,f=0.16)
USER  MOD Single : A  12 SER OG  :   rot   75:sc=   0.331
USER  MOD Single : A  17 LYS NZ  :NH3+    155:sc= -0.0064   (180deg=-0.0723)
USER  MOD Single : A  22 SER OG  :   rot  142:sc=  -0.645
USER  MOD Single : A  23 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  26 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  32 SER OG  :   rot -115:sc=   0.983
USER  MOD -----------------------------------------------------------------
ATOM      1  N   GLU A   1      -8.964   4.128  -3.029  1.00  0.00           N
ATOM      2  CA  GLU A   1      -8.666   5.365  -2.249  1.00  0.00           C
ATOM      3  C   GLU A   1      -7.476   5.130  -1.320  1.00  0.00           C
ATOM      4  O   GLU A   1      -6.829   4.103  -1.373  1.00  0.00           O
ATOM      5  CB  GLU A   1      -9.927   5.637  -1.425  1.00  0.00           C
ATOM      6  CG  GLU A   1     -11.169   5.431  -2.294  1.00  0.00           C
ATOM      7  CD  GLU A   1     -11.996   6.719  -2.321  1.00  0.00           C
ATOM      8  OE1 GLU A   1     -12.414   7.152  -1.259  1.00  0.00           O
ATOM      9  OE2 GLU A   1     -12.197   7.248  -3.401  1.00  0.00           O
ATOM      0  H1  GLU A   1      -9.323   4.389  -3.970  1.00  0.00           H   new
ATOM      0  H2  GLU A   1      -8.095   3.566  -3.133  1.00  0.00           H   new
ATOM      0  H3  GLU A   1      -9.682   3.566  -2.528  1.00  0.00           H   new
ATOM      0  HA  GLU A   1      -8.411   6.203  -2.898  1.00  0.00           H   new
ATOM      0  HB2 GLU A   1      -9.960   4.970  -0.563  1.00  0.00           H   new
ATOM      0  HB3 GLU A   1      -9.907   6.656  -1.039  1.00  0.00           H   new
ATOM      0  HG2 GLU A   1     -10.875   5.154  -3.306  1.00  0.00           H   new
ATOM      0  HG3 GLU A   1     -11.768   4.610  -1.901  1.00  0.00           H   new
ATOM     18  N   CYS A   2      -7.190   6.068  -0.463  1.00  0.00           N
ATOM     19  CA  CYS A   2      -6.049   5.889   0.474  1.00  0.00           C
ATOM     20  C   CYS A   2      -6.428   4.877   1.561  1.00  0.00           C
ATOM     21  O   CYS A   2      -7.170   5.180   2.474  1.00  0.00           O
ATOM     22  CB  CYS A   2      -5.809   7.271   1.081  1.00  0.00           C
ATOM     23  SG  CYS A   2      -4.085   7.404   1.608  1.00  0.00           S
ATOM      0  H   CYS A   2      -7.696   6.949  -0.371  1.00  0.00           H   new
ATOM      0  HA  CYS A   2      -5.156   5.509  -0.022  1.00  0.00           H   new
ATOM      0  HB2 CYS A   2      -6.038   8.046   0.350  1.00  0.00           H   new
ATOM      0  HB3 CYS A   2      -6.474   7.428   1.931  1.00  0.00           H   new
ATOM     28  N   GLY A   3      -5.926   3.677   1.465  1.00  0.00           N
ATOM     29  CA  GLY A   3      -6.260   2.646   2.488  1.00  0.00           C
ATOM     30  C   GLY A   3      -5.103   2.513   3.480  1.00  0.00           C
ATOM     31  O   GLY A   3      -4.024   3.027   3.263  1.00  0.00           O
ATOM      0  H   GLY A   3      -5.299   3.366   0.723  1.00  0.00           H   new
ATOM      0  HA2 GLY A   3      -7.173   2.924   3.014  1.00  0.00           H   new
ATOM      0  HA3 GLY A   3      -6.450   1.688   2.005  1.00  0.00           H   new
ATOM     35  N   LYS A   4      -5.321   1.829   4.568  1.00  0.00           N
ATOM     36  CA  LYS A   4      -4.237   1.661   5.579  1.00  0.00           C
ATOM     37  C   LYS A   4      -3.434   0.388   5.296  1.00  0.00           C
ATOM     38  O   LYS A   4      -3.945  -0.564   4.743  1.00  0.00           O
ATOM     39  CB  LYS A   4      -4.967   1.541   6.917  1.00  0.00           C
ATOM     40  CG  LYS A   4      -5.023   2.910   7.597  1.00  0.00           C
ATOM     41  CD  LYS A   4      -3.607   3.350   7.973  1.00  0.00           C
ATOM     42  CE  LYS A   4      -3.215   4.565   7.131  1.00  0.00           C
ATOM     43  NZ  LYS A   4      -1.749   4.726   7.347  1.00  0.00           N
ATOM      0  H   LYS A   4      -6.205   1.377   4.802  1.00  0.00           H   new
ATOM      0  HA  LYS A   4      -3.530   2.490   5.566  1.00  0.00           H   new
ATOM      0  HB2 LYS A   4      -5.976   1.161   6.759  1.00  0.00           H   new
ATOM      0  HB3 LYS A   4      -4.454   0.826   7.560  1.00  0.00           H   new
ATOM      0  HG2 LYS A   4      -5.477   3.642   6.929  1.00  0.00           H   new
ATOM      0  HG3 LYS A   4      -5.649   2.860   8.488  1.00  0.00           H   new
ATOM      0  HD2 LYS A   4      -3.560   3.598   9.033  1.00  0.00           H   new
ATOM      0  HD3 LYS A   4      -2.904   2.534   7.805  1.00  0.00           H   new
ATOM      0  HE2 LYS A   4      -3.444   4.406   6.077  1.00  0.00           H   new
ATOM      0  HE3 LYS A   4      -3.760   5.455   7.444  1.00  0.00           H   new
ATOM      0  HZ1 LYS A   4      -1.405   5.541   6.801  1.00  0.00           H   new
ATOM      0  HZ2 LYS A   4      -1.562   4.883   8.358  1.00  0.00           H   new
ATOM      0  HZ3 LYS A   4      -1.255   3.866   7.033  1.00  0.00           H   new
ATOM     57  N   PHE A   5      -2.180   0.365   5.675  1.00  0.00           N
ATOM     58  CA  PHE A   5      -1.346  -0.846   5.435  1.00  0.00           C
ATOM     59  C   PHE A   5      -2.169  -2.103   5.704  1.00  0.00           C
ATOM     60  O   PHE A   5      -3.063  -2.103   6.523  1.00  0.00           O
ATOM     61  CB  PHE A   5      -0.189  -0.744   6.430  1.00  0.00           C
ATOM     62  CG  PHE A   5       0.775  -1.896   6.225  1.00  0.00           C
ATOM     63  CD1 PHE A   5       1.552  -1.968   5.061  1.00  0.00           C
