USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17
USER  MOD reduce.3.24.130724 removed 586 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  22 THR OG1 :   rot  180:sc=   0.164
USER  MOD Set 1.2: A  25 ASN     :      amide:sc=   0.238  K(o=0.4,f=-0.16)
USER  MOD Set 2.1: A   7 THR OG1 :   rot  180:sc=   0.593
USER  MOD Set 2.2: A   9 THR OG1 :   rot  180:sc= 0.00202
USER  MOD Single : A   1 MET CE  :methyl -160:sc= -0.0881   (180deg=-0.665)
USER  MOD Single : A   1 MET N   :NH3+    166:sc=    1.21   (180deg=1.05)
USER  MOD Single : A   2 GLN     :      amide:sc= -0.0358  K(o=-0.036,f=-1.2!)
USER  MOD Single : A   6 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  11 LYS NZ  :NH3+    144:sc=     1.2   (180deg=0.547)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  20 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  27 LYS NZ  :NH3+   -151:sc=    1.18   (180deg=0.324)
USER  MOD Single : A  29 LYS NZ  :NH3+    172:sc=    1.25   (180deg=1.2)
USER  MOD Single : A  31 GLN     :      amide:sc= -0.0586  X(o=-0.059,f=-0.076)
USER  MOD Single : A  33 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  40 GLN     :      amide:sc=       0  X(o=0,f=-0.13)
USER  MOD Single : A  41 GLN     :      amide:sc= -0.0691  K(o=-0.069,f=-0.87)
USER  MOD Single : A  48 LYS NZ  :NH3+   -166:sc= -0.0388   (180deg=-0.151)
USER  MOD Single : A  49 GLN     :      amide:sc= -0.0556  X(o=-0.056,f=0)
USER  MOD Single : A  55 THR OG1 :   rot  180:sc=-0.000778
USER  MOD Single : A  57 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  59 TYR OH  :   rot  130:sc=  -0.102
USER  MOD Single : A  60 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  62 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  63 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  65 SER OG  :   rot  125:sc=   0.306
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HD1:sc= -0.0247  X(o=-0.025,f=0)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -12.321   4.738  -5.015  1.00  9.67           N
ATOM      2  CA  MET A   1     -12.253   5.132  -3.590  1.00 10.38           C
ATOM      3  C   MET A   1     -10.965   5.775  -3.209  1.00  9.62           C
ATOM      4  O   MET A   1      -9.990   5.629  -3.945  1.00  9.62           O
ATOM      5  CB  MET A   1     -12.481   3.888  -2.713  1.00 13.77           C
ATOM      6  CG  MET A   1     -11.487   2.726  -2.739  1.00 16.29           C
ATOM      7  SD  MET A   1     -12.020   1.240  -1.837  1.00 17.17           S
ATOM      8  CE  MET A   1     -10.428   0.369  -1.901  1.00 16.11           C
ATOM      0  H1  MET A   1     -13.126   4.096  -5.160  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -12.445   5.586  -5.604  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -11.440   4.255  -5.284  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -13.032   5.878  -3.431  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -12.548   4.231  -1.680  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -13.457   3.482  -2.978  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -11.296   2.454  -3.777  1.00 16.29           H   new
ATOM      0  HG3 MET A   1     -10.541   3.067  -2.320  1.00 16.29           H   new
ATOM      0  HE1 MET A   1     -10.589  -0.696  -1.731  1.00 16.11           H   new
ATOM      0  HE2 MET A   1      -9.972   0.515  -2.880  1.00 16.11           H   new
ATOM      0  HE3 MET A   1      -9.766   0.764  -1.130  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -10.864   6.399  -2.022  1.00  9.27           N
ATOM     21  CA  GLN A   2      -9.643   6.972  -1.547  1.00  9.07           C
ATOM     22  C   GLN A   2      -9.034   6.094  -0.509  1.00  8.72           C
ATOM     23  O   GLN A   2      -9.572   5.773   0.550  1.00  8.22           O
ATOM     24  CB  GLN A   2      -9.817   8.361  -0.909  1.00 14.46           C
ATOM     25  CG  GLN A   2     -10.113   9.449  -1.942  1.00 17.01           C
ATOM     26  CD  GLN A   2     -10.639  10.665  -1.193  1.00 20.10           C
ATOM     27  OE1 GLN A   2     -10.657  10.727   0.035  1.00 21.89           O
ATOM     28  NE2 GLN A   2     -11.125  11.642  -2.006  1.00 19.49           N
ATOM      0  H   GLN A   2     -11.648   6.508  -1.378  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -9.011   7.071  -2.430  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2     -10.629   8.324  -0.183  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2      -8.911   8.622  -0.362  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2      -9.211   9.703  -2.499  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2     -10.848   9.099  -2.667  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2     -11.081  11.531  -3.019  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2     -11.533  12.485  -1.602  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -7.790   5.653  -0.768  1.00  5.87           N
ATOM     38  CA  ILE A   3      -7.010   5.008   0.241  1.00  5.07           C
ATOM     39  C   ILE A   3      -5.845   5.823   0.688  1.00  4.01           C
ATOM     40  O   ILE A   3      -5.337   6.735   0.037  1.00  4.61           O
ATOM     41  CB  ILE A   3      -6.458   3.652  -0.085  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -5.432   3.555  -1.227  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -7.654   2.744  -0.414  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -4.587   2.295  -1.051  1.00 10.83           C
ATOM      0  H   ILE A   3      -7.326   5.743  -1.672  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -7.764   4.891   1.019  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -5.888   3.354   0.795  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -5.945   3.530  -2.189  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -4.792   4.437  -1.230  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -7.295   1.744  -0.658  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -8.319   2.691   0.448  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -8.197   3.152  -1.266  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -3.861   2.228  -1.861  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -4.063   2.339  -0.096  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -5.234   1.418  -1.070  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -5.550   5.657   1.989  1.00  4.55           N
ATOM     57  CA  PHE A   4      -4.508   6.398   2.631  1.00  4.68           C
ATOM     58  C   PHE A   4      -3.292   5.602   2.961  1.00  5.30           C
ATOM     59  O   PHE A   4      -3.421   4.432   3.315  1.00  5.58           O
ATOM     60  CB  PHE A   4      -5.019   7.000   3.951  1.00  4.83           C
ATOM     61  CG  PHE A   4      -6.071   8.052   3.876  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -6.341   8.825   2.771  1.00  6.69           C
ATOM     63  CD2 PHE A   4      -6.814   8.258   5.014  1.00  8.34           C
ATOM     64  CE1 PHE A   4      -7.456   9.628   2.711  1.00  9.10           C
ATOM     65  CE2 PHE A   4      -7.837   9.177   4.998  1.00 10.61           C
ATOM     66  CZ  PHE A   4      -8.160   9.884   3.864  1.00  8.90           C
ATOM      0  H   PHE A   4      -6.038   5.004   2.602  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -4.226   7.159   1.904  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -5.404   6.185   4.563  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -4.164   7.420   4.481  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -5.662   8.801   1.931  1.00  6.69           H   new
ATOM      0  HD2 PHE A   4      -6.596   7.702   5.914  1.00  8.34           H   new
ATOM      0  HE1 PHE A   4      -7.775  10.052   1.770  1.00  9.10           H   new
ATOM      0  HE2 PHE A   4      -8.403   9.348   5.902  1.00 10.61           H   new
ATOM      0  HZ  PHE A   4      -8.948  10.623   3.878  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -2.067   6.145   2.848  1.00  4.44           N
ATOM     77  CA  VAL A   5      -0.864   5.388   3.009  1.00  3.87           C
ATOM     78  C   VAL A   5      -0.067   6.228   3.946  1.00  4.93           C
ATOM     79  O   VAL A   5       0.138   7.414   3.694  1.00  6.84           O
ATOM     80  CB  VAL A   5      -0.092   5.096   1.756  1.00  2.99           C
ATOM     81  CG1 VAL A   5       1.130   4.222   2.084  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -1.052   4.340   0.822  1.00  9.13           C
ATOM      0  H   VAL A   5      -1.908   7.131   2.640  1.00  4.44           H   new
ATOM      0  HA  VAL A   5      -1.097   4.384   3.365  1.00  3.87           H   new
ATOM      0  HB  VAL A   5       0.272   6.011   1.289  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       1.685   4.015   1.169  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       1.775   4.748   2.788  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       0.798   3.283   2.527  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5      -0.540   4.101  -0.110  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -1.378   3.418   1.304  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -1.920   4.964   0.609  1.00  9.13           H   new
ATOM     92  N   LYS A   6       0.283   5.694   5.130  1.00  6.04           N
ATOM     93  CA  LYS A   6       0.771   6.557   6.161  1.00  6.12           C
ATOM     94  C   LYS A   6       2.168   6.189   6.525  1.00  6.57           C
ATOM     95  O   LYS A   6       2.252   5.071   7.031  1.00  5.76           O
ATOM     96  CB  LYS A   6      -0.177   6.653   7.369  1.00  7.45           C
ATOM     97  CG  LYS A   6       0.329   7.570   8.484  1.00 11.12           C
ATOM     98  CD  LYS A   6      -0.790   8.027   9.422  1.00 14.54           C
ATOM     99  CE  LYS A   6      -0.389   8.781  10.692  1.00 18.84           C
ATOM    100  NZ  LYS A   6       0.011   7.843  11.764  1.00 20.55           N
ATOM      0  H   LYS A   6       0.232   4.704   5.369  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       0.796   7.572   5.764  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6      -1.148   7.013   7.029  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6      -0.333   5.654   7.776  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6       1.092   7.047   9.061  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6       0.807   8.444   8.042  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6      -1.466   8.665   8.852  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6      -1.359   7.146   9.720  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6       0.436   9.459  10.471  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6      -1.223   9.394  11.033  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6       0.278   8.380  12.614  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6      -0.785   7.213  11.989  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6       0.822   7.276  11.444  1.00 20.55           H   new
ATOM    114  N   THR A   7       3.127   7.101   6.282  1.00  7.41           N
ATOM    115  CA  THR A   7       4.496   6.948   6.664  1.00  7.48           C
ATOM    116  C   THR A   7       4.680   6.872   8.141  1.00  8.75           C
ATOM    117  O   THR A   7       3.734   6.972   8.920  1.00  8.58           O
ATOM    118  CB  THR A   7       5.440   7.926   6.031  1.00  9.61           C
ATOM    119  OG1 THR A   7       5.094   9.258   6.380  1.00 11.78           O
ATOM    120  CG2 THR A   7       5.268   7.860   4.504  1.00  9.17           C
ATOM      0  H   THR A   7       2.940   7.980   5.800  1.00  7.41           H   new
ATOM      0  HA  THR A   7       4.776   5.979   6.251  1.00  7.48           H   new
