USER  MOD reduce.3.24.130724 H: found=0, std=0, add=243, rem=0, adj=8
USER  MOD reduce.3.24.130724 removed 244 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 Single : A   5 LYS NZ  :NH3+   -172:sc=       0   (180deg=-0.0518)
USER  MOD Single : A   7 MET CE  :methyl  180:sc=       0   (180deg=0)
USER  MOD Single : A   9 LYS NZ  :NH3+   -173:sc=       0   (180deg=-0.0227)
USER  MOD Single : A  11 LYS NZ  :NH3+   -124:sc=  -0.531   (180deg=-2.14!)
USER  MOD Single : A  12 ASN     :      amide:sc=   -1.13  K(o=-1.1,f=-3.8!)
USER  MOD Single : A  13 SER OG  :   rot  180:sc=  0.0184
USER  MOD Single : A  14 ASN     :      amide:sc=  -0.281  K(o=-0.28,f=-2.8!)
USER  MOD Single : A  18 LYS NZ  :NH3+    155:sc= -0.0847   (180deg=-0.434)
USER  MOD Single : A  23 SER OG  :   rot -150:sc=  -0.138
USER  MOD Single : A  24 SER OG  :   rot  -39:sc=  0.0125
USER  MOD Single : A  27 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  33 SER OG  :   rot  180:sc=       0
USER  MOD -----------------------------------------------------------------
ATOM     12  N   GLU A   2       2.235  -1.351  -3.259  1.00 41.25           N
ATOM     13  CA  GLU A   2       2.114  -2.505  -4.141  1.00 73.01           C
ATOM     14  C   GLU A   2       3.475  -3.151  -4.382  1.00 11.12           C
ATOM     15  O   GLU A   2       4.511  -2.601  -4.006  1.00 60.40           O
ATOM     16  CB  GLU A   2       1.489  -2.093  -5.474  1.00 23.35           C
ATOM     17  CG  GLU A   2       0.448  -3.072  -5.988  1.00 11.21           C
ATOM     18  CD  GLU A   2      -0.668  -3.314  -4.990  1.00  4.33           C
ATOM     19  OE1 GLU A   2      -1.186  -2.326  -4.429  1.00 33.02           O
ATOM     20  OE2 GLU A   2      -1.022  -4.491  -4.770  1.00 41.33           O1-
ATOM      0  HA  GLU A   2       1.466  -3.235  -3.655  1.00 73.01           H   new
ATOM      0  HB2 GLU A   2       1.028  -1.112  -5.361  1.00 23.35           H   new
ATOM      0  HB3 GLU A   2       2.278  -1.991  -6.219  1.00 23.35           H   new
ATOM      0  HG2 GLU A   2       0.023  -2.691  -6.917  1.00 11.21           H   new
ATOM      0  HG3 GLU A   2       0.931  -4.020  -6.224  1.00 11.21           H   new
ATOM     27  N   CYS A   3       3.465  -4.322  -5.010  1.00 42.14           N
ATOM     28  CA  CYS A   3       4.698  -5.045  -5.302  1.00 42.15           C
ATOM     29  C   CYS A   3       4.744  -5.472  -6.767  1.00 30.34           C
ATOM     30  O   CYS A   3       3.849  -5.150  -7.547  1.00 64.22           O
ATOM     31  CB  CYS A   3       4.819  -6.273  -4.397  1.00 34.30           C
ATOM     32  SG  CYS A   3       3.299  -7.271  -4.289  1.00 72.02           S
ATOM      0  H   CYS A   3       2.616  -4.791  -5.327  1.00 42.14           H   new
ATOM      0  HA  CYS A   3       5.537  -4.376  -5.110  1.00 42.15           H   new
ATOM      0  HB2 CYS A   3       5.629  -6.903  -4.764  1.00 34.30           H   new
ATOM      0  HB3 CYS A   3       5.098  -5.946  -3.395  1.00 34.30           H   new
ATOM     37  N   GLY A   4       5.795  -6.199  -7.132  1.00  4.44           N
ATOM     38  CA  GLY A   4       5.940  -6.659  -8.500  1.00 13.42           C
ATOM     39  C   GLY A   4       4.851  -7.634  -8.903  1.00 43.02           C
ATOM     40  O   GLY A   4       3.758  -7.625  -8.337  1.00 51.20           O
ATOM      0  H   GLY A   4       6.549  -6.478  -6.504  1.00  4.44           H   new
ATOM      0  HA2 GLY A   4       5.922  -5.801  -9.172  1.00 13.42           H   new
ATOM      0  HA3 GLY A   4       6.913  -7.136  -8.618  1.00 13.42           H   new
ATOM     44  N   LYS A   5       5.149  -8.479  -9.883  1.00 14.14           N
ATOM     45  CA  LYS A   5       4.189  -9.465 -10.363  1.00 71.53           C
ATOM     46  C   LYS A   5       4.852 -10.451 -11.320  1.00  3.13           C
ATOM     47  O   LYS A   5       6.007 -10.273 -11.707  1.00 70.30           O
ATOM     48  CB  LYS A   5       3.018  -8.771 -11.060  1.00 45.22           C
ATOM     49  CG  LYS A   5       1.657  -9.205 -10.542  1.00 15.10           C
ATOM     50  CD  LYS A   5       0.587  -9.082 -11.615  1.00 72.00           C
ATOM     51  CE  LYS A   5      -0.441  -8.019 -11.256  1.00  3.34           C
ATOM     52  NZ  LYS A   5      -1.490  -7.888 -12.304  1.00 33.12           N1+
ATOM      0  H   LYS A   5       6.050  -8.501 -10.361  1.00 14.14           H   new
ATOM      0  HA  LYS A   5       3.815 -10.018  -9.502  1.00 71.53           H   new
ATOM      0  HB2 LYS A   5       3.118  -7.693 -10.934  1.00 45.22           H   new
ATOM      0  HB3 LYS A   5       3.072  -8.973 -12.130  1.00 45.22           H   new
ATOM      0  HG2 LYS A   5       1.710 -10.237 -10.197  1.00 15.10           H   new
ATOM      0  HG3 LYS A   5       1.383  -8.595  -9.681  1.00 15.10           H   new
ATOM      0  HD2 LYS A   5       1.053  -8.832 -12.568  1.00 72.00           H   new
ATOM      0  HD3 LYS A   5       0.089 -10.043 -11.746  1.00 72.00           H   new
ATOM      0  HE2 LYS A   5      -0.908  -8.272 -10.304  1.00  3.34           H   new
ATOM      0  HE3 LYS A   5       0.060  -7.060 -11.121  1.00  3.34           H   new
ATOM      0  HZ1 LYS A   5      -2.092  -7.067 -12.092  1.00 33.12           H   new