ATOM     64  CD2 PHE A   5       0.904  -2.882   7.211  1.00  0.00           C
ATOM     65  CE1 PHE A   5       2.457  -3.024   4.889  1.00  0.00           C
ATOM     66  CE2 PHE A   5       1.805  -3.938   7.033  1.00  0.00           C
ATOM     67  CZ  PHE A   5       2.582  -4.007   5.873  1.00  0.00           C
ATOM      0  H   PHE A   5      -1.700   1.135   6.141  1.00  0.00           H   new
ATOM      0  HA  PHE A   5      -0.989  -0.904   4.407  1.00  0.00           H   new
ATOM      0  HB2 PHE A   5       0.332   0.204   6.299  1.00  0.00           H   new
ATOM      0  HB3 PHE A   5      -0.573  -0.758   7.450  1.00  0.00           H   new
ATOM      0  HD1 PHE A   5       1.453  -1.211   4.297  1.00  0.00           H   new
ATOM      0  HD2 PHE A   5       0.308  -2.827   8.110  1.00  0.00           H   new
ATOM      0  HE1 PHE A   5       3.059  -3.078   3.994  1.00  0.00           H   new
ATOM      0  HE2 PHE A   5       1.900  -4.700   7.792  1.00  0.00           H   new
ATOM      0  HZ  PHE A   5       3.279  -4.821   5.738  1.00  0.00           H   new
ATOM     77  N   MET A   6      -1.874  -3.165   5.006  1.00  0.00           N
ATOM     78  CA  MET A   6      -2.626  -4.443   5.187  1.00  0.00           C
ATOM     79  C   MET A   6      -3.983  -4.373   4.487  1.00  0.00           C
ATOM     80  O   MET A   6      -4.676  -5.364   4.368  1.00  0.00           O
ATOM     81  CB  MET A   6      -2.811  -4.638   6.695  1.00  0.00           C
ATOM     82  CG  MET A   6      -1.515  -4.283   7.423  1.00  0.00           C
ATOM     83  SD  MET A   6      -1.417  -5.211   8.972  1.00  0.00           S
ATOM     84  CE  MET A   6      -0.017  -6.262   8.513  1.00  0.00           C
ATOM      0  H   MET A   6      -1.132  -3.203   4.307  1.00  0.00           H   new
ATOM      0  HA  MET A   6      -2.080  -5.279   4.749  1.00  0.00           H   new
ATOM      0  HB2 MET A   6      -3.626  -4.010   7.055  1.00  0.00           H   new
ATOM      0  HB3 MET A   6      -3.087  -5.671   6.907  1.00  0.00           H   new
ATOM      0  HG2 MET A   6      -0.656  -4.515   6.793  1.00  0.00           H   new
ATOM      0  HG3 MET A   6      -1.481  -3.213   7.626  1.00  0.00           H   new
ATOM      0  HE1 MET A   6      -0.274  -7.307   8.688  1.00  0.00           H   new
ATOM      0  HE2 MET A   6       0.216  -6.118   7.458  1.00  0.00           H   new
ATOM      0  HE3 MET A   6       0.851  -5.996   9.116  1.00  0.00           H   new
ATOM     94  N   TRP A   7      -4.372  -3.222   4.015  1.00  0.00           N
ATOM     95  CA  TRP A   7      -5.685  -3.121   3.322  1.00  0.00           C
ATOM     96  C   TRP A   7      -5.674  -3.986   2.061  1.00  0.00           C
ATOM     97  O   TRP A   7      -4.804  -3.860   1.219  1.00  0.00           O
ATOM     98  CB  TRP A   7      -5.843  -1.650   2.943  1.00  0.00           C
ATOM     99  CG  TRP A   7      -6.676  -0.950   3.963  1.00  0.00           C
ATOM    100  CD1 TRP A   7      -6.542  -1.066   5.305  1.00  0.00           C
ATOM    101  CD2 TRP A   7      -7.766  -0.022   3.739  1.00  0.00           C
ATOM    102  NE1 TRP A   7      -7.496  -0.266   5.913  1.00  0.00           N
ATOM    103  CE2 TRP A   7      -8.270   0.395   4.989  1.00  0.00           C
ATOM    104  CE3 TRP A   7      -8.358   0.489   2.578  1.00  0.00           C
ATOM    105  CZ2 TRP A   7      -9.327   1.289   5.088  1.00  0.00           C
ATOM    106  CZ3 TRP A   7      -9.428   1.395   2.666  1.00  0.00           C
ATOM    107  CH2 TRP A   7      -9.913   1.796   3.922  1.00  0.00           C
ATOM      0  H   TRP A   7      -3.842  -2.353   4.078  1.00  0.00           H   new
ATOM      0  HA  TRP A   7      -6.504  -3.464   3.954  1.00  0.00           H   new
ATOM      0  HB2 TRP A   7      -4.864  -1.176   2.873  1.00  0.00           H   new
ATOM      0  HB3 TRP A   7      -6.308  -1.566   1.961  1.00  0.00           H   new
ATOM      0  HD1 TRP A   7      -5.814  -1.679   5.816  1.00  0.00           H   new
ATOM      0  HE1 TRP A   7      -7.610  -0.178   6.923  1.00  0.00           H   new
ATOM      0  HE3 TRP A   7      -7.990   0.185   1.609  1.00  0.00           H   new
ATOM      0  HZ2 TRP A   7      -9.695   1.591   6.057  1.00  0.00           H   new
ATOM      0  HZ3 TRP A   7      -9.879   1.784   1.765  1.00  0.00           H   new
ATOM      0  HH2 TRP A   7     -10.735   2.493   3.988  1.00  0.00           H   new
ATOM    118  N   LYS A   8      -6.639  -4.852   1.920  1.00  0.00           N
ATOM    119  CA  LYS A   8      -6.693  -5.713   0.706  1.00  0.00           C
ATOM    120  C   LYS A   8      -6.638  -4.824  -0.535  1.00  0.00           C
ATOM    121  O   LYS A   8      -7.112  -3.705  -0.526  1.00  0.00           O
ATOM    122  CB  LYS A   8      -8.033  -6.448   0.795  1.00  0.00           C
ATOM    123  CG  LYS A   8      -7.792  -7.896   1.229  1.00  0.00           C
ATOM    124  CD  LYS A   8      -7.391  -8.735   0.013  1.00  0.00           C
ATOM    125  CE  LYS A   8      -6.259  -9.686   0.402  1.00  0.00           C
ATOM    126  NZ  LYS A   8      -6.816 -11.052   0.195  1.00  0.00           N
ATOM      0  H   LYS A   8      -7.392  -5.000   2.592  1.00  0.00           H   new
ATOM      0  HA  LYS A   8      -5.863  -6.416   0.643  1.00  0.00           H   new
ATOM      0  HB2 LYS A   8      -8.688  -5.947   1.508  1.00  0.00           H   new
ATOM      0  HB3 LYS A   8      -8.537  -6.426  -0.171  1.00  0.00           H   new
ATOM      0  HG2 LYS A   8      -7.008  -7.934   1.985  1.00  0.00           H   new