ATOM      0  HB  THR A   7       6.448   7.677   6.363  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       5.723   9.880   5.958  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       5.949   8.567   4.030  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       5.492   6.852   4.156  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       4.241   8.115   4.242  1.00  9.17           H   new
ATOM    128  N   LEU A   8       5.937   6.639   8.559  1.00  9.84           N
ATOM    129  CA  LEU A   8       6.298   6.528   9.938  1.00 14.15           C
ATOM    130  C   LEU A   8       6.165   7.820  10.668  1.00 17.37           C
ATOM    131  O   LEU A   8       5.720   7.862  11.814  1.00 17.01           O
ATOM    132  CB  LEU A   8       7.797   6.198  10.040  1.00 16.63           C
ATOM    133  CG  LEU A   8       8.386   6.043  11.452  1.00 18.88           C
ATOM    134  CD1 LEU A   8       8.210   4.638  12.051  1.00 18.59           C
ATOM    135  CD2 LEU A   8       9.899   6.271  11.297  1.00 19.31           C
ATOM      0  H   LEU A   8       6.724   6.525   7.920  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       5.641   5.769  10.362  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8       7.977   5.271   9.495  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8       8.352   6.983   9.526  1.00 16.63           H   new
ATOM      0  HG  LEU A   8       7.875   6.742  12.114  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8       8.651   4.609  13.047  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8       7.148   4.401  12.117  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8       8.706   3.906  11.413  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8      10.383   6.175  12.269  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8      10.310   5.530  10.612  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8      10.078   7.270  10.900  1.00 19.31           H   new
ATOM    147  N   THR A   9       6.484   8.954  10.018  1.00 18.33           N
ATOM    148  CA  THR A   9       6.635  10.249  10.605  1.00 19.24           C
ATOM    149  C   THR A   9       5.283  10.872  10.650  1.00 19.48           C
ATOM    150  O   THR A   9       4.855  11.432  11.658  1.00 23.14           O
ATOM    151  CB  THR A   9       7.678  11.094   9.935  1.00 18.97           C
ATOM    152  OG1 THR A   9       7.478  11.095   8.529  1.00 20.24           O
ATOM    153  CG2 THR A   9       9.091  10.600  10.289  1.00 19.70           C
ATOM      0  H   THR A   9       6.648   8.965   9.011  1.00 18.33           H   new
ATOM      0  HA  THR A   9       7.025  10.156  11.619  1.00 19.24           H   new
ATOM      0  HB  THR A   9       7.582  12.117  10.298  1.00 18.97           H   new
ATOM      0  HG1 THR A   9       8.163  11.651   8.102  1.00 20.24           H   new
ATOM      0 HG21 THR A   9       9.831  11.227   9.792  1.00 19.70           H   new
ATOM      0 HG22 THR A   9       9.236  10.654  11.368  1.00 19.70           H   new
ATOM      0 HG23 THR A   9       9.209   9.568   9.958  1.00 19.70           H   new
ATOM    161  N   GLY A  10       4.562  10.810   9.516  1.00 19.43           N
ATOM    162  CA  GLY A  10       3.174  11.147   9.467  1.00 18.74           C
ATOM    163  C   GLY A  10       2.825  11.900   8.229  1.00 17.62           C
ATOM    164  O   GLY A  10       2.027  12.835   8.213  1.00 19.74           O
ATOM      0  H   GLY A  10       4.950  10.521   8.618  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       2.578  10.236   9.517  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       2.915  11.746  10.340  1.00 18.74           H   new
ATOM    168  N   LYS A  11       3.408  11.474   7.094  1.00 13.56           N
ATOM    169  CA  LYS A  11       2.925  11.842   5.799  1.00 11.91           C
ATOM    170  C   LYS A  11       1.928  10.857   5.293  1.00 10.18           C
ATOM    171  O   LYS A  11       2.105   9.640   5.277  1.00  9.10           O
ATOM    172  CB  LYS A  11       4.011  12.004   4.722  1.00 13.43           C
ATOM    173  CG  LYS A  11       3.725  12.913   3.525  1.00 16.69           C
ATOM    174  CD  LYS A  11       4.951  13.136   2.637  1.00 17.92           C
ATOM    175  CE  LYS A  11       4.644  14.132   1.516  1.00 20.81           C
ATOM    176  NZ  LYS A  11       5.734  14.322   0.534  1.00 21.93           N
ATOM      0  H   LYS A  11       4.226  10.865   7.075  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       2.474  12.821   5.961  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       4.911  12.376   5.212  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       4.245  11.012   4.336  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       2.925  12.476   2.927  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       3.364  13.876   3.885  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       5.779  13.507   3.241  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       5.270  12.187   2.207  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       3.752  13.797   0.986  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       4.405  15.097   1.963  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       5.328  14.461  -0.413  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       6.295  15.157   0.796  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       6.346  13.481   0.528  1.00 21.93           H   new
ATOM    190  N   THR A  12       0.758  11.442   4.979  1.00  9.63           N
ATOM    191  CA  THR A  12      -0.442  10.806   4.533  1.00  9.85           C
ATOM    192  C   THR A  12      -0.532  10.932   3.051  1.00 11.66           C
ATOM    193  O   THR A  12      -0.720  12.023   2.514  1.00 12.33           O
ATOM    194  CB  THR A  12      -1.764  11.277   5.062  1.00 10.85           C
ATOM    195  OG1 THR A  12      -1.716  11.150   6.475  1.00 10.91           O
ATOM    196  CG2 THR A  12      -2.916  10.404   4.535  1.00  9.63           C
ATOM      0  H   THR A  12       0.644  12.454   5.044  1.00  9.63           H   new
ATOM      0  HA  THR A  12      -0.320   9.797   4.927  1.00  9.85           H   new
ATOM      0  HB  THR A  12      -1.940  12.305   4.744  1.00 10.85           H   new
ATOM      0  HG1 THR A  12      -2.566  11.451   6.860  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -3.862  10.769   4.935  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -2.940  10.452   3.446  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -2.763   9.372   4.850  1.00  9.63           H   new
ATOM    204  N   ILE A  13      -0.303   9.835   2.308  1.00 10.42           N
ATOM    205  CA  ILE A  13      -0.309   9.797   0.878  1.00 11.84           C
ATOM    206  C   ILE A  13      -1.642   9.339   0.394  1.00 10.55           C
ATOM    207  O   ILE A  13      -2.105   8.264   0.773  1.00 11.92           O
ATOM    208  CB  ILE A  13       0.710   8.836   0.342  1.00 14.86           C
ATOM    209  CG1 ILE A  13       2.177   9.124   0.703  1.00 14.87           C
ATOM    210  CG2 ILE A  13       0.599   8.720  -1.188  1.00 17.08           C
ATOM    211  CD1 ILE A  13       3.121   7.925   0.629  1.00 16.46           C
ATOM      0  H   ILE A  13      -0.103   8.927   2.727  1.00 10.42           H   new
ATOM      0  HA  ILE A  13      -0.079  10.804   0.531  1.00 11.84           H   new
ATOM      0  HB  ILE A  13       0.459   7.901   0.842  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       2.551   9.900   0.036  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13       2.211   9.529   1.714  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       1.348   8.018  -1.555  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13      -0.396   8.362  -1.455  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13       0.766   9.698  -1.640  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       4.129   8.238   0.902  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       2.782   7.152   1.318  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       3.127   7.529  -0.386  1.00 16.46           H   new
ATOM    223  N   THR A  14      -2.426  10.113  -0.376  1.00  9.39           N
ATOM    224  CA  THR A  14      -3.770   9.843  -0.784  1.00  9.63           C
ATOM    225  C   THR A  14      -3.655   9.330  -2.178  1.00 11.20           C
ATOM    226  O   THR A  14      -3.066   9.977  -3.041  1.00 11.63           O
ATOM    227  CB  THR A  14      -4.647  11.055  -0.899  1.00 10.38           C
ATOM    228  OG1 THR A  14      -4.672  11.745   0.342  1.00 16.30           O
ATOM    229  CG2 THR A  14      -6.126  10.676  -1.084  1.00 11.66           C
ATOM      0  H   THR A  14      -2.090  11.003  -0.744  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -4.211   9.177  -0.042  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -4.249  11.628  -1.736  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -5.244  12.537   0.264  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -6.727  11.582  -1.163  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -6.239  10.085  -1.993  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -6.462  10.092  -0.227  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -4.150   8.107  -2.439  1.00  8.29           N
ATOM    238  CA  LEU A  15      -4.085   7.413  -3.689  1.00  9.03           C
ATOM    239  C   LEU A  15      -5.474   7.090  -4.119  1.00  8.59           C
ATOM    240  O   LEU A  15      -6.265   6.659  -3.281  1.00  7.79           O
ATOM    241  CB  LEU A  15      -3.264   6.113  -3.668  1.00 11.08           C
ATOM    242  CG  LEU A  15      -1.764   6.417  -3.812  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -1.050   5.072  -3.596  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -1.414   7.011  -5.187  1.00 15.88           C
ATOM      0  H   LEU A  15      -4.631   7.563  -1.723  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -3.572   8.081  -4.381  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -3.444   5.578  -2.736  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -3.587   5.459  -4.478  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -1.452   7.170  -3.088  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15       0.027   5.213  -3.685  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -1.285   4.691  -2.602  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -1.385   4.357  -4.348  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15      -0.343   7.207  -5.237  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -1.690   6.304  -5.970  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -1.961   7.943  -5.331  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -5.840   7.175  -5.410  1.00 11.04           N
ATOM    257  CA  GLU A  16      -7.132   6.753  -5.854  1.00 11.50           C
ATOM    258  C   GLU A  16      -6.983   5.400  -6.461  1.00 10.13           C
ATOM    259  O   GLU A  16      -6.188   5.043  -7.329  1.00  9.83           O
ATOM    260  CB  GLU A  16      -7.919   7.666  -6.809  1.00 17.22           C
ATOM    261  CG  GLU A  16      -9.402   7.312  -6.935  1.00 23.33           C
ATOM    262  CD  GLU A  16     -10.198   8.290  -7.788  1.00 26.99           C
ATOM    263  OE1 GLU A  16      -9.788   9.464  -7.990  1.00 28.90           O
ATOM    264  OE2 GLU A  16     -11.265   7.876  -8.315  1.00 28.86           O
ATOM      0  H   GLU A  16      -5.238   7.538  -6.149  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -7.748   6.777  -4.955  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -7.831   8.696  -6.464  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -7.461   7.621  -7.797  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16      -9.492   6.314  -7.364  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16      -9.842   7.272  -5.939  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -7.895   4.501  -6.052  1.00  8.99           N