ATOM      0  HZ2 LYS A   5      -1.039  -7.756 -13.232  1.00 33.12           H   new
ATOM      0  HZ3 LYS A   5      -2.073  -8.749 -12.321  1.00 33.12           H   new
ATOM     66  N   PHE A   6       4.114 -11.488 -11.699  1.00  1.44           N
ATOM     67  CA  PHE A   6       4.630 -12.501 -12.612  1.00 43.32           C
ATOM     68  C   PHE A   6       4.684 -11.970 -14.041  1.00 62.05           C
ATOM     69  O   PHE A   6       3.805 -11.223 -14.470  1.00 70.24           O
ATOM     70  CB  PHE A   6       3.760 -13.759 -12.557  1.00 24.12           C
ATOM     71  CG  PHE A   6       4.105 -14.772 -13.611  1.00 13.53           C
ATOM     72  CD1 PHE A   6       5.404 -15.235 -13.749  1.00 75.24           C
ATOM     73  CD2 PHE A   6       3.130 -15.262 -14.464  1.00 30.22           C
ATOM     74  CE1 PHE A   6       5.724 -16.168 -14.717  1.00 25.35           C
ATOM     75  CE2 PHE A   6       3.443 -16.196 -15.435  1.00 72.54           C
ATOM     76  CZ  PHE A   6       4.742 -16.648 -15.562  1.00 32.12           C
ATOM      0  H   PHE A   6       3.156 -11.649 -11.388  1.00  1.44           H   new
ATOM      0  HA  PHE A   6       5.643 -12.753 -12.298  1.00 43.32           H   new
ATOM      0  HB2 PHE A   6       3.862 -14.219 -11.574  1.00 24.12           H   new
ATOM      0  HB3 PHE A   6       2.714 -13.473 -12.668  1.00 24.12           H   new
ATOM      0  HD1 PHE A   6       6.176 -14.862 -13.092  1.00 75.24           H   new
ATOM      0  HD2 PHE A   6       2.113 -14.911 -14.370  1.00 30.22           H   new
ATOM      0  HE1 PHE A   6       6.740 -16.521 -14.813  1.00 25.35           H   new
ATOM      0  HE2 PHE A   6       2.673 -16.571 -16.093  1.00 72.54           H   new
ATOM      0  HZ  PHE A   6       4.990 -17.376 -16.321  1.00 32.12           H   new
ATOM     86  N   MET A   7       5.723 -12.359 -14.773  1.00 43.35           N
ATOM     87  CA  MET A   7       5.891 -11.922 -16.154  1.00 21.13           C
ATOM     88  C   MET A   7       6.042 -10.405 -16.230  1.00 62.32           C
ATOM     89  O   MET A   7       5.814  -9.802 -17.279  1.00 44.50           O
ATOM     90  CB  MET A   7       4.700 -12.372 -17.003  1.00 61.22           C
ATOM     91  CG  MET A   7       4.966 -13.636 -17.803  1.00 50.33           C
ATOM     92  SD  MET A   7       3.715 -13.936 -19.065  1.00 74.33           S
ATOM     93  CE  MET A   7       4.595 -15.047 -20.159  1.00 44.25           C
ATOM      0  H   MET A   7       6.461 -12.976 -14.433  1.00 43.35           H   new
ATOM      0  HA  MET A   7       6.800 -12.379 -16.546  1.00 21.13           H   new
ATOM      0  HB2 MET A   7       3.842 -12.538 -16.351  1.00 61.22           H   new
ATOM      0  HB3 MET A   7       4.429 -11.569 -17.688  1.00 61.22           H   new
ATOM      0  HG2 MET A   7       5.944 -13.562 -18.278  1.00 50.33           H   new
ATOM      0  HG3 MET A   7       5.004 -14.489 -17.125  1.00 50.33           H   new
ATOM      0  HE1 MET A   7       3.950 -15.324 -20.993  1.00 44.25           H   new
ATOM      0  HE2 MET A   7       5.488 -14.551 -20.540  1.00 44.25           H   new
ATOM      0  HE3 MET A   7       4.884 -15.944 -19.611  1.00 44.25           H   new
ATOM    103  N   TRP A   8       6.425  -9.797 -15.113  1.00 34.43           N
ATOM    104  CA  TRP A   8       6.606  -8.351 -15.054  1.00 22.41           C
ATOM    105  C   TRP A   8       8.085  -7.988 -15.019  1.00 34.33           C
ATOM    106  O   TRP A   8       8.846  -8.517 -14.208  1.00 51.25           O
ATOM    107  CB  TRP A   8       5.898  -7.779 -13.825  1.00 44.33           C
ATOM    108  CG  TRP A   8       4.419  -7.619 -14.011  1.00 72.12           C
ATOM    109  CD1 TRP A   8       3.612  -8.357 -14.830  1.00 44.44           C
ATOM    110  CD2 TRP A   8       3.573  -6.661 -13.369  1.00 51.33           C
ATOM    111  NE1 TRP A   8       2.314  -7.915 -14.733  1.00 14.23           N
ATOM    112  CE2 TRP A   8       2.264  -6.875 -13.843  1.00 53.53           C
ATOM    113  CE3 TRP A   8       3.792  -5.643 -12.436  1.00 73.15           C
ATOM    114  CZ2 TRP A   8       1.182  -6.109 -13.416  1.00 54.31           C
ATOM    115  CZ3 TRP A   8       2.718  -4.883 -12.014  1.00 13.31           C
ATOM    116  CH2 TRP A   8       1.426  -5.120 -12.503  1.00 23.11           C
ATOM      0  H   TRP A   8       6.616 -10.282 -14.236  1.00 34.43           H   new
ATOM      0  HA  TRP A   8       6.167  -7.918 -15.953  1.00 22.41           H   new
ATOM      0  HB2 TRP A   8       6.081  -8.433 -12.972  1.00 44.33           H   new
ATOM      0  HB3 TRP A   8       6.333  -6.810 -13.582  1.00 44.33           H   new
ATOM      0  HD1 TRP A   8       3.945  -9.168 -15.461  1.00 44.44           H   new
ATOM      0  HE1 TRP A   8       1.517  -8.299 -15.241  1.00 14.23           H   new
ATOM      0  HE3 TRP A   8       4.783  -5.454 -12.052  1.00 73.15           H   new
ATOM      0  HZ2 TRP A   8       0.186  -6.289 -13.792  1.00 54.31           H   new
ATOM      0  HZ3 TRP A   8       2.877  -4.093 -11.295  1.00 13.31           H   new
ATOM      0  HH2 TRP A   8       0.607  -4.510 -12.152  1.00 23.11           H   new
ATOM    127  N   LYS A   9       8.489  -7.082 -15.902  1.00 21.41           N
ATOM    128  CA  LYS A   9       9.879  -6.646 -15.972  1.00 71.24           C