ATOM      0  HG3 LYS A   8      -8.694  -8.305   1.685  1.00  0.00           H   new
ATOM      0  HD2 LYS A   8      -8.248  -9.302  -0.350  1.00  0.00           H   new
ATOM      0  HD3 LYS A   8      -7.071  -8.085  -0.801  1.00  0.00           H   new
ATOM      0  HE2 LYS A   8      -5.376  -9.522  -0.215  1.00  0.00           H   new
ATOM      0  HE3 LYS A   8      -5.956  -9.536   1.438  1.00  0.00           H   new
ATOM      0  HZ1 LYS A   8      -6.096 -11.761   0.441  1.00  0.00           H   new
ATOM      0  HZ2 LYS A   8      -7.652 -11.182   0.801  1.00  0.00           H   new
ATOM      0  HZ3 LYS A   8      -7.089 -11.168  -0.802  1.00  0.00           H   new
ATOM    140  N   CYS A   9      -6.043  -5.289  -1.593  1.00  0.00           N
ATOM    141  CA  CYS A   9      -5.944  -4.441  -2.808  1.00  0.00           C
ATOM    142  C   CYS A   9      -6.169  -5.261  -4.076  1.00  0.00           C
ATOM    143  O   CYS A   9      -6.366  -6.459  -4.036  1.00  0.00           O
ATOM    144  CB  CYS A   9      -4.516  -3.912  -2.776  1.00  0.00           C
ATOM    145  SG  CYS A   9      -3.374  -5.298  -2.538  1.00  0.00           S
ATOM      0  H   CYS A   9      -5.623  -6.215  -1.670  1.00  0.00           H   new
ATOM      0  HA  CYS A   9      -6.695  -3.651  -2.817  1.00  0.00           H   new
ATOM      0  HB2 CYS A   9      -4.287  -3.392  -3.706  1.00  0.00           H   new
ATOM      0  HB3 CYS A   9      -4.401  -3.188  -1.969  1.00  0.00           H   new
ATOM    150  N   LYS A  10      -6.128  -4.611  -5.203  1.00  0.00           N
ATOM    151  CA  LYS A  10      -6.323  -5.322  -6.496  1.00  0.00           C
ATOM    152  C   LYS A  10      -5.086  -5.134  -7.370  1.00  0.00           C
ATOM    153  O   LYS A  10      -4.739  -5.978  -8.173  1.00  0.00           O
ATOM    154  CB  LYS A  10      -7.525  -4.640  -7.141  1.00  0.00           C
ATOM    155  CG  LYS A  10      -7.158  -3.198  -7.505  1.00  0.00           C
ATOM    156  CD  LYS A  10      -8.426  -2.347  -7.565  1.00  0.00           C
ATOM    157  CE  LYS A  10      -8.406  -1.487  -8.828  1.00  0.00           C
ATOM    158  NZ  LYS A  10      -9.141  -0.247  -8.456  1.00  0.00           N
ATOM      0  H   LYS A  10      -5.966  -3.607  -5.285  1.00  0.00           H   new
ATOM      0  HA  LYS A  10      -6.480  -6.393  -6.366  1.00  0.00           H   new
ATOM      0  HB2 LYS A  10      -7.831  -5.185  -8.034  1.00  0.00           H   new
ATOM      0  HB3 LYS A  10      -8.373  -4.649  -6.456  1.00  0.00           H   new
ATOM      0  HG2 LYS A  10      -6.468  -2.790  -6.766  1.00  0.00           H   new
ATOM      0  HG3 LYS A  10      -6.646  -3.174  -8.467  1.00  0.00           H   new
ATOM      0  HD2 LYS A  10      -9.307  -2.989  -7.563  1.00  0.00           H   new
ATOM      0  HD3 LYS A  10      -8.492  -1.712  -6.681  1.00  0.00           H   new
ATOM      0  HE2 LYS A  10      -7.385  -1.264  -9.138  1.00  0.00           H   new
ATOM      0  HE3 LYS A  10      -8.888  -1.997  -9.662  1.00  0.00           H   new
ATOM      0  HZ1 LYS A  10      -9.041   0.457  -9.215  1.00  0.00           H   new
ATOM      0  HZ2 LYS A  10     -10.148  -0.468  -8.319  1.00  0.00           H   new
ATOM      0  HZ3 LYS A  10      -8.748   0.138  -7.573  1.00  0.00           H   new
ATOM    172  N   ASN A  11      -4.421  -4.024  -7.215  1.00  0.00           N
ATOM    173  CA  ASN A  11      -3.202  -3.758  -8.028  1.00  0.00           C
ATOM    174  C   ASN A  11      -2.427  -2.572  -7.450  1.00  0.00           C
ATOM    175  O   ASN A  11      -1.212  -2.568  -7.425  1.00  0.00           O
ATOM    176  CB  ASN A  11      -3.723  -3.424  -9.428  1.00  0.00           C
ATOM    177  CG  ASN A  11      -2.975  -4.265 -10.463  1.00  0.00           C
ATOM    178  OD1 ASN A  11      -3.344  -5.390 -10.733  1.00  0.00           O
ATOM    179  ND2 ASN A  11      -1.930  -3.762 -11.062  1.00  0.00           N
ATOM      0  H   ASN A  11      -4.671  -3.286  -6.557  1.00  0.00           H   new
ATOM      0  HA  ASN A  11      -2.521  -4.609  -8.037  1.00  0.00           H   new
ATOM      0  HB2 ASN A  11      -4.793  -3.623  -9.487  1.00  0.00           H   new
ATOM      0  HB3 ASN A  11      -3.584  -2.363  -9.636  1.00  0.00           H   new
ATOM      0 HD21 ASN A  11      -1.425  -4.314 -11.756  1.00  0.00           H   new
ATOM      0 HD22 ASN A  11      -1.619  -2.817 -10.837  1.00  0.00           H   new
ATOM    186  N   SER A  12      -3.122  -1.565  -6.986  1.00  0.00           N
ATOM    187  CA  SER A  12      -2.434  -0.369  -6.408  1.00  0.00           C
ATOM    188  C   SER A  12      -3.402   0.815  -6.272  1.00  0.00           C
ATOM    189  O   SER A  12      -3.135   1.763  -5.560  1.00  0.00           O
ATOM    190  CB  SER A  12      -1.331  -0.016  -7.403  1.00  0.00           C
ATOM    191  OG  SER A  12      -0.062  -0.202  -6.789  1.00  0.00           O
ATOM      0  H   SER A  12      -4.141  -1.519  -6.982  1.00  0.00           H   new
ATOM      0  HA  SER A  12      -2.048  -0.582  -5.411  1.00  0.00           H   new
ATOM      0  HB2 SER A  12      -1.413  -0.643  -8.291  1.00  0.00           H   new
ATOM      0  HB3 SER A  12      -1.440   1.018  -7.732  1.00  0.00           H   new
ATOM      0  HG  SER A  12       0.132  -1.160  -6.722  1.00  0.00           H   new
ATOM    197  N   ASN A  13      -4.513   0.784  -6.959  1.00  0.00           N
ATOM    198  CA  ASN A  13      -5.478   1.919  -6.877  1.00  0.00           C