ATOM    272  CA  VAL A  17      -7.942   3.113  -6.393  1.00  8.85           C
ATOM    273  C   VAL A  17      -9.349   2.723  -6.694  1.00  8.04           C
ATOM    274  O   VAL A  17     -10.284   3.463  -6.392  1.00  8.99           O
ATOM    275  CB  VAL A  17      -7.374   2.273  -5.287  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -5.850   2.481  -5.272  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -8.009   2.507  -3.906  1.00 10.54           C
ATOM      0  H   VAL A  17      -8.661   4.768  -5.433  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -7.332   2.942  -7.280  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -7.619   1.232  -5.497  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -5.409   1.881  -4.476  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -5.432   2.176  -6.231  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -5.628   3.534  -5.098  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -7.534   1.856  -3.172  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -7.869   3.547  -3.613  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -9.075   2.284  -3.953  1.00 10.54           H   new
ATOM    287  N   GLU A  18      -9.533   1.469  -7.143  1.00  7.29           N
ATOM    288  CA  GLU A  18     -10.729   0.714  -6.934  1.00  7.08           C
ATOM    289  C   GLU A  18     -10.386  -0.554  -6.229  1.00  6.45           C
ATOM    290  O   GLU A  18      -9.223  -0.951  -6.180  1.00  5.28           O
ATOM    291  CB  GLU A  18     -11.298   0.536  -8.352  1.00 10.28           C
ATOM    292  CG  GLU A  18     -12.162   1.719  -8.794  1.00 12.65           C
ATOM    293  CD  GLU A  18     -13.125   1.357  -9.916  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -13.979   0.467  -9.656  1.00 14.33           O
ATOM    295  OE2 GLU A  18     -13.052   1.896 -11.052  1.00 18.17           O
ATOM      0  H   GLU A  18      -8.823   0.962  -7.671  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -11.477   1.184  -6.295  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18     -10.475   0.409  -9.056  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -11.893  -0.377  -8.389  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -12.729   2.089  -7.940  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -11.516   2.532  -9.124  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -11.269  -1.209  -5.536  1.00  7.24           N
ATOM    303  CA  PRO A  19     -10.943  -2.324  -4.696  1.00  7.07           C
ATOM    304  C   PRO A  19     -10.373  -3.485  -5.436  1.00  6.65           C
ATOM    305  O   PRO A  19      -9.771  -4.329  -4.775  1.00  6.37           O
ATOM    306  CB  PRO A  19     -12.261  -2.756  -4.057  1.00  7.61           C
ATOM    307  CG  PRO A  19     -13.276  -1.691  -4.502  1.00  8.16           C
ATOM    308  CD  PRO A  19     -12.696  -1.050  -5.773  1.00  7.49           C
ATOM      0  HA  PRO A  19     -10.180  -2.018  -3.980  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -12.557  -3.750  -4.392  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -12.180  -2.797  -2.971  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.249  -2.140  -4.702  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -13.424  -0.944  -3.722  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -13.023  -1.560  -6.679  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -12.983  -0.004  -5.875  1.00  7.49           H   new
ATOM    316  N   SER A  20     -10.648  -3.669  -6.740  1.00  6.80           N
ATOM    317  CA  SER A  20     -10.273  -4.855  -7.446  1.00  6.28           C
ATOM    318  C   SER A  20      -8.888  -4.780  -7.990  1.00  8.45           C
ATOM    319  O   SER A  20      -8.446  -5.579  -8.815  1.00  7.26           O
ATOM    320  CB  SER A  20     -11.211  -5.195  -8.616  1.00  8.57           C
ATOM    321  OG  SER A  20     -12.518  -5.615  -8.252  1.00 11.13           O
ATOM      0  H   SER A  20     -11.139  -2.983  -7.314  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -10.341  -5.640  -6.692  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -11.296  -4.318  -9.257  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -10.749  -5.982  -9.212  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -13.037  -5.806  -9.061  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -8.137  -3.723  -7.632  1.00  7.50           N
ATOM    328  CA  ASP A  21      -6.853  -3.383  -8.162  1.00  7.70           C
ATOM    329  C   ASP A  21      -5.866  -4.132  -7.334  1.00  7.08           C
ATOM    330  O   ASP A  21      -6.093  -4.400  -6.155  1.00  8.11           O
ATOM    331  CB  ASP A  21      -6.483  -1.891  -8.132  1.00 11.00           C
ATOM    332  CG  ASP A  21      -7.269  -1.041  -9.120  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -7.535  -1.493 -10.266  1.00 14.36           O
ATOM    334  OD2 ASP A  21      -7.623   0.106  -8.739  1.00 18.03           O
ATOM      0  H   ASP A  21      -8.450  -3.060  -6.923  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -6.859  -3.641  -9.221  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -6.647  -1.506  -7.126  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -5.419  -1.786  -8.344  1.00 11.00           H   new
ATOM    339  N   THR A  22      -4.727  -4.569  -7.901  1.00  5.37           N
ATOM    340  CA  THR A  22      -3.764  -5.335  -7.173  1.00  6.01           C
ATOM    341  C   THR A  22      -2.848  -4.485  -6.362  1.00  8.01           C
ATOM    342  O   THR A  22      -2.690  -3.325  -6.740  1.00  8.11           O
ATOM    343  CB  THR A  22      -2.914  -6.279  -7.971  1.00  8.92           C
ATOM    344  OG1 THR A  22      -2.300  -5.607  -9.061  1.00 10.22           O
ATOM    345  CG2 THR A  22      -3.875  -7.339  -8.535  1.00  9.65           C
ATOM      0  H   THR A  22      -4.472  -4.390  -8.872  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -4.411  -5.943  -6.540  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -2.129  -6.707  -7.348  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -1.749  -6.240  -9.567  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -3.313  -8.060  -9.129  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -4.371  -7.855  -7.713  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -4.623  -6.855  -9.163  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -2.341  -5.047  -5.250  1.00  8.32           N
ATOM    354  CA  ILE A  23      -1.402  -4.542  -4.297  1.00  9.92           C
ATOM    355  C   ILE A  23      -0.191  -4.055  -5.015  1.00 10.01           C
ATOM    356  O   ILE A  23       0.280  -2.992  -4.611  1.00  8.71           O
ATOM    357  CB  ILE A  23      -1.143  -5.481  -3.156  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -2.419  -5.986  -2.463  1.00 11.38           C
ATOM    359  CG2 ILE A  23      -0.130  -4.975  -2.115  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -3.188  -4.879  -1.742  1.00 12.30           C
ATOM      0  H   ILE A  23      -2.635  -5.988  -4.988  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -1.836  -3.682  -3.786  1.00  9.92           H   new
ATOM      0  HB  ILE A  23      -0.676  -6.331  -3.654  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -3.070  -6.448  -3.205  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -2.153  -6.762  -1.745  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23      -0.010  -5.722  -1.331  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       0.831  -4.799  -2.598  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23      -0.492  -4.045  -1.677  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -4.078  -5.300  -1.274  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -2.552  -4.433  -0.978  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -3.483  -4.114  -2.460  1.00 12.30           H   new
ATOM    372  N   GLU A  24       0.303  -4.809  -6.013  1.00  9.54           N
ATOM    373  CA  GLU A  24       1.432  -4.476  -6.824  1.00 11.81           C
ATOM    374  C   GLU A  24       1.289  -3.205  -7.588  1.00 11.14           C
ATOM    375  O   GLU A  24       2.184  -2.368  -7.694  1.00 10.62           O
ATOM    376  CB  GLU A  24       1.728  -5.573  -7.861  1.00 19.24           C
ATOM    377  CG  GLU A  24       2.874  -5.178  -8.796  1.00 27.76           C
ATOM    378  CD  GLU A  24       3.100  -6.270  -9.832  1.00 32.92           C
ATOM    379  OE1 GLU A  24       3.834  -7.262  -9.582  1.00 36.51           O
ATOM    380  OE2 GLU A  24       2.636  -6.097 -10.991  1.00 34.80           O
ATOM      0  H   GLU A  24      -0.112  -5.705  -6.268  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       2.241  -4.368  -6.101  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24       1.982  -6.500  -7.347  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24       0.831  -5.769  -8.448  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       2.641  -4.236  -9.293  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       3.785  -5.017  -8.220  1.00 27.76           H   new
ATOM    387  N   ASN A  25       0.077  -2.921  -8.096  1.00  9.43           N
ATOM    388  CA  ASN A  25      -0.221  -1.708  -8.792  1.00 10.96           C
ATOM    389  C   ASN A  25      -0.312  -0.498  -7.928  1.00  9.68           C
ATOM    390  O   ASN A  25       0.031   0.598  -8.369  1.00  9.33           O
ATOM    391  CB  ASN A  25      -1.401  -1.808  -9.774  1.00 16.78           C
ATOM    392  CG  ASN A  25      -1.087  -2.686 -10.977  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -0.183  -2.256 -11.692  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -1.715  -3.882 -11.136  1.00 24.70           N
ATOM      0  H   ASN A  25      -0.719  -3.554  -8.020  1.00  9.43           H   new
ATOM      0  HA  ASN A  25       0.668  -1.563  -9.406  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -2.270  -2.209  -9.253  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -1.669  -0.809 -10.118  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -1.444  -4.503 -11.898  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -2.457  -4.158 -10.493  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -0.784  -0.678  -6.681  1.00  6.52           N
ATOM    402  CA  VAL A  26      -0.731   0.251  -5.596  1.00  5.53           C
ATOM    403  C   VAL A  26       0.681   0.548  -5.223  1.00  4.42           C
ATOM    404  O   VAL A  26       1.073   1.700  -5.043  1.00  3.40           O
ATOM    405  CB  VAL A  26      -1.400  -0.304  -4.374  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -1.427   0.762  -3.265  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -2.876  -0.597  -4.692  1.00  8.12           C
ATOM      0  H   VAL A  26      -1.241  -1.549  -6.411  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -1.241   1.153  -5.933  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -0.856  -1.197  -4.066  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -1.914   0.354  -2.380  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26      -0.407   1.054  -3.016  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -1.979   1.635  -3.613  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -3.366  -1.001  -3.806  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -3.373   0.325  -4.993  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -2.936  -1.323  -5.503  1.00  8.12           H   new
ATOM    417  N   LYS A  27       1.596  -0.436  -5.291  1.00  2.64           N