ATOM    129  C   LYS A   9      10.391  -6.239 -14.594  1.00 45.12           C
ATOM    130  O   LYS A   9       9.626  -5.779 -13.747  1.00 22.42           O
ATOM    131  CB  LYS A   9      10.019  -5.475 -16.947  1.00 71.41           C
ATOM    132  CG  LYS A   9       9.945  -5.886 -18.407  1.00 42.53           C
ATOM    133  CD  LYS A   9       8.510  -5.903 -18.909  1.00 21.25           C
ATOM    134  CE  LYS A   9       8.451  -6.011 -20.424  1.00 65.14           C
ATOM    135  NZ  LYS A   9       8.782  -4.718 -21.086  1.00 63.20           N1+
ATOM      0  H   LYS A   9       7.873  -6.634 -16.580  1.00 21.41           H   new
ATOM      0  HA  LYS A   9      10.479  -7.482 -16.330  1.00 71.24           H   new
ATOM      0  HB2 LYS A   9       9.233  -4.748 -16.743  1.00 71.41           H   new
ATOM      0  HB3 LYS A   9      10.971  -4.975 -16.767  1.00 71.41           H   new
ATOM      0  HG2 LYS A   9      10.535  -5.196 -19.011  1.00 42.53           H   new
ATOM      0  HG3 LYS A   9      10.387  -6.875 -18.531  1.00 42.53           H   new
ATOM      0  HD2 LYS A   9       7.977  -6.742 -18.462  1.00 21.25           H   new
ATOM      0  HD3 LYS A   9       8.000  -4.995 -18.588  1.00 21.25           H   new
ATOM      0  HE2 LYS A   9       9.147  -6.780 -20.761  1.00 65.14           H   new
ATOM      0  HE3 LYS A   9       7.453  -6.329 -20.727  1.00 65.14           H   new
ATOM      0  HZ1 LYS A   9       8.616  -4.800 -22.109  1.00 63.20           H   new
ATOM      0  HZ2 LYS A   9       8.180  -3.965 -20.697  1.00 63.20           H   new
ATOM      0  HZ3 LYS A   9       9.781  -4.486 -20.915  1.00 63.20           H   new
ATOM    149  N   CYS A  10      11.691  -6.411 -14.377  1.00 44.41           N
ATOM    150  CA  CYS A  10      12.306  -6.061 -13.102  1.00 52.21           C
ATOM    151  C   CYS A  10      13.804  -5.821 -13.268  1.00 12.32           C
ATOM    152  O   CYS A  10      14.473  -6.514 -14.036  1.00 13.12           O
ATOM    153  CB  CYS A  10      12.067  -7.170 -12.075  1.00  5.43           C
ATOM    154  SG  CYS A  10      12.962  -8.715 -12.428  1.00 71.00           S
ATOM      0  H   CYS A  10      12.339  -6.791 -15.068  1.00 44.41           H   new
ATOM      0  HA  CYS A  10      11.845  -5.140 -12.746  1.00 52.21           H   new
ATOM      0  HB2 CYS A  10      12.363  -6.808 -11.090  1.00  5.43           H   new
ATOM      0  HB3 CYS A  10      10.999  -7.384 -12.029  1.00  5.43           H   new
ATOM    159  N   LYS A  11      14.324  -4.837 -12.544  1.00 64.42           N
ATOM    160  CA  LYS A  11      15.742  -4.505 -12.609  1.00 41.35           C
ATOM    161  C   LYS A  11      16.541  -5.334 -11.607  1.00 30.14           C
ATOM    162  O   LYS A  11      17.769  -5.376 -11.663  1.00 31.31           O
ATOM    163  CB  LYS A  11      15.952  -3.014 -12.335  1.00  1.10           C
ATOM    164  CG  LYS A  11      15.400  -2.558 -10.995  1.00 23.24           C
ATOM    165  CD  LYS A  11      15.694  -1.089 -10.743  1.00 22.43           C
ATOM    166  CE  LYS A  11      14.978  -0.197 -11.745  1.00 23.11           C
ATOM    167  NZ  LYS A  11      15.795   0.029 -12.969  1.00 11.12           N1+
ATOM      0  H   LYS A  11      13.784  -4.254 -11.904  1.00 64.42           H   new
ATOM      0  HA  LYS A  11      16.098  -4.737 -13.613  1.00 41.35           H   new
ATOM      0  HB2 LYS A  11      17.019  -2.793 -12.373  1.00  1.10           H   new
ATOM      0  HB3 LYS A  11      15.478  -2.437 -13.129  1.00  1.10           H   new
ATOM      0  HG2 LYS A  11      14.323  -2.724 -10.968  1.00 23.24           H   new
ATOM      0  HG3 LYS A  11      15.836  -3.159 -10.197  1.00 23.24           H   new
ATOM      0  HD2 LYS A  11      15.385  -0.823  -9.732  1.00 22.43           H   new
ATOM      0  HD3 LYS A  11      16.769  -0.916 -10.804  1.00 22.43           H   new
ATOM      0  HE2 LYS A  11      14.027  -0.652 -12.022  1.00 23.11           H   new
ATOM      0  HE3 LYS A  11      14.749   0.761 -11.279  1.00 23.11           H   new
ATOM      0  HZ1 LYS A  11      15.921   1.050 -13.118  1.00 11.12           H   new
ATOM      0  HZ2 LYS A  11      16.725  -0.422 -12.854  1.00 11.12           H   new
ATOM      0  HZ3 LYS A  11      15.310  -0.384 -13.791  1.00 11.12           H   new
ATOM    181  N   ASN A  12      15.835  -5.992 -10.695  1.00 51.45           N
ATOM    182  CA  ASN A  12      16.478  -6.820  -9.681  1.00  3.12           C
ATOM    183  C   ASN A  12      15.480  -7.790  -9.057  1.00 14.41           C
ATOM    184  O   ASN A  12      14.303  -7.802  -9.416  1.00 45.02           O
ATOM    185  CB  ASN A  12      17.102  -5.942  -8.595  1.00  2.42           C
ATOM    186  CG  ASN A  12      16.173  -4.830  -8.148  1.00 32.43           C
ATOM    187  OD1 ASN A  12      14.963  -5.027  -8.026  1.00 31.00           O
ATOM    188  ND2 ASN A  12      16.736  -3.653  -7.899  1.00 73.25           N
ATOM      0  H   ASN A  12      14.817  -5.968 -10.637  1.00 51.45           H   new
ATOM      0  HA  ASN A  12      17.264  -7.399 -10.166  1.00  3.12           H   new
ATOM      0  HB2 ASN A  12      17.363  -6.561  -7.737  1.00  2.42           H   new