ATOM    199  C   ASN A  13      -6.109   2.008  -5.482  1.00  0.00           C
ATOM    200  O   ASN A  13      -6.875   2.907  -5.199  1.00  0.00           O
ATOM    201  CB  ASN A  13      -6.546   1.602  -7.923  1.00  0.00           C
ATOM    202  CG  ASN A  13      -6.217   2.328  -9.229  1.00  0.00           C
ATOM    203  OD1 ASN A  13      -5.142   2.877  -9.381  1.00  0.00           O
ATOM    204  ND2 ASN A  13      -7.102   2.355 -10.189  1.00  0.00           N
ATOM      0  H   ASN A  13      -4.794   0.021  -7.574  1.00  0.00           H   new
ATOM      0  HA  ASN A  13      -4.990   2.877  -7.056  1.00  0.00           H   new
ATOM      0  HB2 ASN A  13      -6.593   0.527  -8.095  1.00  0.00           H   new
ATOM      0  HB3 ASN A  13      -7.527   1.910  -7.561  1.00  0.00           H   new
ATOM      0 HD21 ASN A  13      -6.891   2.836 -11.064  1.00  0.00           H   new
ATOM      0 HD22 ASN A  13      -8.004   1.895 -10.064  1.00  0.00           H   new
ATOM    211  N   ASP A  14      -5.806   1.085  -4.612  1.00  0.00           N
ATOM    212  CA  ASP A  14      -6.408   1.135  -3.246  1.00  0.00           C
ATOM    213  C   ASP A  14      -5.336   1.408  -2.185  1.00  0.00           C
ATOM    214  O   ASP A  14      -5.639   1.614  -1.026  1.00  0.00           O
ATOM    215  CB  ASP A  14      -7.025  -0.248  -3.034  1.00  0.00           C
ATOM    216  CG  ASP A  14      -8.299  -0.118  -2.195  1.00  0.00           C
ATOM    217  OD1 ASP A  14      -9.096   0.756  -2.496  1.00  0.00           O
ATOM    218  OD2 ASP A  14      -8.456  -0.894  -1.267  1.00  0.00           O
ATOM      0  H   ASP A  14      -5.173   0.304  -4.783  1.00  0.00           H   new
ATOM      0  HA  ASP A  14      -7.144   1.935  -3.158  1.00  0.00           H   new
ATOM      0  HB2 ASP A  14      -7.256  -0.706  -3.996  1.00  0.00           H   new
ATOM      0  HB3 ASP A  14      -6.312  -0.903  -2.532  1.00  0.00           H   new
ATOM    223  N   CYS A  15      -4.088   1.398  -2.562  1.00  0.00           N
ATOM    224  CA  CYS A  15      -3.008   1.642  -1.567  1.00  0.00           C
ATOM    225  C   CYS A  15      -2.787   3.138  -1.338  1.00  0.00           C
ATOM    226  O   CYS A  15      -2.707   3.921  -2.263  1.00  0.00           O
ATOM    227  CB  CYS A  15      -1.773   1.004  -2.192  1.00  0.00           C
ATOM    228  SG  CYS A  15      -2.111  -0.748  -2.481  1.00  0.00           S
ATOM      0  H   CYS A  15      -3.770   1.231  -3.517  1.00  0.00           H   new
ATOM      0  HA  CYS A  15      -3.249   1.225  -0.589  1.00  0.00           H   new
ATOM      0  HB2 CYS A  15      -1.524   1.501  -3.130  1.00  0.00           H   new
ATOM      0  HB3 CYS A  15      -0.913   1.119  -1.532  1.00  0.00           H   new
ATOM    233  N   CYS A  16      -2.679   3.533  -0.098  1.00  0.00           N
ATOM    234  CA  CYS A  16      -2.452   4.972   0.224  1.00  0.00           C
ATOM    235  C   CYS A  16      -1.195   5.475  -0.484  1.00  0.00           C
ATOM    236  O   CYS A  16      -0.414   4.702  -1.002  1.00  0.00           O
ATOM    237  CB  CYS A  16      -2.246   5.008   1.738  1.00  0.00           C
ATOM    238  SG  CYS A  16      -3.731   5.650   2.544  1.00  0.00           S
ATOM      0  H   CYS A  16      -2.739   2.916   0.712  1.00  0.00           H   new
ATOM      0  HA  CYS A  16      -3.282   5.602  -0.097  1.00  0.00           H   new
ATOM      0  HB2 CYS A  16      -2.025   4.007   2.108  1.00  0.00           H   new
ATOM      0  HB3 CYS A  16      -1.389   5.635   1.983  1.00  0.00           H   new
ATOM    243  N   LYS A  17      -0.984   6.762  -0.504  1.00  0.00           N
ATOM    244  CA  LYS A  17       0.227   7.298  -1.168  1.00  0.00           C
ATOM    245  C   LYS A  17       1.465   6.571  -0.639  1.00  0.00           C
ATOM    246  O   LYS A  17       1.512   6.165   0.505  1.00  0.00           O
ATOM    247  CB  LYS A  17       0.261   8.778  -0.793  1.00  0.00           C
ATOM    248  CG  LYS A  17       1.135   9.534  -1.793  1.00  0.00           C
ATOM    249  CD  LYS A  17       1.831  10.699  -1.088  1.00  0.00           C
ATOM    250  CE  LYS A  17       1.757  11.945  -1.973  1.00  0.00           C
ATOM    251  NZ  LYS A  17       0.372  12.464  -1.792  1.00  0.00           N
ATOM      0  H   LYS A  17      -1.599   7.461  -0.089  1.00  0.00           H   new
ATOM      0  HA  LYS A  17       0.212   7.161  -2.249  1.00  0.00           H   new
ATOM      0  HB2 LYS A  17      -0.749   9.188  -0.793  1.00  0.00           H   new
ATOM      0  HB3 LYS A  17       0.655   8.900   0.216  1.00  0.00           H   new
ATOM      0  HG2 LYS A  17       1.876   8.862  -2.224  1.00  0.00           H   new
ATOM      0  HG3 LYS A  17       0.525   9.906  -2.616  1.00  0.00           H   new
ATOM      0  HD2 LYS A  17       1.355  10.893  -0.127  1.00  0.00           H   new
ATOM      0  HD3 LYS A  17       2.871  10.446  -0.884  1.00  0.00           H   new
ATOM      0  HE2 LYS A  17       2.498  12.686  -1.674  1.00  0.00           H   new
ATOM      0  HE3 LYS A  17       1.954  11.700  -3.017  1.00  0.00           H   new
ATOM      0  HZ1 LYS A  17       0.354  13.484  -1.993  1.00  0.00           H   new
ATOM      0  HZ2 LYS A  17      -0.271  11.971  -2.444  1.00  0.00           H   new
ATOM      0  HZ3 LYS A  17       0.065  12.299  -0.812  1.00  0.00           H   new
ATOM    265  N   ASP A  18       2.459   6.387  -1.462  1.00  0.00           N
ATOM    266  CA  ASP A  18       3.682   5.671  -1.002  1.00  0.00           C
ATOM    267  C   ASP A  18       3.330   4.220  -0.651  1.00  0.00           C