ATOM    418  CA  LYS A  27       2.993  -0.157  -5.171  1.00  4.14           C
ATOM    419  C   LYS A  27       3.613   0.559  -6.322  1.00  5.58           C
ATOM    420  O   LYS A  27       4.560   1.314  -6.107  1.00  4.11           O
ATOM    421  CB  LYS A  27       3.858  -1.389  -4.856  1.00  3.97           C
ATOM    422  CG  LYS A  27       3.435  -2.142  -3.593  1.00  7.45           C
ATOM    423  CD  LYS A  27       3.998  -3.556  -3.439  1.00  9.02           C
ATOM    424  CE  LYS A  27       5.484  -3.815  -3.697  1.00 12.90           C
ATOM    425  NZ  LYS A  27       5.884  -5.160  -3.228  1.00 15.47           N
ATOM      0  H   LYS A  27       1.369  -1.421  -5.429  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       2.991   0.520  -4.317  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       3.820  -2.073  -5.704  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       4.896  -1.073  -4.748  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       3.736  -1.555  -2.725  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       2.347  -2.201  -3.576  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       3.783  -3.883  -2.422  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       3.434  -4.205  -4.108  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       5.692  -3.722  -4.763  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       6.081  -3.058  -3.189  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       6.887  -5.147  -2.952  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       5.303  -5.429  -2.409  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       5.744  -5.850  -3.993  1.00 15.47           H   new
ATOM    439  N   ALA A  28       3.108   0.454  -7.564  1.00  6.61           N
ATOM    440  CA  ALA A  28       3.554   1.342  -8.593  1.00  7.74           C
ATOM    441  C   ALA A  28       3.027   2.714  -8.346  1.00  9.17           C
ATOM    442  O   ALA A  28       3.680   3.741  -8.519  1.00 11.45           O
ATOM    443  CB  ALA A  28       2.933   0.899  -9.928  1.00  7.68           C
ATOM      0  H   ALA A  28       2.407  -0.229  -7.852  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       4.644   1.330  -8.610  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28       3.264   1.567 -10.723  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       3.248  -0.119 -10.156  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28       1.846   0.935  -9.853  1.00  7.68           H   new
ATOM    449  N   LYS A  29       1.788   2.887  -7.852  1.00  8.96           N
ATOM    450  CA  LYS A  29       1.179   4.145  -7.552  1.00  7.90           C
ATOM    451  C   LYS A  29       1.841   4.930  -6.472  1.00  6.92           C
ATOM    452  O   LYS A  29       1.892   6.158  -6.508  1.00  6.87           O
ATOM    453  CB  LYS A  29      -0.292   3.917  -7.166  1.00 10.28           C
ATOM    454  CG  LYS A  29      -1.036   3.676  -8.481  1.00 14.94           C
ATOM    455  CD  LYS A  29      -2.533   3.486  -8.228  1.00 19.69           C
ATOM    456  CE  LYS A  29      -3.369   3.988  -9.406  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -4.820   3.720  -9.283  1.00 24.98           N
ATOM      0  H   LYS A  29       1.174   2.098  -7.650  1.00  8.96           H   new
ATOM      0  HA  LYS A  29       1.281   4.740  -8.460  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -0.393   3.062  -6.497  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29      -0.697   4.782  -6.641  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -0.880   4.520  -9.153  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29      -0.631   2.794  -8.977  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -2.743   2.430  -8.055  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -2.821   4.020  -7.323  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -3.218   5.062  -9.512  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -3.002   3.523 -10.321  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -5.329   4.206 -10.049  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -4.991   2.696  -9.349  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -5.161   4.069  -8.364  1.00 24.98           H   new
ATOM    471  N   ILE A  30       2.431   4.286  -5.450  1.00  4.57           N
ATOM    472  CA  ILE A  30       3.224   4.910  -4.436  1.00  5.58           C
ATOM    473  C   ILE A  30       4.501   5.374  -5.047  1.00  7.26           C
ATOM    474  O   ILE A  30       5.049   6.430  -4.735  1.00  9.46           O
ATOM    475  CB  ILE A  30       3.333   4.075  -3.195  1.00  5.36           C
ATOM    476  CG1 ILE A  30       1.924   3.712  -2.697  1.00  2.94           C
ATOM    477  CG2 ILE A  30       4.209   4.796  -2.157  1.00  2.78           C
ATOM    478  CD1 ILE A  30       1.698   2.524  -1.763  1.00  2.00           C
ATOM      0  H   ILE A  30       2.351   3.277  -5.324  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       2.731   5.804  -4.054  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       3.835   3.129  -3.400  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       1.527   4.593  -2.193  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       1.307   3.545  -3.580  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       4.285   4.185  -1.258  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       5.204   4.958  -2.571  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       3.760   5.757  -1.906  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       0.636   2.440  -1.531  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       2.036   1.609  -2.249  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       2.260   2.674  -0.841  1.00  2.00           H   new
ATOM    490  N   GLN A  31       5.046   4.682  -6.064  1.00  7.06           N
ATOM    491  CA  GLN A  31       6.193   5.164  -6.769  1.00  8.67           C
ATOM    492  C   GLN A  31       5.805   6.352  -7.582  1.00 10.90           C
ATOM    493  O   GLN A  31       6.487   7.372  -7.665  1.00  9.63           O
ATOM    494  CB  GLN A  31       6.786   3.966  -7.528  1.00  9.12           C
ATOM    495  CG  GLN A  31       7.952   4.248  -8.477  1.00 10.76           C
ATOM    496  CD  GLN A  31       8.442   3.117  -9.371  1.00 13.78           C
ATOM    497  OE1 GLN A  31       9.611   2.756  -9.240  1.00 14.48           O
ATOM    498  NE2 GLN A  31       7.627   2.459 -10.237  1.00 14.76           N
ATOM      0  H   GLN A  31       4.691   3.786  -6.399  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       6.989   5.540  -6.126  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       7.118   3.232  -6.794  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       5.986   3.502  -8.104  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       7.664   5.080  -9.120  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       8.796   4.587  -7.876  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       6.657   2.754 -10.349  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       7.985   1.670 -10.775  1.00 14.76           H   new
ATOM    507  N   ASP A  32       4.652   6.196  -8.257  1.00 10.93           N
ATOM    508  CA  ASP A  32       4.173   7.278  -9.059  1.00 14.01           C
ATOM    509  C   ASP A  32       3.869   8.548  -8.342  1.00 14.04           C
ATOM    510  O   ASP A  32       4.226   9.665  -8.713  1.00 13.39           O
ATOM    511  CB  ASP A  32       2.864   6.753  -9.673  1.00 18.01           C
ATOM    512  CG  ASP A  32       2.460   7.478 -10.949  1.00 24.33           C
ATOM    513  OD1 ASP A  32       3.147   8.357 -11.533  1.00 26.29           O
ATOM    514  OD2 ASP A  32       1.459   6.983 -11.533  1.00 25.17           O
ATOM      0  H   ASP A  32       4.072   5.357  -8.251  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       4.961   7.547  -9.763  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       2.973   5.690  -9.887  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       2.063   6.850  -8.940  1.00 18.01           H   new
ATOM    519  N   LYS A  33       3.162   8.487  -7.199  1.00 14.22           N
ATOM    520  CA  LYS A  33       2.658   9.567  -6.410  1.00 14.00           C
ATOM    521  C   LYS A  33       3.633  10.254  -5.517  1.00 12.37           C
ATOM    522  O   LYS A  33       3.893  11.440  -5.715  1.00 12.17           O
ATOM    523  CB  LYS A  33       1.367   9.198  -5.661  1.00 18.62           C
ATOM    524  CG  LYS A  33       0.719  10.455  -5.076  1.00 24.00           C
ATOM    525  CD  LYS A  33      -0.521  10.998  -5.790  1.00 27.61           C
ATOM    526  CE  LYS A  33      -1.083  12.302  -5.222  1.00 27.64           C
ATOM    527  NZ  LYS A  33      -2.303  12.745  -5.933  1.00 30.06           N
ATOM      0  H   LYS A  33       2.920   7.585  -6.788  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       2.422  10.320  -7.163  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       0.672   8.704  -6.340  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       1.590   8.490  -4.863  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33       0.449  10.246  -4.041  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       1.470  11.244  -5.056  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33      -0.276  11.154  -6.841  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33      -1.302  10.239  -5.754  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -1.310  12.167  -4.165  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33      -0.324  13.081  -5.288  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -2.647  13.632  -5.513  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33      -2.082  12.900  -6.937  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33      -3.038  12.014  -5.849  1.00 30.06           H   new
ATOM    541  N   GLU A  34       4.194   9.463  -4.585  1.00 10.11           N
ATOM    542  CA  GLU A  34       5.192   9.978  -3.699  1.00 10.07           C
ATOM    543  C   GLU A  34       6.553   9.886  -4.299  1.00  9.32           C
ATOM    544  O   GLU A  34       7.259  10.891  -4.235  1.00 11.61           O
ATOM    545  CB  GLU A  34       5.048   9.304  -2.324  1.00 14.77           C
ATOM    546  CG  GLU A  34       5.915   9.844  -1.185  1.00 18.75           C
ATOM    547  CD  GLU A  34       5.680  11.313  -0.864  1.00 22.28           C
ATOM    548  OE1 GLU A  34       4.769  11.989  -1.412  1.00 21.95           O
ATOM    549  OE2 GLU A  34       6.476  11.920  -0.099  1.00 25.19           O
ATOM      0  H   GLU A  34       3.961   8.480  -4.445  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       5.041  11.046  -3.540  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       4.004   9.379  -2.019  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       5.269   8.243  -2.443  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       5.727   9.253  -0.289  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       6.964   9.704  -1.444  1.00 18.75           H   new
ATOM    556  N   GLY A  35       6.979   8.693  -4.751  1.00  7.22           N
ATOM    557  CA  GLY A  35       8.328   8.520  -5.193  1.00  6.29           C
ATOM    558  C   GLY A  35       9.163   7.692  -4.278  1.00  6.93           C
ATOM    559  O   GLY A  35      10.376   7.893  -4.326  1.00  7.41           O
ATOM      0  H   GLY A  35       6.397   7.857  -4.810  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       8.320   8.057  -6.180  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35       8.792   9.500  -5.305  1.00  6.29           H   new