ATOM      0  HB3 ASN A  12      18.029  -5.509  -8.970  1.00  2.42           H   new
ATOM      0 HD21 ASN A  12      16.162  -2.867  -7.593  1.00 73.25           H   new
ATOM      0 HD22 ASN A  12      17.743  -3.535  -8.013  1.00 73.25           H   new
ATOM    195  N   SER A  13      15.958  -8.602  -8.120  1.00 15.42           N
ATOM    196  CA  SER A  13      15.110  -9.578  -7.446  1.00  2.01           C
ATOM    197  C   SER A  13      14.251  -8.906  -6.379  1.00 64.12           C
ATOM    198  O   SER A  13      13.350  -9.522  -5.813  1.00 55.22           O
ATOM    199  CB  SER A  13      15.963 -10.677  -6.813  1.00  4.24           C
ATOM    200  OG  SER A  13      17.198 -10.821  -7.493  1.00 14.12           O
ATOM      0  H   SER A  13      16.930  -8.603  -7.810  1.00 15.42           H   new
ATOM      0  HA  SER A  13      14.451 -10.025  -8.190  1.00  2.01           H   new
ATOM      0  HB2 SER A  13      16.147 -10.440  -5.765  1.00  4.24           H   new
ATOM      0  HB3 SER A  13      15.420 -11.622  -6.836  1.00  4.24           H   new
ATOM      0  HG  SER A  13      17.725 -11.529  -7.067  1.00 14.12           H   new
ATOM    206  N   ASN A  14      14.539  -7.636  -6.109  1.00  2.51           N
ATOM    207  CA  ASN A  14      13.795  -6.880  -5.109  1.00  2.11           C
ATOM    208  C   ASN A  14      12.401  -6.529  -5.619  1.00 40.21           C
ATOM    209  O   ASN A  14      11.464  -6.367  -4.836  1.00 72.22           O
ATOM    210  CB  ASN A  14      14.551  -5.602  -4.740  1.00 71.03           C
ATOM    211  CG  ASN A  14      15.878  -5.890  -4.065  1.00 13.31           C
ATOM    212  OD1 ASN A  14      16.568  -6.849  -4.411  1.00 35.41           O
ATOM    213  ND2 ASN A  14      16.241  -5.059  -3.096  1.00 13.12           N
ATOM      0  H   ASN A  14      15.282  -7.110  -6.569  1.00  2.51           H   new
ATOM      0  HA  ASN A  14      13.692  -7.503  -4.221  1.00  2.11           H   new
ATOM      0  HB2 ASN A  14      14.725  -5.013  -5.641  1.00 71.03           H   new
ATOM      0  HB3 ASN A  14      13.933  -4.996  -4.077  1.00 71.03           H   new
ATOM      0 HD21 ASN A  14      17.124  -5.202  -2.605  1.00 13.12           H   new
ATOM      0 HD22 ASN A  14      15.637  -4.277  -2.842  1.00 13.12           H   new
ATOM    220  N   ASP A  15      12.269  -6.415  -6.937  1.00 65.41           N
ATOM    221  CA  ASP A  15      10.989  -6.086  -7.552  1.00 74.11           C
ATOM    222  C   ASP A  15       9.985  -7.218  -7.356  1.00  3.03           C
ATOM    223  O   ASP A  15       8.776  -6.989  -7.306  1.00 52.11           O
ATOM    224  CB  ASP A  15      11.174  -5.803  -9.044  1.00 34.42           C
ATOM    225  CG  ASP A  15      10.158  -4.811  -9.575  1.00 12.24           C
ATOM    226  OD1 ASP A  15       9.059  -5.246  -9.978  1.00 11.11           O1-
ATOM    227  OD2 ASP A  15      10.464  -3.601  -9.588  1.00 30.12           O
ATOM      0  H   ASP A  15      13.034  -6.546  -7.599  1.00 65.41           H   new
ATOM      0  HA  ASP A  15      10.599  -5.191  -7.066  1.00 74.11           H   new
ATOM      0  HB2 ASP A  15      12.179  -5.417  -9.216  1.00 34.42           H   new
ATOM      0  HB3 ASP A  15      11.092  -6.736  -9.601  1.00 34.42           H   new
ATOM    232  N   CYS A  16      10.494  -8.441  -7.249  1.00 23.35           N
ATOM    233  CA  CYS A  16       9.642  -9.610  -7.060  1.00 33.41           C
ATOM    234  C   CYS A  16       8.852  -9.503  -5.760  1.00 13.44           C
ATOM    235  O   CYS A  16       9.420  -9.275  -4.691  1.00 13.33           O
ATOM    236  CB  CYS A  16      10.487 -10.885  -7.052  1.00 65.34           C
ATOM    237  SG  CYS A  16      11.271 -11.268  -8.652  1.00 62.13           S
ATOM      0  H   CYS A  16      11.492  -8.649  -7.290  1.00 23.35           H   new
ATOM      0  HA  CYS A  16       8.937  -9.653  -7.890  1.00 33.41           H   new
ATOM      0  HB2 CYS A  16      11.263 -10.789  -6.293  1.00 65.34           H   new
ATOM      0  HB3 CYS A  16       9.856 -11.724  -6.758  1.00 65.34           H   new
ATOM    242  N   CYS A  17       7.536  -9.669  -5.858  1.00 51.51           N
ATOM    243  CA  CYS A  17       6.666  -9.590  -4.691  1.00 14.30           C
ATOM    244  C   CYS A  17       6.823 -10.828  -3.812  1.00 34.03           C
ATOM    245  O   CYS A  17       7.314 -10.746  -2.685  1.00 53.55           O
ATOM    246  CB  CYS A  17       5.207  -9.443  -5.126  1.00 32.13           C
ATOM    247  SG  CYS A  17       4.066  -9.020  -3.771  1.00 71.00           S
ATOM      0  H   CYS A  17       7.050  -9.859  -6.734  1.00 51.51           H   new
ATOM      0  HA  CYS A  17       6.956  -8.714  -4.111  1.00 14.30           H   new
ATOM      0  HB2 CYS A  17       5.144  -8.672  -5.894  1.00 32.13           H   new
ATOM      0  HB3 CYS A  17       4.880 -10.376  -5.584  1.00 32.13           H   new
ATOM    252  N   LYS A  18       6.403 -11.975  -4.334  1.00  2.41           N
ATOM    253  CA  LYS A  18       6.497 -13.231  -3.600  1.00 32.05           C
ATOM    254  C   LYS A  18       6.438 -14.423  -4.549  1.00 15.02           C
ATOM    255  O   LYS A  18       5.637 -14.444  -5.484  1.00 34.32           O
ATOM    256  CB  LYS A  18       5.369 -13.329  -2.569  1.00 73.25           C