ATOM    268  O   ASP A  18       4.126   3.496  -0.087  1.00  0.00           O
ATOM    269  CB  ASP A  18       4.154   6.433   0.238  1.00  0.00           C
ATOM    270  CG  ASP A  18       4.097   7.938  -0.036  1.00  0.00           C
ATOM    271  OD1 ASP A  18       3.016   8.496   0.057  1.00  0.00           O
ATOM    272  OD2 ASP A  18       5.134   8.506  -0.335  1.00  0.00           O
ATOM      0  H   ASP A  18       2.478   6.701  -2.432  1.00  0.00           H   new
ATOM      0  HA  ASP A  18       4.458   5.637  -1.766  1.00  0.00           H   new
ATOM      0  HB2 ASP A  18       3.525   6.184   1.092  1.00  0.00           H   new
ATOM      0  HB3 ASP A  18       5.171   6.137   0.494  1.00  0.00           H   new
ATOM    277  N   LEU A  19       2.141   3.791  -0.990  1.00  0.00           N
ATOM    278  CA  LEU A  19       1.734   2.388  -0.688  1.00  0.00           C
ATOM    279  C   LEU A  19       1.294   1.691  -1.980  1.00  0.00           C
ATOM    280  O   LEU A  19       0.683   2.292  -2.842  1.00  0.00           O
ATOM    281  CB  LEU A  19       0.558   2.509   0.291  1.00  0.00           C
ATOM    282  CG  LEU A  19       0.509   1.271   1.196  1.00  0.00           C
ATOM    283  CD1 LEU A  19       1.707   1.279   2.141  1.00  0.00           C
ATOM    284  CD2 LEU A  19      -0.774   1.286   2.026  1.00  0.00           C
ATOM      0  H   LEU A  19       1.434   4.354  -1.464  1.00  0.00           H   new
ATOM      0  HA  LEU A  19       2.547   1.800  -0.263  1.00  0.00           H   new
ATOM      0  HB2 LEU A  19       0.667   3.409   0.896  1.00  0.00           H   new
ATOM      0  HB3 LEU A  19      -0.378   2.606  -0.260  1.00  0.00           H   new
ATOM      0  HG  LEU A  19       0.534   0.377   0.573  1.00  0.00           H   new
ATOM      0 HD11 LEU A  19       1.670   0.399   2.783  1.00  0.00           H   new
ATOM      0 HD12 LEU A  19       2.629   1.266   1.560  1.00  0.00           H   new
ATOM      0 HD13 LEU A  19       1.679   2.178   2.756  1.00  0.00           H   new
ATOM      0 HD21 LEU A  19      -0.803   0.405   2.667  1.00  0.00           H   new
ATOM      0 HD22 LEU A  19      -0.798   2.184   2.643  1.00  0.00           H   new
ATOM      0 HD23 LEU A  19      -1.638   1.280   1.361  1.00  0.00           H   new
ATOM    296  N   VAL A  20       1.605   0.432  -2.127  1.00  0.00           N
ATOM    297  CA  VAL A  20       1.206  -0.289  -3.371  1.00  0.00           C
ATOM    298  C   VAL A  20       0.758  -1.717  -3.044  1.00  0.00           C
ATOM    299  O   VAL A  20       1.222  -2.325  -2.100  1.00  0.00           O
ATOM    300  CB  VAL A  20       2.467  -0.310  -4.236  1.00  0.00           C
ATOM    301  CG1 VAL A  20       2.728   1.089  -4.795  1.00  0.00           C
ATOM    302  CG2 VAL A  20       3.658  -0.748  -3.381  1.00  0.00           C
ATOM      0  H   VAL A  20       2.116  -0.127  -1.444  1.00  0.00           H   new
ATOM      0  HA  VAL A  20       0.369   0.195  -3.875  1.00  0.00           H   new
ATOM      0  HB  VAL A  20       2.332  -1.009  -5.061  1.00  0.00           H   new
ATOM      0 HG11 VAL A  20       3.627   1.073  -5.411  1.00  0.00           H   new
ATOM      0 HG12 VAL A  20       1.878   1.403  -5.401  1.00  0.00           H   new
ATOM      0 HG13 VAL A  20       2.865   1.790  -3.972  1.00  0.00           H   new
ATOM      0 HG21 VAL A  20       4.559  -0.764  -3.994  1.00  0.00           H   new
ATOM      0 HG22 VAL A  20       3.792  -0.047  -2.557  1.00  0.00           H   new
ATOM      0 HG23 VAL A  20       3.472  -1.745  -2.982  1.00  0.00           H   new
ATOM    312  N   CYS A  21      -0.139  -2.256  -3.822  1.00  0.00           N
ATOM    313  CA  CYS A  21      -0.620  -3.643  -3.563  1.00  0.00           C
ATOM    314  C   CYS A  21       0.524  -4.640  -3.754  1.00  0.00           C
ATOM    315  O   CYS A  21       1.327  -4.505  -4.655  1.00  0.00           O
ATOM    316  CB  CYS A  21      -1.714  -3.874  -4.604  1.00  0.00           C
ATOM    317  SG  CYS A  21      -2.467  -5.494  -4.330  1.00  0.00           S
ATOM      0  H   CYS A  21      -0.561  -1.795  -4.628  1.00  0.00           H   new
ATOM      0  HA  CYS A  21      -0.988  -3.775  -2.546  1.00  0.00           H   new
ATOM      0  HB2 CYS A  21      -2.470  -3.092  -4.533  1.00  0.00           H   new
ATOM      0  HB3 CYS A  21      -1.293  -3.821  -5.608  1.00  0.00           H   new
ATOM    322  N   SER A  22       0.617  -5.637  -2.914  1.00  0.00           N
ATOM    323  CA  SER A  22       1.724  -6.622  -3.070  1.00  0.00           C
ATOM    324  C   SER A  22       1.236  -8.041  -2.773  1.00  0.00           C
ATOM    325  O   SER A  22       0.694  -8.318  -1.720  1.00  0.00           O
ATOM    326  CB  SER A  22       2.781  -6.193  -2.056  1.00  0.00           C
ATOM    327  OG  SER A  22       4.073  -6.417  -2.605  1.00  0.00           O
ATOM      0  H   SER A  22      -0.019  -5.810  -2.135  1.00  0.00           H   new
ATOM      0  HA  SER A  22       2.114  -6.637  -4.088  1.00  0.00           H   new
ATOM      0  HB2 SER A  22       2.656  -5.139  -1.807  1.00  0.00           H   new
ATOM      0  HB3 SER A  22       2.664  -6.756  -1.130  1.00  0.00           H   new
ATOM      0  HG  SER A  22       4.671  -5.687  -2.342  1.00  0.00           H   new
ATOM    333  N   SER A  23       1.433  -8.942  -3.701  1.00  0.00           N
ATOM    334  CA  SER A  23       0.998 -10.345  -3.496  1.00  0.00           C
ATOM    335  C   SER A  23       1.888 -11.020  -2.452  1.00  0.00           C