ATOM    563  N   ILE A  36       8.602   6.678  -3.596  1.00  5.86           N
ATOM    564  CA  ILE A  36       9.210   5.600  -2.879  1.00  6.07           C
ATOM    565  C   ILE A  36       9.182   4.468  -3.847  1.00  6.36           C
ATOM    566  O   ILE A  36       8.092   4.234  -4.367  1.00  6.18           O
ATOM    567  CB  ILE A  36       8.490   5.238  -1.614  1.00  7.47           C
ATOM    568  CG1 ILE A  36       8.394   6.476  -0.706  1.00  8.52           C
ATOM    569  CG2 ILE A  36       9.169   4.035  -0.938  1.00  7.36           C
ATOM    570  CD1 ILE A  36       7.403   6.301   0.444  1.00  9.49           C
ATOM      0  H   ILE A  36       7.586   6.610  -3.543  1.00  5.86           H   new
ATOM      0  HA  ILE A  36      10.212   5.869  -2.545  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       7.470   4.925  -1.835  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36       9.380   6.697  -0.297  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       8.097   7.337  -1.305  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       8.635   3.784  -0.021  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       9.151   3.180  -1.614  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36      10.202   4.287  -0.699  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36       7.382   7.209   1.047  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36       6.408   6.110   0.041  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36       7.711   5.460   1.065  1.00  9.49           H   new
ATOM    582  N   PRO A  37      10.253   3.790  -4.135  1.00  8.65           N
ATOM    583  CA  PRO A  37      10.184   2.744  -5.114  1.00  9.18           C
ATOM    584  C   PRO A  37       9.581   1.467  -4.639  1.00  9.85           C
ATOM    585  O   PRO A  37       9.628   1.341  -3.416  1.00  8.51           O
ATOM    586  CB  PRO A  37      11.645   2.389  -5.381  1.00 11.42           C
ATOM    587  CG  PRO A  37      12.480   2.982  -4.235  1.00  9.27           C
ATOM    588  CD  PRO A  37      11.626   4.217  -3.910  1.00  8.33           C
ATOM      0  HA  PRO A  37       9.580   3.107  -5.946  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37      11.774   1.308  -5.430  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37      11.969   2.793  -6.340  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      12.572   2.302  -3.388  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      13.492   3.243  -4.546  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      11.776   4.541  -2.880  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      11.888   5.059  -4.551  1.00  8.33           H   new
ATOM    596  N   PRO A  38       9.091   0.474  -5.321  1.00  8.71           N
ATOM    597  CA  PRO A  38       8.393  -0.624  -4.718  1.00  9.08           C
ATOM    598  C   PRO A  38       9.193  -1.526  -3.843  1.00  9.28           C
ATOM    599  O   PRO A  38       8.486  -2.155  -3.056  1.00  6.50           O
ATOM    600  CB  PRO A  38       7.753  -1.397  -5.869  1.00 10.31           C
ATOM    601  CG  PRO A  38       7.614  -0.329  -6.965  1.00 10.81           C
ATOM    602  CD  PRO A  38       8.802   0.620  -6.739  1.00 12.00           C
ATOM      0  HA  PRO A  38       7.669  -0.210  -4.016  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       8.378  -2.229  -6.193  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       6.786  -1.815  -5.587  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       7.647  -0.775  -7.959  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       6.664   0.200  -6.884  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       9.659   0.343  -7.353  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       8.547   1.649  -6.992  1.00 12.00           H   new
ATOM    610  N   ASP A  39      10.523  -1.647  -3.995  1.00 11.20           N
ATOM    611  CA  ASP A  39      11.349  -2.572  -3.282  1.00 14.96           C
ATOM    612  C   ASP A  39      11.350  -2.351  -1.808  1.00 13.99           C
ATOM    613  O   ASP A  39      11.396  -3.281  -1.004  1.00 13.75           O
ATOM    614  CB  ASP A  39      12.810  -2.513  -3.760  1.00 24.16           C
ATOM    615  CG  ASP A  39      13.060  -3.224  -5.082  1.00 31.06           C
ATOM    616  OD1 ASP A  39      12.735  -2.695  -6.178  1.00 34.22           O
ATOM    617  OD2 ASP A  39      13.540  -4.386  -5.000  1.00 35.55           O
ATOM      0  H   ASP A  39      11.050  -1.069  -4.650  1.00 11.20           H   new
ATOM      0  HA  ASP A  39      10.912  -3.548  -3.493  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      13.107  -1.469  -3.859  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      13.449  -2.955  -2.996  1.00 24.16           H   new
ATOM    622  N   GLN A  40      11.203  -1.081  -1.390  1.00 11.60           N
ATOM    623  CA  GLN A  40      11.184  -0.636  -0.032  1.00 10.76           C
ATOM    624  C   GLN A  40       9.991  -0.920   0.815  1.00  8.01           C
ATOM    625  O   GLN A  40      10.025  -0.825   2.041  1.00  8.96           O
ATOM    626  CB  GLN A  40      11.756   0.777   0.170  1.00 11.14           C
ATOM    627  CG  GLN A  40      13.167   1.026  -0.368  1.00 14.85           C
ATOM    628  CD  GLN A  40      13.508   2.451   0.041  1.00 16.11           C
ATOM    629  OE1 GLN A  40      13.181   3.417  -0.647  1.00 20.52           O
ATOM    630  NE2 GLN A  40      14.078   2.612   1.265  1.00 18.16           N
ATOM      0  H   GLN A  40      11.089  -0.311  -2.050  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      11.892  -1.347   0.395  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      11.080   1.489  -0.303  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      11.754   0.996   1.238  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      13.879   0.315   0.052  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      13.201   0.909  -1.451  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      14.340   1.795   1.817  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      14.243   3.550   1.631  1.00 18.16           H   new
ATOM    639  N   GLN A  41       8.818  -1.275   0.260  1.00  6.52           N
ATOM    640  CA  GLN A  41       7.567  -1.065   0.919  1.00  3.87           C
ATOM    641  C   GLN A  41       6.984  -2.292   1.532  1.00  4.79           C
ATOM    642  O   GLN A  41       6.571  -3.245   0.872  1.00  6.34           O
ATOM    643  CB  GLN A  41       6.564  -0.563  -0.133  1.00  4.20           C
ATOM    644  CG  GLN A  41       7.141   0.407  -1.166  1.00  3.20           C
ATOM    645  CD  GLN A  41       6.090   1.034  -2.071  1.00  4.89           C
ATOM    646  OE1 GLN A  41       4.923   0.644  -2.079  1.00  5.21           O
ATOM    647  NE2 GLN A  41       6.500   1.967  -2.970  1.00  7.13           N
ATOM      0  H   GLN A  41       8.737  -1.713  -0.658  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       7.752  -0.357   1.726  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.149  -1.424  -0.657  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       5.737  -0.073   0.380  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       7.679   1.199  -0.646  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       7.869  -0.122  -1.781  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       7.467   2.291  -2.964  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       5.840   2.344  -3.651  1.00  7.13           H   new
ATOM    656  N   ARG A  42       6.954  -2.375   2.874  1.00  5.73           N
ATOM    657  CA  ARG A  42       6.234  -3.375   3.599  1.00  6.97           C
ATOM    658  C   ARG A  42       4.923  -2.734   3.901  1.00  7.15           C
ATOM    659  O   ARG A  42       4.896  -1.904   4.807  1.00  7.33           O
ATOM    660  CB  ARG A  42       6.851  -3.760   4.955  1.00 13.23           C
ATOM    661  CG  ARG A  42       8.080  -4.666   4.860  1.00 21.27           C
ATOM    662  CD  ARG A  42       8.377  -5.231   6.251  1.00 26.14           C
ATOM    663  NE  ARG A  42       9.619  -6.043   6.115  1.00 32.26           N
ATOM    664  CZ  ARG A  42      10.573  -6.117   7.088  1.00 34.32           C
ATOM    665  NH1 ARG A  42      10.517  -5.536   8.322  1.00 35.30           N
ATOM    666  NH2 ARG A  42      11.583  -7.029   6.983  1.00 36.39           N
ATOM      0  H   ARG A  42       7.451  -1.720   3.478  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       6.208  -4.286   3.001  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       7.127  -2.849   5.486  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       6.092  -4.261   5.556  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       7.900  -5.476   4.153  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       8.937  -4.104   4.489  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       8.514  -4.428   6.976  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       7.549  -5.844   6.607  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       9.763  -6.569   5.253  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42       9.703  -4.983   8.589  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42      11.289  -5.655   8.977  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42      11.624  -7.654   6.178  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42      12.297  -7.085   7.709  1.00 36.39           H   new
ATOM    680  N   LEU A  43       3.806  -3.051   3.223  1.00  4.65           N
ATOM    681  CA  LEU A  43       2.512  -2.539   3.554  1.00  3.51           C
ATOM    682  C   LEU A  43       1.789  -3.502   4.431  1.00  5.56           C
ATOM    683  O   LEU A  43       1.560  -4.678   4.152  1.00  4.19           O
ATOM    684  CB  LEU A  43       1.557  -2.287   2.375  1.00  3.74           C
ATOM    685  CG  LEU A  43       2.015  -1.183   1.408  1.00  6.32           C
ATOM    686  CD1 LEU A  43       1.387  -1.458   0.031  1.00  6.41           C
ATOM    687  CD2 LEU A  43       1.595   0.231   1.841  1.00  9.55           C
ATOM      0  H   LEU A  43       3.802  -3.682   2.421  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       2.742  -1.581   4.020  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       1.437  -3.215   1.816  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       0.576  -2.023   2.769  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       3.105  -1.209   1.391  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       1.699  -0.686  -0.672  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       1.716  -2.432  -0.331  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43       0.301  -1.451   0.119  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       1.953   0.957   1.111  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       0.508   0.285   1.903  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       2.026   0.456   2.817  1.00  9.55           H   new
ATOM    699  N   ILE A  44       1.513  -2.941   5.622  1.00  4.58           N
ATOM    700  CA  ILE A  44       0.838  -3.601   6.696  1.00  5.55           C
ATOM    701  C   ILE A  44      -0.473  -2.921   6.889  1.00  5.46           C
ATOM    702  O   ILE A  44      -0.572  -1.695   6.899  1.00  6.04           O
ATOM    703  CB  ILE A  44       1.602  -3.574   7.987  1.00  6.80           C
ATOM    704  CG1 ILE A  44       2.978  -4.246   7.847  1.00 10.31           C
ATOM    705  CG2 ILE A  44       0.825  -4.229   9.142  1.00  7.39           C
ATOM    706  CD1 ILE A  44       3.869  -4.371   9.082  1.00 13.90           C