ATOM    257  CG  LYS A  18       5.775 -14.038  -1.289  1.00  5.22           C
ATOM    258  CD  LYS A  18       6.743 -13.200  -0.471  1.00 54.05           C
ATOM    259  CE  LYS A  18       6.010 -12.331   0.540  1.00 51.15           C
ATOM    260  NZ  LYS A  18       5.364 -13.145   1.606  1.00 61.42           N1+
ATOM      0  H   LYS A  18       5.994 -12.061  -5.264  1.00  2.41           H   new
ATOM      0  HA  LYS A  18       7.456 -13.249  -3.083  1.00 32.05           H   new
ATOM      0  HB2 LYS A  18       5.024 -12.325  -2.324  1.00 73.25           H   new
ATOM      0  HB3 LYS A  18       4.526 -13.856  -3.015  1.00 73.25           H   new
ATOM      0  HG2 LYS A  18       4.887 -14.254  -0.695  1.00  5.22           H   new
ATOM      0  HG3 LYS A  18       6.237 -14.995  -1.533  1.00  5.22           H   new
ATOM      0  HD2 LYS A  18       7.443 -13.854   0.049  1.00 54.05           H   new
ATOM      0  HD3 LYS A  18       7.332 -12.568  -1.136  1.00 54.05           H   new
ATOM      0  HE2 LYS A  18       6.712 -11.631   0.993  1.00 51.15           H   new
ATOM      0  HE3 LYS A  18       5.253 -11.737   0.027  1.00 51.15           H   new
ATOM      0  HZ1 LYS A  18       5.252 -12.568   2.464  1.00 61.42           H   new
ATOM      0  HZ2 LYS A  18       4.430 -13.466   1.280  1.00 61.42           H   new
ATOM      0  HZ3 LYS A  18       5.958 -13.971   1.820  1.00 61.42           H   new
ATOM    274  N   ASP A  19       7.289 -15.413  -4.303  1.00 60.05           N
ATOM    275  CA  ASP A  19       7.331 -16.609  -5.136  1.00 34.00           C
ATOM    276  C   ASP A  19       7.784 -16.270  -6.552  1.00 62.31           C
ATOM    277  O   ASP A  19       7.544 -17.032  -7.491  1.00 74.31           O
ATOM    278  CB  ASP A  19       5.957 -17.280  -5.172  1.00 44.15           C
ATOM    279  CG  ASP A  19       5.962 -18.646  -4.515  1.00  0.10           C
ATOM    280  OD1 ASP A  19       6.082 -18.708  -3.274  1.00 21.34           O1-
ATOM    281  OD2 ASP A  19       5.844 -19.655  -5.243  1.00 31.11           O
ATOM      0  H   ASP A  19       7.959 -15.411  -3.534  1.00 60.05           H   new
ATOM      0  HA  ASP A  19       8.052 -17.300  -4.700  1.00 34.00           H   new
ATOM      0  HB2 ASP A  19       5.231 -16.641  -4.670  1.00 44.15           H   new
ATOM      0  HB3 ASP A  19       5.632 -17.379  -6.208  1.00 44.15           H   new
ATOM    286  N   LEU A  20       8.437 -15.124  -6.701  1.00 15.45           N
ATOM    287  CA  LEU A  20       8.923 -14.683  -8.003  1.00  3.34           C
ATOM    288  C   LEU A  20      10.431 -14.453  -7.973  1.00 15.22           C
ATOM    289  O   LEU A  20      11.007 -14.178  -6.921  1.00 54.12           O
ATOM    290  CB  LEU A  20       8.209 -13.398  -8.427  1.00 32.33           C
ATOM    291  CG  LEU A  20       6.933 -13.580  -9.252  1.00  1.30           C
ATOM    292  CD1 LEU A  20       6.153 -14.791  -8.768  1.00 64.44           C
ATOM    293  CD2 LEU A  20       6.073 -12.327  -9.186  1.00 74.21           C
ATOM      0  H   LEU A  20       8.643 -14.482  -5.935  1.00 15.45           H   new
ATOM      0  HA  LEU A  20       8.708 -15.468  -8.728  1.00  3.34           H   new
ATOM      0  HB2 LEU A  20       7.960 -12.831  -7.530  1.00 32.33           H   new
ATOM      0  HB3 LEU A  20       8.907 -12.791  -9.004  1.00 32.33           H   new
ATOM      0  HG  LEU A  20       7.215 -13.748 -10.291  1.00  1.30           H   new
ATOM      0 HD11 LEU A  20       5.249 -14.904  -9.366  1.00 64.44           H   new
ATOM      0 HD12 LEU A  20       6.769 -15.685  -8.868  1.00 64.44           H   new
ATOM      0 HD13 LEU A  20       5.881 -14.654  -7.722  1.00 64.44           H   new
ATOM      0 HD21 LEU A  20       5.170 -12.474  -9.778  1.00 74.21           H   new
ATOM      0 HD22 LEU A  20       5.799 -12.128  -8.150  1.00 74.21           H   new
ATOM      0 HD23 LEU A  20       6.633 -11.480  -9.583  1.00 74.21           H   new
ATOM    305  N   VAL A  21      11.064 -14.566  -9.137  1.00 12.02           N
ATOM    306  CA  VAL A  21      12.505 -14.368  -9.245  1.00 44.43           C
ATOM    307  C   VAL A  21      12.866 -13.665 -10.550  1.00 71.53           C
ATOM    308  O   VAL A  21      12.457 -14.089 -11.630  1.00 64.04           O
ATOM    309  CB  VAL A  21      13.263 -15.706  -9.169  1.00 20.32           C
ATOM    310  CG1 VAL A  21      13.209 -16.271  -7.757  1.00 31.34           C
ATOM    311  CG2 VAL A  21      12.693 -16.698 -10.171  1.00 70.34           C
ATOM      0  H   VAL A  21      10.602 -14.793 -10.018  1.00 12.02           H   new
ATOM      0  HA  VAL A  21      12.803 -13.743  -8.403  1.00 44.43           H   new
ATOM      0  HB  VAL A  21      14.308 -15.527  -9.423  1.00 20.32           H   new
ATOM      0 HG11 VAL A  21      13.750 -17.217  -7.723  1.00 31.34           H   new
ATOM      0 HG12 VAL A  21      13.668 -15.565  -7.065  1.00 31.34           H   new
ATOM      0 HG13 VAL A  21      12.170 -16.437  -7.471  1.00 31.34           H   new
ATOM      0 HG21 VAL A  21      13.240 -17.638 -10.104  1.00 70.34           H   new
ATOM      0 HG22 VAL A  21      11.640 -16.874  -9.950  1.00 70.34           H   new
ATOM      0 HG23 VAL A  21      12.789 -16.293 -11.179  1.00 70.34           H   new