ATOM    336  O   SER A  23       1.501 -11.979  -1.815  1.00  0.00           O
ATOM    337  CB  SER A  23       1.165 -11.016  -4.859  1.00  0.00           C
ATOM    338  OG  SER A  23      -0.100 -11.473  -5.315  1.00  0.00           O
ATOM      0  H   SER A  23       1.881  -8.758  -4.599  1.00  0.00           H   new
ATOM      0  HA  SER A  23      -0.028 -10.413  -3.134  1.00  0.00           H   new
ATOM      0  HB2 SER A  23       1.590 -10.312  -5.574  1.00  0.00           H   new
ATOM      0  HB3 SER A  23       1.861 -11.852  -4.783  1.00  0.00           H   new
ATOM      0  HG  SER A  23       0.003 -11.902  -6.190  1.00  0.00           H   new
ATOM    344  N   ARG A  24       3.080 -10.519  -2.269  1.00  0.00           N
ATOM    345  CA  ARG A  24       3.995 -11.123  -1.262  1.00  0.00           C
ATOM    346  C   ARG A  24       3.592 -10.644   0.132  1.00  0.00           C
ATOM    347  O   ARG A  24       3.698 -11.366   1.104  1.00  0.00           O
ATOM    348  CB  ARG A  24       5.386 -10.610  -1.635  1.00  0.00           C
ATOM    349  CG  ARG A  24       6.411 -11.731  -1.445  1.00  0.00           C
ATOM    350  CD  ARG A  24       7.769 -11.285  -1.995  1.00  0.00           C
ATOM    351  NE  ARG A  24       8.419 -10.551  -0.872  1.00  0.00           N
ATOM    352  CZ  ARG A  24       9.573 -10.951  -0.413  1.00  0.00           C
ATOM    353  NH1 ARG A  24      10.484 -11.393  -1.236  1.00  0.00           N
ATOM    354  NH2 ARG A  24       9.818 -10.907   0.868  1.00  0.00           N
ATOM      0  H   ARG A  24       3.458  -9.718  -2.774  1.00  0.00           H   new
ATOM      0  HA  ARG A  24       3.962 -12.212  -1.254  1.00  0.00           H   new
ATOM      0  HB2 ARG A  24       5.394 -10.267  -2.670  1.00  0.00           H   new
ATOM      0  HB3 ARG A  24       5.648  -9.754  -1.014  1.00  0.00           H   new
ATOM      0  HG2 ARG A  24       6.500 -11.981  -0.388  1.00  0.00           H   new
ATOM      0  HG3 ARG A  24       6.078 -12.633  -1.959  1.00  0.00           H   new
ATOM      0  HD2 ARG A  24       8.369 -12.140  -2.307  1.00  0.00           H   new
ATOM      0  HD3 ARG A  24       7.650 -10.644  -2.869  1.00  0.00           H   new
ATOM      0  HE  ARG A  24       7.962  -9.736  -0.463  1.00  0.00           H   new
ATOM      0 HH11 ARG A  24      10.294 -11.426  -2.238  1.00  0.00           H   new
ATOM      0 HH12 ARG A  24      11.386 -11.706  -0.878  1.00  0.00           H   new
ATOM      0 HH21 ARG A  24       9.107 -10.560   1.512  1.00  0.00           H   new
ATOM      0 HH22 ARG A  24      10.721 -11.220   1.226  1.00  0.00           H   new
ATOM    368  N   TRP A  25       3.110  -9.436   0.227  1.00  0.00           N
ATOM    369  CA  TRP A  25       2.672  -8.908   1.548  1.00  0.00           C
ATOM    370  C   TRP A  25       1.158  -9.098   1.694  1.00  0.00           C
ATOM    371  O   TRP A  25       0.604  -8.931   2.758  1.00  0.00           O
ATOM    372  CB  TRP A  25       3.048  -7.427   1.537  1.00  0.00           C
ATOM    373  CG  TRP A  25       4.535  -7.300   1.412  1.00  0.00           C
ATOM    374  CD1 TRP A  25       5.191  -6.881   0.304  1.00  0.00           C
ATOM    375  CD2 TRP A  25       5.564  -7.591   2.405  1.00  0.00           C
ATOM    376  NE1 TRP A  25       6.549  -6.896   0.556  1.00  0.00           N
ATOM    377  CE2 TRP A  25       6.827  -7.324   1.831  1.00  0.00           C
ATOM    378  CE3 TRP A  25       5.527  -8.055   3.733  1.00  0.00           C
ATOM    379  CZ2 TRP A  25       8.007  -7.506   2.534  1.00  0.00           C
ATOM    380  CZ3 TRP A  25       6.722  -8.242   4.452  1.00  0.00           C
ATOM    381  CH2 TRP A  25       7.961  -7.967   3.852  1.00  0.00           C
ATOM      0  H   TRP A  25       3.001  -8.791  -0.555  1.00  0.00           H   new
ATOM      0  HA  TRP A  25       3.141  -9.423   2.387  1.00  0.00           H   new
ATOM      0  HB2 TRP A  25       2.556  -6.920   0.707  1.00  0.00           H   new
ATOM      0  HB3 TRP A  25       2.705  -6.945   2.453  1.00  0.00           H   new
ATOM      0  HD1 TRP A  25       4.728  -6.584  -0.625  1.00  0.00           H   new
ATOM      0  HE1 TRP A  25       7.259  -6.622  -0.123  1.00  0.00           H   new
ATOM      0  HE3 TRP A  25       4.578  -8.268   4.202  1.00  0.00           H   new
ATOM      0  HZ2 TRP A  25       8.957  -7.293   2.066  1.00  0.00           H   new
ATOM      0  HZ3 TRP A  25       6.686  -8.599   5.471  1.00  0.00           H   new
ATOM      0  HH2 TRP A  25       8.876  -8.111   4.408  1.00  0.00           H   new
ATOM    392  N   LYS A  26       0.497  -9.471   0.626  1.00  0.00           N
ATOM    393  CA  LYS A  26      -0.975  -9.713   0.682  1.00  0.00           C
ATOM    394  C   LYS A  26      -1.747  -8.420   0.985  1.00  0.00           C
ATOM    395  O   LYS A  26      -2.810  -8.457   1.569  1.00  0.00           O
ATOM    396  CB  LYS A  26      -1.147 -10.770   1.798  1.00  0.00           C
ATOM    397  CG  LYS A  26      -1.609 -10.131   3.122  1.00  0.00           C
ATOM    398  CD  LYS A  26      -0.794 -10.677   4.301  1.00  0.00           C
ATOM    399  CE  LYS A  26      -0.500 -12.169   4.106  1.00  0.00           C
ATOM    400  NZ  LYS A  26      -0.595 -12.756   5.472  1.00  0.00           N
ATOM      0  H   LYS A  26       0.920  -9.619  -0.290  1.00  0.00           H   new
ATOM      0  HA  LYS A  26      -1.377 -10.059  -0.270  1.00  0.00           H   new
ATOM      0  HB2 LYS A  26      -1.874 -11.518   1.482  1.00  0.00           H   new