ATOM      0  H   ILE A  44       1.773  -1.981   5.846  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       0.725  -4.651   6.428  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       1.745  -2.520   8.227  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       2.816  -5.250   7.455  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       3.538  -3.695   7.091  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       1.421  -4.184  10.053  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44      -0.114  -3.698   9.296  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       0.617  -5.270   8.896  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       4.800  -4.867   8.810  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       4.088  -3.378   9.475  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       3.355  -4.957   9.844  1.00 13.90           H   new
ATOM    718  N   PHE A  45      -1.531  -3.729   7.082  1.00  6.75           N
ATOM    719  CA  PHE A  45      -2.818  -3.219   7.439  1.00  4.70           C
ATOM    720  C   PHE A  45      -3.056  -3.900   8.743  1.00  6.34           C
ATOM    721  O   PHE A  45      -3.275  -5.110   8.759  1.00  5.45           O
ATOM    722  CB  PHE A  45      -3.787  -3.645   6.324  1.00  5.51           C
ATOM    723  CG  PHE A  45      -5.207  -3.279   6.589  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -5.568  -2.064   7.122  1.00  6.86           C
ATOM    725  CD2 PHE A  45      -6.187  -4.185   6.260  1.00  5.87           C
ATOM    726  CE1 PHE A  45      -6.846  -1.802   7.558  1.00  6.68           C
ATOM    727  CE2 PHE A  45      -7.496  -3.853   6.518  1.00  6.64           C
ATOM    728  CZ  PHE A  45      -7.820  -2.706   7.203  1.00  6.84           C
ATOM      0  H   PHE A  45      -1.494  -4.744   6.990  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -2.927  -2.139   7.538  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -3.472  -3.186   5.387  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -3.719  -4.724   6.189  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -4.821  -1.288   7.201  1.00  6.86           H   new
ATOM      0  HD2 PHE A  45      -5.935  -5.134   5.810  1.00  5.87           H   new
ATOM      0  HE1 PHE A  45      -7.074  -0.928   8.151  1.00  6.68           H   new
ATOM      0  HE2 PHE A  45      -8.285  -4.506   6.176  1.00  6.64           H   new
ATOM      0  HZ  PHE A  45      -8.850  -2.513   7.465  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -3.113  -3.210   9.896  1.00  6.53           N
ATOM    739  CA  ALA A  46      -3.258  -3.778  11.201  1.00  7.15           C
ATOM    740  C   ALA A  46      -2.088  -4.629  11.554  1.00  9.00           C
ATOM    741  O   ALA A  46      -0.974  -4.122  11.671  1.00 11.15           O
ATOM    742  CB  ALA A  46      -4.618  -4.466  11.410  1.00  8.99           C
ATOM      0  H   ALA A  46      -3.054  -2.192   9.918  1.00  6.53           H   new
ATOM      0  HA  ALA A  46      -3.262  -2.955  11.915  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -4.667  -4.877  12.418  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -5.418  -3.738  11.275  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -4.734  -5.271  10.684  1.00  8.99           H   new
ATOM    748  N   GLY A  47      -2.206  -5.950  11.782  1.00  9.35           N
ATOM    749  CA  GLY A  47      -1.067  -6.780  12.022  1.00 11.68           C
ATOM    750  C   GLY A  47      -0.728  -7.773  10.963  1.00 11.14           C
ATOM    751  O   GLY A  47      -0.226  -8.861  11.240  1.00 13.93           O
ATOM      0  H   GLY A  47      -3.097  -6.445  11.800  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47      -0.202  -6.135  12.173  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47      -1.229  -7.319  12.955  1.00 11.68           H   new
ATOM    755  N   LYS A  48      -1.135  -7.484   9.714  1.00 10.47           N
ATOM    756  CA  LYS A  48      -1.034  -8.356   8.586  1.00  8.82           C
ATOM    757  C   LYS A  48      -0.437  -7.613   7.441  1.00  7.68           C
ATOM    758  O   LYS A  48      -0.745  -6.475   7.089  1.00  6.47           O
ATOM    759  CB  LYS A  48      -2.375  -8.968   8.146  1.00  9.74           C
ATOM    760  CG  LYS A  48      -2.318  -9.897   6.932  1.00 14.14           C
ATOM    761  CD  LYS A  48      -3.584 -10.708   6.649  1.00 16.32           C
ATOM    762  CE  LYS A  48      -3.472 -12.096   7.283  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -2.436 -13.049   6.825  1.00 23.92           N
ATOM      0  H   LYS A  48      -1.560  -6.587   9.479  1.00 10.47           H   new
ATOM      0  HA  LYS A  48      -0.401  -9.187   8.896  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -2.792  -9.524   8.986  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -3.068  -8.156   7.926  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48      -2.090  -9.297   6.051  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48      -1.489 -10.591   7.069  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -4.455 -10.187   7.047  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48      -3.732 -10.802   5.573  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -3.325 -11.950   8.353  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -4.438 -12.586   7.158  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -2.655 -13.999   7.186  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -2.418 -13.069   5.785  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -1.506 -12.749   7.181  1.00 23.92           H   new
ATOM    777  N   GLN A  49       0.406  -8.316   6.665  1.00  8.89           N
ATOM    778  CA  GLN A  49       1.095  -7.715   5.566  1.00  7.18           C
ATOM    779  C   GLN A  49       0.589  -8.213   4.256  1.00  8.23           C
ATOM    780  O   GLN A  49       0.358  -9.390   3.984  1.00  9.70           O
ATOM    781  CB  GLN A  49       2.581  -8.100   5.670  1.00 11.67           C
ATOM    782  CG  GLN A  49       3.479  -7.515   4.578  1.00 15.82           C
ATOM    783  CD  GLN A  49       4.880  -8.087   4.736  1.00 20.21           C
ATOM    784  OE1 GLN A  49       5.795  -7.332   5.062  1.00 23.23           O
ATOM    785  NE2 GLN A  49       4.956  -9.421   4.482  1.00 20.67           N
ATOM      0  H   GLN A  49       0.611  -9.306   6.800  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       0.940  -6.637   5.612  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       2.957  -7.777   6.641  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       2.662  -9.187   5.642  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       3.081  -7.757   3.592  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       3.505  -6.428   4.653  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       4.118  -9.939   4.218  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       5.851  -9.904   4.555  1.00 20.67           H   new
ATOM    794  N   LEU A  50       0.517  -7.279   3.290  1.00  6.51           N
ATOM    795  CA  LEU A  50      -0.164  -7.389   2.038  1.00  7.41           C
ATOM    796  C   LEU A  50       0.775  -7.825   0.967  1.00  8.27           C
ATOM    797  O   LEU A  50       1.948  -7.469   0.866  1.00  8.34           O
ATOM    798  CB  LEU A  50      -0.940  -6.138   1.592  1.00  7.13           C
ATOM    799  CG  LEU A  50      -1.664  -5.304   2.662  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -1.911  -3.900   2.084  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -2.960  -5.937   3.197  1.00  8.14           C
ATOM      0  H   LEU A  50       0.974  -6.373   3.396  1.00  6.51           H   new
ATOM      0  HA  LEU A  50      -0.928  -8.147   2.207  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50      -0.240  -5.480   1.076  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -1.682  -6.452   0.858  1.00  7.13           H   new
ATOM      0  HG  LEU A  50      -1.019  -5.254   3.539  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -2.424  -3.287   2.825  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50      -0.957  -3.438   1.829  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -2.527  -3.979   1.188  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -3.403  -5.281   3.946  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -3.663  -6.076   2.376  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -2.734  -6.903   3.649  1.00  8.14           H   new
ATOM    813  N   GLU A  51       0.223  -8.704   0.112  1.00  9.43           N
ATOM    814  CA  GLU A  51       0.984  -9.376  -0.895  1.00 11.90           C
ATOM    815  C   GLU A  51       0.644  -8.886  -2.260  1.00 11.49           C
ATOM    816  O   GLU A  51      -0.527  -8.795  -2.627  1.00  9.88           O
ATOM    817  CB  GLU A  51       0.714 -10.890  -0.852  1.00 16.56           C
ATOM    818  CG  GLU A  51       1.458 -11.761  -1.865  1.00 26.06           C
ATOM    819  CD  GLU A  51       1.144 -13.225  -1.594  1.00 29.86           C
ATOM    820  OE1 GLU A  51       0.010 -13.712  -1.850  1.00 32.13           O
ATOM    821  OE2 GLU A  51       2.110 -13.881  -1.119  1.00 33.44           O
ATOM      0  H   GLU A  51      -0.766  -8.952   0.120  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       2.034  -9.168  -0.688  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51       0.960 -11.249   0.147  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51      -0.355 -11.047  -0.993  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       1.160 -11.495  -2.879  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51       2.532 -11.588  -1.792  1.00 26.06           H   new
ATOM    828  N   ASP A  52       1.670  -8.664  -3.101  1.00 12.71           N
ATOM    829  CA  ASP A  52       1.581  -8.027  -4.378  1.00 16.56           C
ATOM    830  C   ASP A  52       0.447  -8.468  -5.238  1.00 15.83           C
ATOM    831  O   ASP A  52      -0.396  -7.687  -5.674  1.00 17.21           O
ATOM    832  CB  ASP A  52       2.882  -8.269  -5.163  1.00 21.05           C
ATOM    833  CG  ASP A  52       4.126  -7.667  -4.525  1.00 25.12           C
ATOM    834  OD1 ASP A  52       4.285  -7.761  -3.279  1.00 28.37           O
ATOM    835  OD2 ASP A  52       4.900  -6.906  -5.165  1.00 25.82           O
ATOM      0  H   ASP A  52       2.623  -8.948  -2.873  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       1.409  -6.975  -4.151  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       3.030  -9.343  -5.274  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       2.768  -7.857  -6.166  1.00 21.05           H   new
ATOM    840  N   GLY A  53       0.378  -9.763  -5.597  1.00 15.00           N
ATOM    841  CA  GLY A  53      -0.585 -10.283  -6.517  1.00 11.77           C
ATOM    842  C   GLY A  53      -1.996 -10.402  -6.053  1.00 11.10           C
ATOM    843  O   GLY A  53      -2.866 -10.807  -6.823  1.00 11.25           O
ATOM      0  H   GLY A  53       1.015 -10.472  -5.234  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -0.577  -9.650  -7.404  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53      -0.250 -11.272  -6.828  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -2.282 -10.096  -4.776  1.00  8.53           N
ATOM    848  CA  ARG A  54      -3.652 -10.016  -4.373  1.00  9.05           C
ATOM    849  C   ARG A  54      -4.218  -8.676  -4.695  1.00  8.96           C
ATOM    850  O   ARG A  54      -3.521  -7.775  -5.159  1.00 11.60           O
ATOM    851  CB  ARG A  54      -3.919 -10.243  -2.875  1.00  7.97           C
ATOM    852  CG  ARG A  54      -3.192 -11.432  -2.244  1.00  9.62           C
ATOM    853  CD  ARG A  54      -3.313 -12.783  -2.952  1.00 12.20           C