ATOM    321  N   CYS A  22      13.637 -12.588 -10.440  1.00 50.54           N
ATOM    322  CA  CYS A  22      14.054 -11.826 -11.610  1.00 71.21           C
ATOM    323  C   CYS A  22      14.886 -12.689 -12.554  1.00 73.43           C
ATOM    324  O   CYS A  22      15.998 -13.099 -12.221  1.00 44.52           O
ATOM    325  CB  CYS A  22      14.860 -10.597 -11.183  1.00 74.43           C
ATOM    326  SG  CYS A  22      14.866  -9.248 -12.408  1.00 14.40           S
ATOM      0  H   CYS A  22      13.985 -12.224  -9.553  1.00 50.54           H   new
ATOM      0  HA  CYS A  22      13.158 -11.500 -12.138  1.00 71.21           H   new
ATOM      0  HB2 CYS A  22      14.455 -10.219 -10.244  1.00 74.43           H   new
ATOM      0  HB3 CYS A  22      15.889 -10.900 -10.988  1.00 74.43           H   new
ATOM    331  N   SER A  23      14.339 -12.961 -13.735  1.00 64.24           N
ATOM    332  CA  SER A  23      15.028 -13.779 -14.726  1.00 31.22           C
ATOM    333  C   SER A  23      15.480 -12.930 -15.910  1.00 73.33           C
ATOM    334  O   SER A  23      14.659 -12.431 -16.681  1.00 61.23           O
ATOM    335  CB  SER A  23      14.114 -14.907 -15.212  1.00 40.14           C
ATOM    336  OG  SER A  23      14.425 -16.129 -14.565  1.00 31.01           O
ATOM      0  H   SER A  23      13.421 -12.627 -14.028  1.00 64.24           H   new
ATOM      0  HA  SER A  23      15.909 -14.213 -14.254  1.00 31.22           H   new
ATOM      0  HB2 SER A  23      13.074 -14.645 -15.020  1.00 40.14           H   new
ATOM      0  HB3 SER A  23      14.219 -15.026 -16.290  1.00 40.14           H   new
ATOM      0  HG  SER A  23      14.218 -16.878 -15.163  1.00 31.01           H   new
ATOM    342  N   SER A  24      16.792 -12.771 -16.049  1.00  1.30           N
ATOM    343  CA  SER A  24      17.355 -11.980 -17.137  1.00 51.40           C
ATOM    344  C   SER A  24      17.097 -12.647 -18.485  1.00 24.35           C
ATOM    345  O   SER A  24      17.251 -12.027 -19.536  1.00 53.40           O
ATOM    346  CB  SER A  24      18.859 -11.788 -16.931  1.00 44.52           C
ATOM    347  OG  SER A  24      19.362 -10.764 -17.770  1.00 33.02           O
ATOM      0  H   SER A  24      17.485 -13.179 -15.422  1.00  1.30           H   new
ATOM      0  HA  SER A  24      16.867 -11.005 -17.134  1.00 51.40           H   new
ATOM      0  HB2 SER A  24      19.057 -11.539 -15.889  1.00 44.52           H   new
ATOM      0  HB3 SER A  24      19.380 -12.722 -17.140  1.00 44.52           H   new
ATOM      0  HG  SER A  24      18.924 -10.813 -18.645  1.00 33.02           H   new
ATOM    353  N   ARG A  25      16.702 -13.916 -18.444  1.00 75.21           N
ATOM    354  CA  ARG A  25      16.423 -14.669 -19.661  1.00 43.25           C
ATOM    355  C   ARG A  25      15.150 -14.162 -20.333  1.00 61.22           C
ATOM    356  O   ARG A  25      15.132 -13.909 -21.537  1.00  1.33           O
ATOM    357  CB  ARG A  25      16.287 -16.159 -19.343  1.00  4.34           C
ATOM    358  CG  ARG A  25      15.596 -16.954 -20.440  1.00 65.22           C
ATOM    359  CD  ARG A  25      15.865 -18.445 -20.300  1.00  1.10           C
ATOM    360  NE  ARG A  25      15.304 -19.209 -21.411  1.00 14.51           N
ATOM    361  CZ  ARG A  25      15.152 -20.528 -21.393  1.00 61.34           C
ATOM    362  NH1 ARG A  25      15.517 -21.227 -20.327  1.00  4.04           N1+
ATOM    363  NH2 ARG A  25      14.632 -21.152 -22.443  1.00 71.15           N
ATOM      0  H   ARG A  25      16.568 -14.444 -17.581  1.00 75.21           H   new
ATOM      0  HA  ARG A  25      17.257 -14.526 -20.348  1.00 43.25           H   new
ATOM      0  HB2 ARG A  25      17.279 -16.578 -19.172  1.00  4.34           H   new
ATOM      0  HB3 ARG A  25      15.728 -16.274 -18.415  1.00  4.34           H   new
ATOM      0  HG2 ARG A  25      14.522 -16.772 -20.402  1.00 65.22           H   new
ATOM      0  HG3 ARG A  25      15.943 -16.610 -21.414  1.00 65.22           H   new
ATOM      0  HD2 ARG A  25      16.940 -18.616 -20.249  1.00  1.10           H   new
ATOM      0  HD3 ARG A  25      15.440 -18.804 -19.362  1.00  1.10           H   new
ATOM      0  HE  ARG A  25      15.013 -18.702 -22.247  1.00 14.51           H   new
ATOM      0 HH11 ARG A  25      15.916 -20.752 -19.517  1.00  4.04           H   new
ATOM      0 HH12 ARG A  25      15.399 -22.240 -20.316  1.00  4.04           H   new
ATOM      0 HH21 ARG A  25      14.349 -20.618 -23.265  1.00 71.15           H   new
ATOM      0 HH22 ARG A  25      14.516 -22.165 -22.428  1.00 71.15           H   new
ATOM    377  N   TRP A  26      14.090 -14.017 -19.547  1.00 21.33           N
ATOM    378  CA  TRP A  26      12.813 -13.542 -20.068  1.00 11.24           C
ATOM    379  C   TRP A  26      12.686 -12.031 -19.902  1.00 12.14           C
ATOM    380  O   TRP A  26      11.721 -11.425 -20.366  1.00 65.35           O
ATOM    381  CB  TRP A  26      11.655 -14.244 -19.356  1.00 62.44           C
ATOM    382  CG  TRP A  26      11.887 -15.710 -19.148  1.00 50.52           C
ATOM    383  CD1 TRP A  26      12.346 -16.315 -18.014  1.00  3.34           C
ATOM    384  CD2 TRP A  26      11.673 -16.755 -20.104  1.00 24.03           C