ATOM      0  HB3 LYS A  26      -0.202 -11.290   1.955  1.00  0.00           H   new
ATOM      0  HG2 LYS A  26      -1.498  -9.048   3.067  1.00  0.00           H   new
ATOM      0  HG3 LYS A  26      -2.668 -10.335   3.280  1.00  0.00           H   new
ATOM      0  HD2 LYS A  26       0.141 -10.125   4.391  1.00  0.00           H   new
ATOM      0  HD3 LYS A  26      -1.343 -10.527   5.231  1.00  0.00           H   new
ATOM      0  HE2 LYS A  26      -1.218 -12.628   3.427  1.00  0.00           H   new
ATOM      0  HE3 LYS A  26       0.490 -12.325   3.676  1.00  0.00           H   new
ATOM      0  HZ1 LYS A  26      -0.406 -13.778   5.425  1.00  0.00           H   new
ATOM      0  HZ2 LYS A  26       0.105 -12.303   6.094  1.00  0.00           H   new
ATOM      0  HZ3 LYS A  26      -1.550 -12.598   5.852  1.00  0.00           H   new
ATOM    414  N   TRP A  27      -1.235  -7.287   0.590  1.00  0.00           N
ATOM    415  CA  TRP A  27      -1.959  -6.011   0.863  1.00  0.00           C
ATOM    416  C   TRP A  27      -1.127  -4.816   0.406  1.00  0.00           C
ATOM    417  O   TRP A  27      -0.061  -4.965  -0.160  1.00  0.00           O
ATOM    418  CB  TRP A  27      -2.167  -5.957   2.387  1.00  0.00           C
ATOM    419  CG  TRP A  27      -0.857  -6.096   3.116  1.00  0.00           C
ATOM    420  CD1 TRP A  27       0.271  -5.403   2.843  1.00  0.00           C
ATOM    421  CD2 TRP A  27      -0.540  -6.934   4.271  1.00  0.00           C
ATOM    422  NE1 TRP A  27       1.261  -5.789   3.726  1.00  0.00           N
ATOM    423  CE2 TRP A  27       0.812  -6.723   4.622  1.00  0.00           C
ATOM    424  CE3 TRP A  27      -1.281  -7.855   5.031  1.00  0.00           C
ATOM    425  CZ2 TRP A  27       1.410  -7.392   5.682  1.00  0.00           C
ATOM    426  CZ3 TRP A  27      -0.682  -8.533   6.107  1.00  0.00           C
ATOM    427  CH2 TRP A  27       0.663  -8.303   6.431  1.00  0.00           C
ATOM      0  H   TRP A  27      -0.350  -7.188   0.092  1.00  0.00           H   new
ATOM      0  HA  TRP A  27      -2.906  -5.972   0.326  1.00  0.00           H   new
ATOM      0  HB2 TRP A  27      -2.641  -5.014   2.660  1.00  0.00           H   new
ATOM      0  HB3 TRP A  27      -2.844  -6.754   2.694  1.00  0.00           H   new
ATOM      0  HD1 TRP A  27       0.381  -4.666   2.061  1.00  0.00           H   new
ATOM      0  HE1 TRP A  27       2.213  -5.422   3.712  1.00  0.00           H   new
ATOM      0  HE3 TRP A  27      -2.316  -8.043   4.787  1.00  0.00           H   new
ATOM      0  HZ2 TRP A  27       2.446  -7.209   5.925  1.00  0.00           H   new
ATOM      0  HZ3 TRP A  27      -1.261  -9.235   6.688  1.00  0.00           H   new
ATOM      0  HH2 TRP A  27       1.119  -8.829   7.257  1.00  0.00           H   new
ATOM    438  N   CYS A  28      -1.595  -3.627   0.667  1.00  0.00           N
ATOM    439  CA  CYS A  28      -0.818  -2.418   0.269  1.00  0.00           C
ATOM    440  C   CYS A  28       0.411  -2.285   1.173  1.00  0.00           C
ATOM    441  O   CYS A  28       0.305  -2.301   2.384  1.00  0.00           O
ATOM    442  CB  CYS A  28      -1.786  -1.255   0.472  1.00  0.00           C
ATOM    443  SG  CYS A  28      -3.067  -1.334  -0.802  1.00  0.00           S
ATOM      0  H   CYS A  28      -2.480  -3.440   1.138  1.00  0.00           H   new
ATOM      0  HA  CYS A  28      -0.453  -2.457  -0.757  1.00  0.00           H   new
ATOM      0  HB2 CYS A  28      -2.236  -1.307   1.463  1.00  0.00           H   new
ATOM      0  HB3 CYS A  28      -1.253  -0.306   0.413  1.00  0.00           H   new
ATOM    448  N   VAL A  29       1.580  -2.182   0.601  1.00  0.00           N
ATOM    449  CA  VAL A  29       2.808  -2.081   1.442  1.00  0.00           C
ATOM    450  C   VAL A  29       3.477  -0.714   1.296  1.00  0.00           C
ATOM    451  O   VAL A  29       3.270  -0.006   0.332  1.00  0.00           O
ATOM    452  CB  VAL A  29       3.725  -3.185   0.924  1.00  0.00           C
ATOM    453  CG1 VAL A  29       2.999  -4.527   1.014  1.00  0.00           C
ATOM    454  CG2 VAL A  29       4.091  -2.901  -0.534  1.00  0.00           C
ATOM      0  H   VAL A  29       1.738  -2.163  -0.407  1.00  0.00           H   new
ATOM      0  HA  VAL A  29       2.579  -2.190   2.502  1.00  0.00           H   new
ATOM      0  HB  VAL A  29       4.633  -3.219   1.526  1.00  0.00           H   new
ATOM      0 HG11 VAL A  29       3.651  -5.319   0.645  1.00  0.00           H   new
ATOM      0 HG12 VAL A  29       2.735  -4.729   2.052  1.00  0.00           H   new
ATOM      0 HG13 VAL A  29       2.093  -4.492   0.409  1.00  0.00           H   new
ATOM      0 HG21 VAL A  29       4.746  -3.689  -0.905  1.00  0.00           H   new
ATOM      0 HG22 VAL A  29       3.184  -2.869  -1.137  1.00  0.00           H   new
ATOM      0 HG23 VAL A  29       4.604  -1.942  -0.600  1.00  0.00           H   new
ATOM    464  N   LEU A  30       4.282  -0.342   2.261  1.00  0.00           N
ATOM    465  CA  LEU A  30       4.976   0.981   2.210  1.00  0.00           C
ATOM    466  C   LEU A  30       5.993   1.026   1.066  1.00  0.00           C
ATOM    467  O   LEU A  30       7.154   1.315   1.275  1.00  0.00           O
ATOM    468  CB  LEU A  30       5.682   1.103   3.564  1.00  0.00           C
ATOM    469  CG  LEU A  30       4.657   0.956   4.694  1.00  0.00           C
ATOM    470  CD1 LEU A  30       5.377   0.986   6.043  1.00  0.00           C
ATOM    471  CD2 LEU A  30       3.655   2.112   4.630  1.00  0.00           C