ATOM    854  NE  ARG A  54      -4.715 -13.272  -2.824  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -5.278 -14.255  -3.585  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -4.572 -14.965  -4.514  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -6.618 -14.498  -3.497  1.00 25.50           N
ATOM      0  H   ARG A  54      -1.595  -9.910  -4.046  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -4.123 -10.827  -4.928  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -3.637  -9.340  -2.334  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -4.991 -10.379  -2.732  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -2.134 -11.182  -2.173  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -3.560 -11.551  -1.225  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -3.043 -12.683  -4.003  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -2.622 -13.502  -2.513  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -5.300 -12.837  -2.111  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -3.582 -14.769  -4.661  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -5.035 -15.691  -5.060  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54      -7.196 -13.946  -2.864  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -7.042 -15.232  -4.065  1.00 25.50           H   new
ATOM    871  N   THR A  55      -5.510  -8.451  -4.399  1.00  9.05           N
ATOM    872  CA  THR A  55      -6.184  -7.204  -4.589  1.00  9.03           C
ATOM    873  C   THR A  55      -6.400  -6.537  -3.274  1.00  8.15           C
ATOM    874  O   THR A  55      -6.221  -7.180  -2.241  1.00  5.91           O
ATOM    875  CB  THR A  55      -7.522  -7.372  -5.246  1.00 11.15           C
ATOM    876  OG1 THR A  55      -8.392  -8.219  -4.510  1.00 11.95           O
ATOM    877  CG2 THR A  55      -7.354  -7.983  -6.648  1.00 11.71           C
ATOM      0  H   THR A  55      -6.114  -9.174  -4.008  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -5.548  -6.601  -5.238  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -7.961  -6.376  -5.297  1.00 11.15           H   new
ATOM      0  HG1 THR A  55      -9.249  -8.294  -4.979  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -8.333  -8.100  -7.114  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -6.737  -7.325  -7.260  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -6.873  -8.958  -6.565  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -6.998  -5.333  -3.306  1.00  6.91           N
ATOM    886  CA  LEU A  56      -7.292  -4.541  -2.151  1.00  8.29           C
ATOM    887  C   LEU A  56      -8.451  -5.156  -1.445  1.00  8.05           C
ATOM    888  O   LEU A  56      -8.451  -5.160  -0.215  1.00 10.17           O
ATOM    889  CB  LEU A  56      -7.569  -3.096  -2.599  1.00  6.60           C
ATOM    890  CG  LEU A  56      -6.294  -2.285  -2.884  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -6.728  -0.984  -3.580  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -5.522  -1.877  -1.618  1.00  9.85           C
ATOM      0  H   LEU A  56      -7.290  -4.891  -4.177  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -6.454  -4.511  -1.455  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -8.186  -3.115  -3.497  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -8.147  -2.589  -1.826  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -5.637  -2.915  -3.484  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -5.849  -0.378  -3.800  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -7.245  -1.223  -4.509  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -7.398  -0.427  -2.925  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -4.636  -1.308  -1.900  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -6.161  -1.262  -0.984  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -5.221  -2.771  -1.071  1.00  9.85           H   new
ATOM    904  N   SER A  57      -9.443  -5.776  -2.109  1.00  8.92           N
ATOM    905  CA  SER A  57     -10.663  -6.330  -1.608  1.00  9.00           C
ATOM    906  C   SER A  57     -10.430  -7.653  -0.964  1.00  9.44           C
ATOM    907  O   SER A  57     -11.121  -8.022  -0.016  1.00 10.91           O
ATOM    908  CB  SER A  57     -11.754  -6.425  -2.688  1.00 10.32           C
ATOM    909  OG  SER A  57     -13.026  -6.704  -2.124  1.00 13.59           O
ATOM      0  H   SER A  57      -9.378  -5.902  -3.119  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -11.031  -5.641  -0.848  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -11.799  -5.488  -3.243  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -11.493  -7.206  -3.402  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -13.696  -6.756  -2.837  1.00 13.59           H   new
ATOM    915  N   ASP A  58      -9.378  -8.362  -1.412  1.00  9.11           N
ATOM    916  CA  ASP A  58      -9.067  -9.645  -0.860  1.00  7.91           C
ATOM    917  C   ASP A  58      -8.699  -9.506   0.577  1.00  9.12           C
ATOM    918  O   ASP A  58      -8.988 -10.445   1.317  1.00  8.61           O
ATOM    919  CB  ASP A  58      -8.025 -10.300  -1.782  1.00  8.41           C
ATOM    920  CG  ASP A  58      -7.802 -11.794  -1.588  1.00 11.50           C
ATOM    921  OD1 ASP A  58      -8.776 -12.567  -1.788  1.00 11.70           O
ATOM    922  OD2 ASP A  58      -6.704 -12.243  -1.162  1.00 10.05           O
ATOM      0  H   ASP A  58      -8.747  -8.050  -2.150  1.00  9.11           H   new
ATOM      0  HA  ASP A  58      -9.919 -10.324  -0.835  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -8.327 -10.130  -2.816  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -7.072  -9.790  -1.640  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -8.029  -8.425   1.014  1.00  7.97           N
ATOM    928  CA  TYR A  59      -7.787  -7.973   2.349  1.00  8.45           C
ATOM    929  C   TYR A  59      -8.852  -7.085   2.893  1.00 10.98           C
ATOM    930  O   TYR A  59      -8.793  -6.751   4.076  1.00 12.95           O
ATOM    931  CB  TYR A  59      -6.443  -7.225   2.329  1.00  7.94           C
ATOM    932  CG  TYR A  59      -5.287  -8.122   2.048  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -4.996  -9.094   2.975  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -4.574  -8.083   0.872  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -3.882  -9.884   2.820  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -3.431  -8.825   0.691  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -3.102  -9.694   1.704  1.00  6.76           C
ATOM    938  OH  TYR A  59      -1.831 -10.280   1.526  1.00  7.63           O
ATOM      0  H   TYR A  59      -7.604  -7.789   0.340  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -7.775  -8.841   3.008  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -6.480  -6.440   1.573  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -6.291  -6.734   3.290  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -5.644  -9.237   3.827  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -4.922  -7.451   0.068  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -3.626 -10.633   3.555  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -2.825  -8.730  -0.198  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -1.791 -10.715   0.649  1.00  7.63           H   new
ATOM    948  N   ASN A  60      -9.923  -6.832   2.120  1.00 12.38           N
ATOM    949  CA  ASN A  60     -10.971  -5.959   2.549  1.00 13.94           C
ATOM    950  C   ASN A  60     -10.521  -4.576   2.874  1.00 14.16           C
ATOM    951  O   ASN A  60     -10.840  -4.045   3.937  1.00 14.26           O
ATOM    952  CB  ASN A  60     -11.804  -6.590   3.677  1.00 19.23           C
ATOM    953  CG  ASN A  60     -12.461  -7.917   3.325  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -12.145  -8.961   3.892  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -13.447  -7.785   2.398  1.00 24.09           N
ATOM      0  H   ASN A  60     -10.063  -7.234   1.193  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -11.625  -5.836   1.685  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -11.160  -6.739   4.544  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -12.580  -5.885   3.974  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -13.997  -8.597   2.119  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -13.636  -6.874   1.981  1.00 24.09           H   new
ATOM    962  N   ILE A  61      -9.741  -3.901   2.011  1.00 11.08           N
ATOM    963  CA  ILE A  61      -9.431  -2.512   2.152  1.00 11.78           C
ATOM    964  C   ILE A  61     -10.614  -1.755   1.655  1.00 13.74           C
ATOM    965  O   ILE A  61     -10.969  -1.836   0.480  1.00 14.60           O
ATOM    966  CB  ILE A  61      -8.175  -2.174   1.406  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -6.956  -2.963   1.914  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -7.794  -0.692   1.246  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -6.709  -2.698   3.398  1.00 11.42           C
ATOM      0  H   ILE A  61      -9.314  -4.333   1.192  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -9.237  -2.246   3.191  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -8.456  -2.487   0.400  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -7.116  -4.029   1.754  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -6.073  -2.683   1.340  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -6.863  -0.614   0.685  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -8.586  -0.169   0.710  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -7.663  -0.242   2.230  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -5.842  -3.269   3.730  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -6.525  -1.635   3.552  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -7.584  -3.001   3.972  1.00 11.42           H   new
ATOM    981  N   GLN A  62     -11.246  -1.070   2.625  1.00 13.97           N
ATOM    982  CA  GLN A  62     -12.326  -0.188   2.307  1.00 15.52           C
ATOM    983  C   GLN A  62     -11.858   1.186   1.974  1.00 13.94           C
ATOM    984  O   GLN A  62     -10.678   1.532   2.023  1.00 12.15           O
ATOM    985  CB  GLN A  62     -13.306  -0.014   3.480  1.00 19.53           C
ATOM    986  CG  GLN A  62     -14.018  -1.343   3.743  1.00 26.38           C
ATOM    987  CD  GLN A  62     -14.923  -1.302   4.966  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -16.142  -1.414   4.844  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -14.432  -1.076   6.214  1.00 32.71           N
ATOM      0  H   GLN A  62     -11.014  -1.125   3.617  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -12.812  -0.659   1.452  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -12.770   0.308   4.373  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -14.035   0.763   3.248  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -14.611  -1.610   2.868  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -13.273  -2.128   3.875  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -13.427  -0.977   6.356  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -15.069  -1.005   7.008  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -12.775   2.131   1.701  1.00 11.73           N
ATOM    999  CA  LYS A  63     -12.424   3.517   1.699  1.00 11.97           C
ATOM   1000  C   LYS A  63     -11.988   4.068   3.013  1.00 10.41           C