ATOM    385  NE1 TRP A  26      12.430 -17.673 -18.206  1.00 52.52           N
ATOM    386  CE2 TRP A  26      12.022 -17.969 -19.479  1.00 21.43           C
ATOM    387  CE3 TRP A  26      11.219 -16.784 -21.425  1.00 45.11           C
ATOM    388  CZ2 TRP A  26      11.931 -19.195 -20.133  1.00  0.31           C
ATOM    389  CZ3 TRP A  26      11.130 -18.002 -22.073  1.00 40.20           C
ATOM    390  CH2 TRP A  26      11.484 -19.193 -21.425  1.00 42.31           C
ATOM      0  H   TRP A  26      14.089 -14.221 -18.548  1.00 21.33           H   new
ATOM      0  HA  TRP A  26      12.773 -13.777 -21.132  1.00 11.24           H   new
ATOM      0  HB2 TRP A  26      11.491 -13.769 -18.389  1.00 62.44           H   new
ATOM      0  HB3 TRP A  26      10.743 -14.107 -19.938  1.00 62.44           H   new
ATOM      0  HD1 TRP A  26      12.605 -15.802 -17.100  1.00  3.34           H   new
ATOM      0  HE1 TRP A  26      12.745 -18.351 -17.512  1.00 52.52           H   new
ATOM      0  HE3 TRP A  26      10.942 -15.871 -21.931  1.00 45.11           H   new
ATOM      0  HZ2 TRP A  26      12.204 -20.115 -19.637  1.00  0.31           H   new
ATOM      0  HZ3 TRP A  26      10.782 -18.036 -23.095  1.00 40.20           H   new
ATOM      0  HH2 TRP A  26      11.402 -20.129 -21.957  1.00 42.31           H   new
ATOM    401  N   LYS A  27      13.667 -11.429 -19.238  1.00 43.14           N
ATOM    402  CA  LYS A  27      13.667  -9.989 -19.013  1.00 71.25           C
ATOM    403  C   LYS A  27      12.571  -9.592 -18.029  1.00 75.02           C
ATOM    404  O   LYS A  27      12.096  -8.457 -18.039  1.00 43.34           O
ATOM    405  CB  LYS A  27      13.473  -9.244 -20.336  1.00 41.51           C
ATOM    406  CG  LYS A  27      14.297  -9.811 -21.480  1.00 33.01           C
ATOM    407  CD  LYS A  27      15.786  -9.727 -21.189  1.00 24.01           C
ATOM    408  CE  LYS A  27      16.285  -8.291 -21.250  1.00 21.54           C
ATOM    409  NZ  LYS A  27      17.725  -8.221 -21.624  1.00 72.21           N1+
ATOM      0  H   LYS A  27      14.473 -11.917 -18.846  1.00 43.14           H   new
ATOM      0  HA  LYS A  27      14.632  -9.714 -18.587  1.00 71.25           H   new
ATOM      0  HB2 LYS A  27      12.418  -9.274 -20.609  1.00 41.51           H   new
ATOM      0  HB3 LYS A  27      13.736  -8.196 -20.195  1.00 41.51           H   new
ATOM      0  HG2 LYS A  27      14.017 -10.850 -21.651  1.00 33.01           H   new
ATOM      0  HG3 LYS A  27      14.073  -9.265 -22.397  1.00 33.01           H   new
ATOM      0  HD2 LYS A  27      15.989 -10.142 -20.202  1.00 24.01           H   new
ATOM      0  HD3 LYS A  27      16.334 -10.335 -21.909  1.00 24.01           H   new
ATOM      0  HE2 LYS A  27      15.694  -7.731 -21.975  1.00 21.54           H   new
ATOM      0  HE3 LYS A  27      16.137  -7.814 -20.281  1.00 21.54           H   new
ATOM      0  HZ1 LYS A  27      18.028  -7.227 -21.655  1.00 72.21           H   new
ATOM      0  HZ2 LYS A  27      18.292  -8.734 -20.919  1.00 72.21           H   new
ATOM      0  HZ3 LYS A  27      17.862  -8.654 -22.560  1.00 72.21           H   new
ATOM    423  N   TRP A  28      12.177 -10.534 -17.180  1.00 25.15           N
ATOM    424  CA  TRP A  28      11.137 -10.281 -16.188  1.00 74.44           C
ATOM    425  C   TRP A  28      11.119 -11.377 -15.128  1.00 44.12           C
ATOM    426  O   TRP A  28      11.758 -12.418 -15.285  1.00 32.41           O
ATOM    427  CB  TRP A  28       9.769 -10.187 -16.866  1.00 20.43           C
ATOM    428  CG  TRP A  28       9.385 -11.433 -17.605  1.00 62.43           C
ATOM    429  CD1 TRP A  28       9.301 -12.697 -17.092  1.00 11.34           C
ATOM    430  CD2 TRP A  28       9.034 -11.535 -18.989  1.00 52.54           C
ATOM    431  NE1 TRP A  28       8.920 -13.578 -18.076  1.00 72.13           N
ATOM    432  CE2 TRP A  28       8.749 -12.890 -19.248  1.00 45.42           C
ATOM    433  CE3 TRP A  28       8.932 -10.614 -20.034  1.00 64.25           C
ATOM    434  CZ2 TRP A  28       8.370 -13.342 -20.509  1.00 13.35           C
ATOM    435  CZ3 TRP A  28       8.556 -11.065 -21.285  1.00 13.32           C
ATOM    436  CH2 TRP A  28       8.278 -12.419 -21.513  1.00 71.13           C
ATOM      0  H   TRP A  28      12.561 -11.479 -17.158  1.00 25.15           H   new
ATOM      0  HA  TRP A  28      11.358  -9.332 -15.699  1.00 74.44           H   new
ATOM      0  HB2 TRP A  28       9.012  -9.973 -16.112  1.00 20.43           H   new
ATOM      0  HB3 TRP A  28       9.773  -9.348 -17.561  1.00 20.43           H   new
ATOM      0  HD1 TRP A  28       9.504 -12.964 -16.065  1.00 11.34           H   new
ATOM      0  HE1 TRP A  28       8.786 -14.582 -17.953  1.00 72.13           H   new
ATOM      0  HE3 TRP A  28       9.143  -9.568 -19.867  1.00 64.25           H   new
ATOM      0  HZ2 TRP A  28       8.156 -14.385 -20.688  1.00 13.35           H   new
ATOM      0  HZ3 TRP A  28       8.475 -10.362 -22.101  1.00 13.32           H   new
ATOM      0  HH2 TRP A  28       7.985 -12.740 -22.502  1.00 71.13           H   new
ATOM    447  N   CYS A  29      10.382 -11.138 -14.048  1.00 34.14           N
ATOM    448  CA  CYS A  29      10.280 -12.104 -12.961  1.00  4.32           C