ATOM      0  H   LEU A  30       4.489  -0.903   3.087  1.00  0.00           H   new
ATOM      0  HA  LEU A  30       4.279   1.799   2.030  1.00  0.00           H   new
ATOM      0  HB2 LEU A  30       6.451   0.336   3.655  1.00  0.00           H   new
ATOM      0  HB3 LEU A  30       6.184   2.068   3.638  1.00  0.00           H   new
ATOM      0  HG  LEU A  30       4.129   0.009   4.582  1.00  0.00           H   new
ATOM      0 HD11 LEU A  30       4.648   0.881   6.847  1.00  0.00           H   new
ATOM      0 HD12 LEU A  30       6.092   0.165   6.092  1.00  0.00           H   new
ATOM      0 HD13 LEU A  30       5.905   1.933   6.153  1.00  0.00           H   new
ATOM      0 HD21 LEU A  30       2.926   2.007   5.434  1.00  0.00           H   new
ATOM      0 HD22 LEU A  30       4.184   3.059   4.741  1.00  0.00           H   new
ATOM      0 HD23 LEU A  30       3.140   2.095   3.669  1.00  0.00           H   new
ATOM    483  N   ALA A  31       5.555   0.753  -0.141  1.00  0.00           N
ATOM    484  CA  ALA A  31       6.477   0.779  -1.320  1.00  0.00           C
ATOM    485  C   ALA A  31       7.888   0.362  -0.914  1.00  0.00           C
ATOM    486  O   ALA A  31       8.865   0.981  -1.291  1.00  0.00           O
ATOM    487  CB  ALA A  31       6.459   2.227  -1.812  1.00  0.00           C
ATOM      0  H   ALA A  31       4.589   0.511  -0.360  1.00  0.00           H   new
ATOM      0  HA  ALA A  31       6.162   0.082  -2.097  1.00  0.00           H   new
ATOM      0  HB1 ALA A  31       7.114   2.325  -2.678  1.00  0.00           H   new
ATOM      0  HB2 ALA A  31       5.443   2.503  -2.093  1.00  0.00           H   new
ATOM      0  HB3 ALA A  31       6.808   2.886  -1.017  1.00  0.00           H   new
ATOM    493  N   SER A  32       7.999  -0.683  -0.147  1.00  0.00           N
ATOM    494  CA  SER A  32       9.350  -1.146   0.290  1.00  0.00           C
ATOM    495  C   SER A  32       9.330  -2.648   0.595  1.00  0.00           C
ATOM    496  O   SER A  32       8.608  -3.094   1.465  1.00  0.00           O
ATOM    497  CB  SER A  32       9.648  -0.348   1.558  1.00  0.00           C
ATOM    498  OG  SER A  32      10.711  -0.975   2.266  1.00  0.00           O
ATOM      0  H   SER A  32       7.216  -1.239   0.198  1.00  0.00           H   new
ATOM      0  HA  SER A  32      10.106  -0.992  -0.480  1.00  0.00           H   new
ATOM      0  HB2 SER A  32       9.920   0.676   1.302  1.00  0.00           H   new
ATOM      0  HB3 SER A  32       8.759  -0.294   2.186  1.00  0.00           H   new
ATOM      0  HG  SER A  32      10.379  -1.311   3.125  1.00  0.00           H   new
ATOM    504  N   PRO A  33      10.132  -3.381  -0.132  1.00  0.00           N
ATOM    505  CA  PRO A  33      10.209  -4.846   0.066  1.00  0.00           C
ATOM    506  C   PRO A  33      11.080  -5.179   1.282  1.00  0.00           C
ATOM    507  O   PRO A  33      12.290  -5.240   1.193  1.00  0.00           O
ATOM    508  CB  PRO A  33      10.860  -5.345  -1.219  1.00  0.00           C
ATOM    509  CG  PRO A  33      11.645  -4.182  -1.746  1.00  0.00           C
ATOM    510  CD  PRO A  33      11.028  -2.918  -1.197  1.00  0.00           C
ATOM      0  HA  PRO A  33       9.238  -5.304   0.254  1.00  0.00           H   new
ATOM      0  HB2 PRO A  33      11.507  -6.200  -1.025  1.00  0.00           H   new
ATOM      0  HB3 PRO A  33      10.109  -5.671  -1.939  1.00  0.00           H   new
ATOM      0  HG2 PRO A  33      12.690  -4.259  -1.444  1.00  0.00           H   new
ATOM      0  HG3 PRO A  33      11.628  -4.173  -2.836  1.00  0.00           H   new
ATOM      0  HD2 PRO A  33      11.789  -2.241  -0.809  1.00  0.00           H   new
ATOM      0  HD3 PRO A  33      10.481  -2.375  -1.968  1.00  0.00           H   new
ATOM    518  N   PHE A  34      10.473  -5.396   2.416  1.00  0.00           N
ATOM    519  CA  PHE A  34      11.265  -5.726   3.635  1.00  0.00           C
ATOM    520  C   PHE A  34      11.831  -7.145   3.531  1.00  0.00           C
ATOM    521  O   PHE A  34      11.817  -7.843   4.531  1.00  0.00           O
ATOM    522  CB  PHE A  34      10.270  -5.631   4.792  1.00  0.00           C
ATOM    523  CG  PHE A  34      10.276  -4.228   5.351  1.00  0.00           C
ATOM    524  CD1 PHE A  34       9.649  -3.190   4.650  1.00  0.00           C
ATOM    525  CD2 PHE A  34      10.907  -3.968   6.572  1.00  0.00           C
ATOM    526  CE1 PHE A  34       9.655  -1.891   5.171  1.00  0.00           C
ATOM    527  CE2 PHE A  34      10.913  -2.669   7.093  1.00  0.00           C
ATOM    528  CZ  PHE A  34      10.288  -1.630   6.393  1.00  0.00           C
ATOM    529  OXT PHE A  34      12.268  -7.509   2.452  1.00  0.00           O
ATOM      0  H   PHE A  34       9.463  -5.359   2.552  1.00  0.00           H   new
ATOM      0  HA  PHE A  34      12.113  -5.055   3.770  1.00  0.00           H   new
ATOM      0  HB2 PHE A  34       9.269  -5.892   4.447  1.00  0.00           H   new
ATOM      0  HB3 PHE A  34      10.534  -6.345   5.572  1.00  0.00           H   new
ATOM      0  HD1 PHE A  34       9.161  -3.392   3.708  1.00  0.00           H   new
ATOM      0  HD2 PHE A  34      11.389  -4.769   7.112  1.00  0.00           H   new
ATOM      0  HE1 PHE A  34       9.172  -1.090   4.631  1.00  0.00           H   new
ATOM      0  HE2 PHE A  34      11.400  -2.468   8.036  1.00  0.00           H   new
ATOM      0  HZ  PHE A  34      10.294  -0.628   6.795  1.00  0.00           H   new
TER     539      PHE A  34