ATOM   1001  O   LYS A  63     -12.609   3.767   4.031  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -13.524   4.415   1.107  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -14.797   4.468   1.954  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -15.925   5.209   1.234  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -17.287   5.487   1.873  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -17.124   6.529   2.912  1.00 25.97           N
ATOM      0  H   LYS A  63     -13.753   1.938   1.483  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -11.551   3.538   1.047  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -13.133   5.426   0.992  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -13.777   4.055   0.110  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -15.120   3.454   2.189  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -14.583   4.963   2.902  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -15.519   6.177   0.940  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -16.122   4.654   0.317  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -17.998   5.817   1.116  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -17.690   4.575   2.313  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -18.045   6.726   3.353  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -16.457   6.195   3.637  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -16.756   7.399   2.477  1.00 25.97           H   new
ATOM   1020  N   GLU A  64     -10.885   4.838   2.991  1.00 10.04           N
ATOM   1021  CA  GLU A  64     -10.353   5.574   4.096  1.00 10.94           C
ATOM   1022  C   GLU A  64      -9.781   4.666   5.130  1.00  9.74           C
ATOM   1023  O   GLU A  64      -9.853   4.852   6.344  1.00  9.42           O
ATOM   1024  CB  GLU A  64     -11.328   6.640   4.622  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -11.675   7.778   3.661  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -12.711   8.829   4.033  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -13.782   8.430   4.565  1.00 31.72           O
ATOM   1028  OE2 GLU A  64     -12.526  10.066   3.879  1.00 32.61           O
ATOM      0  H   GLU A  64     -10.328   4.953   2.144  1.00 10.04           H   new
ATOM      0  HA  GLU A  64      -9.506   6.160   3.738  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64     -12.254   6.143   4.911  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64     -10.903   7.075   5.527  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64     -10.747   8.307   3.444  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -12.006   7.319   2.729  1.00 24.16           H   new
ATOM   1035  N   SER A  65      -9.268   3.529   4.628  1.00  6.85           N
ATOM   1036  CA  SER A  65      -8.424   2.609   5.326  1.00  6.90           C
ATOM   1037  C   SER A  65      -7.019   3.099   5.244  1.00  4.72           C
ATOM   1038  O   SER A  65      -6.504   3.360   4.158  1.00  3.91           O
ATOM   1039  CB  SER A  65      -8.501   1.110   4.993  1.00  7.28           C
ATOM   1040  OG  SER A  65      -7.593   0.310   5.736  1.00 10.56           O
ATOM      0  H   SER A  65      -9.456   3.233   3.670  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -8.827   2.613   6.339  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -9.516   0.758   5.178  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -8.305   0.973   3.930  1.00  7.28           H   new
ATOM      0  HG  SER A  65      -8.086  -0.398   6.202  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -6.283   3.094   6.370  1.00  4.48           N
ATOM   1047  CA  THR A  66      -4.932   3.561   6.354  1.00  3.80           C
ATOM   1048  C   THR A  66      -4.026   2.379   6.392  1.00  4.60           C
ATOM   1049  O   THR A  66      -4.044   1.558   7.308  1.00  5.33           O
ATOM   1050  CB  THR A  66      -4.547   4.518   7.443  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -5.406   5.648   7.489  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -3.154   5.148   7.275  1.00  3.40           C
ATOM      0  H   THR A  66      -6.617   2.772   7.278  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -4.835   4.141   5.436  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -4.596   3.890   8.332  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -5.122   6.245   8.212  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -2.959   5.826   8.106  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -2.399   4.362   7.262  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -3.116   5.703   6.338  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -3.149   2.279   5.378  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -2.027   1.394   5.434  1.00  3.85           C
ATOM   1062  C   LEU A  67      -0.832   1.897   6.169  1.00  3.80           C
ATOM   1063  O   LEU A  67      -0.507   3.054   5.908  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -1.579   0.947   4.032  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -2.724   0.537   3.091  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -2.209   0.175   1.688  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -3.573  -0.644   3.589  1.00  8.12           C
ATOM      0  H   LEU A  67      -3.218   2.815   4.513  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -2.416   0.555   6.011  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -1.019   1.759   3.568  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -0.893   0.106   4.136  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -3.358   1.423   3.063  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -3.049  -0.109   1.054  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -1.701   1.036   1.253  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -1.511  -0.659   1.761  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -4.355  -0.862   2.862  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -2.938  -1.521   3.713  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -4.028  -0.387   4.545  1.00  8.12           H   new
ATOM   1079  N   HIS A  68      -0.166   1.047   6.971  1.00  2.94           N
ATOM   1080  CA  HIS A  68       1.038   1.501   7.595  1.00  4.17           C
ATOM   1081  C   HIS A  68       2.160   1.213   6.658  1.00  5.32           C
ATOM   1082  O   HIS A  68       2.515   0.063   6.404  1.00  7.70           O
ATOM   1083  CB  HIS A  68       1.271   0.684   8.878  1.00  5.57           C
ATOM   1084  CG  HIS A  68       0.264   1.116   9.903  1.00  9.95           C
ATOM   1085  ND1 HIS A  68      -0.169   0.199  10.839  1.00 13.74           N
ATOM   1086  CD2 HIS A  68      -0.534   2.203  10.073  1.00 12.79           C
ATOM   1087  CE1 HIS A  68      -1.167   0.784  11.555  1.00 14.75           C
ATOM   1088  NE2 HIS A  68      -1.420   2.001  11.111  1.00 16.30           N
ATOM      0  H   HIS A  68      -0.444   0.088   7.181  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       0.974   2.563   7.831  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68       1.170  -0.382   8.673  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       2.283   0.843   9.250  1.00  5.57           H   new
ATOM      0  HD2 HIS A  68      -0.482   3.102   9.477  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68      -1.684   0.314  12.379  1.00 14.75           H   new
ATOM      0  HE2 HIS A  68      -2.122   2.653  11.461  1.00 16.30           H   new
ATOM   1096  N   LEU A  69       2.794   2.288   6.156  1.00  5.29           N
ATOM   1097  CA  LEU A  69       3.931   2.058   5.320  1.00  3.97           C
ATOM   1098  C   LEU A  69       5.206   2.061   6.090  1.00  5.07           C
ATOM   1099  O   LEU A  69       5.730   3.118   6.436  1.00  4.34           O
ATOM   1100  CB  LEU A  69       3.998   3.293   4.405  1.00  6.08           C
ATOM   1101  CG  LEU A  69       5.107   3.241   3.340  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       5.339   1.921   2.587  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       4.770   4.199   2.185  1.00  6.87           C
ATOM      0  H   LEU A  69       2.540   3.263   6.315  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       3.827   1.097   4.816  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       3.037   3.411   3.905  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       4.146   4.179   5.022  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       5.983   3.465   3.949  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       6.152   2.048   1.873  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       5.600   1.137   3.298  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       4.430   1.641   2.055  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       5.560   4.157   1.435  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       3.823   3.904   1.732  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       4.688   5.216   2.568  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       5.777   0.857   6.277  1.00  4.29           N
ATOM   1116  CA  VAL A  70       6.999   0.562   6.959  1.00  6.26           C
ATOM   1117  C   VAL A  70       7.985   0.251   5.886  1.00  9.22           C
ATOM   1118  O   VAL A  70       7.694  -0.431   4.904  1.00  9.36           O
ATOM   1119  CB  VAL A  70       6.787  -0.643   7.826  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       8.029  -1.263   8.488  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       5.685  -0.295   8.841  1.00  8.54           C
ATOM      0  H   VAL A  70       5.339   0.010   5.915  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       7.339   1.383   7.590  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       6.486  -1.454   7.163  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       7.731  -2.125   9.085  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70       8.732  -1.580   7.718  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70       8.506  -0.524   9.131  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       5.504  -1.152   9.490  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       6.001   0.556   9.444  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       4.767  -0.043   8.310  1.00  8.54           H   new
ATOM   1131  N   LEU A  71       9.203   0.779   6.103  1.00 12.71           N
ATOM   1132  CA  LEU A  71      10.226   0.732   5.105  1.00 16.06           C
ATOM   1133  C   LEU A  71      11.299  -0.282   5.301  1.00 18.09           C
ATOM   1134  O   LEU A  71      11.873  -0.405   6.383  1.00 19.26           O
ATOM   1135  CB  LEU A  71      10.852   2.107   4.817  1.00 17.10           C
ATOM   1136  CG  LEU A  71       9.877   3.167   4.278  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      10.397   4.608   4.414  1.00 19.57           C
ATOM   1138  CD2 LEU A  71       9.558   2.919   2.794  1.00 17.51           C
ATOM      0  H   LEU A  71       9.479   1.239   6.970  1.00 12.71           H   new
ATOM      0  HA  LEU A  71       9.666   0.398   4.232  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      11.302   2.484   5.735  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      11.659   1.978   4.096  1.00 17.10           H   new
ATOM      0  HG  LEU A  71       8.983   3.066   4.893  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71       9.657   5.301   4.013  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      10.573   4.833   5.466  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      11.330   4.712   3.859  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71       8.867   3.683   2.438  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71      10.478   2.963   2.212  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71       9.103   1.935   2.679  1.00 17.51           H   new