ATOM    449  C   CYS A  29       9.486 -13.332 -13.398  1.00 65.42           C
ATOM    450  O   CYS A  29       8.456 -13.214 -14.062  1.00 54.55           O
ATOM    451  CB  CYS A  29       9.617 -11.462 -11.740  1.00  2.32           C
ATOM    452  SG  CYS A  29      10.795 -10.817 -10.509  1.00 13.01           S
ATOM      0  H   CYS A  29       9.846 -10.282 -13.903  1.00 34.14           H   new
ATOM      0  HA  CYS A  29      11.288 -12.421 -12.694  1.00  4.32           H   new
ATOM      0  HB2 CYS A  29       8.975 -10.647 -12.075  1.00  2.32           H   new
ATOM      0  HB3 CYS A  29       8.973 -12.199 -11.260  1.00  2.32           H   new
ATOM    457  N   VAL A  30       9.972 -14.509 -13.020  1.00 54.32           N
ATOM    458  CA  VAL A  30       9.308 -15.759 -13.370  1.00 70.23           C
ATOM    459  C   VAL A  30       9.019 -16.595 -12.129  1.00 25.44           C
ATOM    460  O   VAL A  30       9.704 -16.474 -11.112  1.00  2.32           O
ATOM    461  CB  VAL A  30      10.157 -16.590 -14.349  1.00 41.32           C
ATOM    462  CG1 VAL A  30      10.136 -15.968 -15.737  1.00 55.45           C
ATOM    463  CG2 VAL A  30      11.584 -16.722 -13.838  1.00 33.45           C
ATOM      0  H   VAL A  30      10.824 -14.624 -12.471  1.00 54.32           H   new
ATOM      0  HA  VAL A  30       8.367 -15.493 -13.852  1.00 70.23           H   new
ATOM      0  HB  VAL A  30       9.725 -17.589 -14.418  1.00 41.32           H   new
ATOM      0 HG11 VAL A  30      10.742 -16.570 -16.415  1.00 55.45           H   new
ATOM      0 HG12 VAL A  30       9.110 -15.931 -16.103  1.00 55.45           H   new
ATOM      0 HG13 VAL A  30      10.541 -14.957 -15.689  1.00 55.45           H   new
ATOM      0 HG21 VAL A  30      12.170 -17.312 -14.543  1.00 33.45           H   new
ATOM      0 HG22 VAL A  30      12.028 -15.731 -13.738  1.00 33.45           H   new
ATOM      0 HG23 VAL A  30      11.578 -17.217 -12.867  1.00 33.45           H   new
ATOM    473  N   LEU A  31       8.002 -17.444 -12.217  1.00  4.15           N
ATOM    474  CA  LEU A  31       7.622 -18.303 -11.101  1.00 75.23           C
ATOM    475  C   LEU A  31       8.806 -19.140 -10.629  1.00 50.02           C
ATOM    476  O   LEU A  31       9.300 -19.999 -11.358  1.00 22.54           O
ATOM    477  CB  LEU A  31       6.464 -19.218 -11.506  1.00 61.45           C
ATOM    478  CG  LEU A  31       5.083 -18.827 -10.977  1.00  2.24           C
ATOM    479  CD1 LEU A  31       5.055 -18.897  -9.457  1.00 35.22           C
ATOM    480  CD2 LEU A  31       4.702 -17.435 -11.456  1.00 41.33           C
ATOM      0  H   LEU A  31       7.425 -17.556 -13.050  1.00  4.15           H   new
ATOM      0  HA  LEU A  31       7.301 -17.665 -10.277  1.00 75.23           H   new
ATOM      0  HB2 LEU A  31       6.418 -19.252 -12.594  1.00 61.45           H   new
ATOM      0  HB3 LEU A  31       6.689 -20.228 -11.165  1.00 61.45           H   new
ATOM      0  HG  LEU A  31       4.352 -19.535 -11.367  1.00  2.24           H   new
ATOM      0 HD11 LEU A  31       4.065 -18.616  -9.098  1.00 35.22           H   new
ATOM      0 HD12 LEU A  31       5.282 -19.913  -9.135  1.00 35.22           H   new
ATOM      0 HD13 LEU A  31       5.798 -18.212  -9.047  1.00 35.22           H   new
ATOM      0 HD21 LEU A  31       3.717 -17.174 -11.070  1.00 41.33           H   new
ATOM      0 HD22 LEU A  31       5.435 -16.713 -11.097  1.00 41.33           H   new
ATOM      0 HD23 LEU A  31       4.681 -17.418 -12.546  1.00 41.33           H   new
ATOM    492  N   ALA A  32       9.256 -18.884  -9.405  1.00  4.33           N
ATOM    493  CA  ALA A  32      10.379 -19.617  -8.835  1.00 15.15           C
ATOM    494  C   ALA A  32      10.138 -21.121  -8.891  1.00 55.54           C
ATOM    495  O   ALA A  32       9.034 -21.594  -8.619  1.00 73.11           O
ATOM    496  CB  ALA A  32      10.626 -19.173  -7.401  1.00 71.52           C
ATOM      0  H   ALA A  32       8.860 -18.174  -8.789  1.00  4.33           H   new
ATOM      0  HA  ALA A  32      11.265 -19.395  -9.430  1.00 15.15           H   new
ATOM      0  HB1 ALA A  32      11.468 -19.729  -6.988  1.00 71.52           H   new
ATOM      0  HB2 ALA A  32      10.852 -18.107  -7.384  1.00 71.52           H   new
ATOM      0  HB3 ALA A  32       9.736 -19.365  -6.802  1.00 71.52           H   new
ATOM    502  N   SER A  33      11.178 -21.870  -9.245  1.00  5.52           N
ATOM    503  CA  SER A  33      11.077 -23.321  -9.341  1.00  3.12           C
ATOM    504  C   SER A  33      10.615 -23.923  -8.018  1.00 20.44           C
ATOM    505  O   SER A  33      10.711 -23.303  -6.957  1.00 14.20           O
ATOM    506  CB  SER A  33      12.425 -23.922  -9.744  1.00 12.34           C
ATOM    507  OG  SER A  33      12.552 -23.989 -11.154  1.00 42.23           O
ATOM      0  H   SER A  33      12.100 -21.496  -9.470  1.00  5.52           H   new
ATOM      0  HA  SER A  33      10.338 -23.558 -10.106  1.00  3.12           H   new
ATOM      0  HB2 SER A  33      13.234 -23.319  -9.331  1.00 12.34           H   new
ATOM      0  HB3 SER A  33      12.523 -24.921  -9.319  1.00 12.34           H   new
ATOM      0  HG  SER A  33      13.422 -24.375 -11.386  1.00 42.23           H   new