USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=16
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   7 THR OG1 :   rot -149:sc=    1.03
USER  MOD Set 1.2: A   9 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A   1 MET CE  :methyl  180:sc=  -0.156   (180deg=-0.156)
USER  MOD Single : A   1 MET N   :NH3+   -173:sc=    2.36   (180deg=2.13)
USER  MOD Single : A   2 GLN     :      amide:sc=   -0.57  X(o=-0.57,f=-0.24)
USER  MOD Single : A   6 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  11 LYS NZ  :NH3+   -123:sc=    1.26   (180deg=0.597)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot   26:sc=   0.115
USER  MOD Single : A  20 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  22 THR OG1 :   rot  180:sc=  0.0119
USER  MOD Single : A  25 ASN     :      amide:sc= -0.0384  K(o=-0.038,f=-1.9!)
USER  MOD Single : A  27 LYS NZ  :NH3+   -152:sc=   0.394   (180deg=0.119)
USER  MOD Single : A  29 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  31 GLN     :      amide:sc=  -0.375  X(o=-0.38,f=-0.8)
USER  MOD Single : A  33 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  40 GLN     :      amide:sc= -0.0922  K(o=-0.092,f=-4.3!)
USER  MOD Single : A  41 GLN     :      amide:sc=   0.632  K(o=0.63,f=-3.6!)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=    -1.3  K(o=-1.3,f=-2.5!)
USER  MOD Single : A  55 THR OG1 :   rot  -72:sc=    1.32
USER  MOD Single : A  57 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  59 TYR OH  :   rot  130:sc=   0.615
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+   -165:sc=-0.00846   (180deg=-0.205)
USER  MOD Single : A  65 SER OG  :   rot   65:sc=     1.9
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HE2:sc=   0.376  K(o=0.38,f=-2.1!)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -12.886   2.557  -2.677  1.00  9.67           N
ATOM      2  CA  MET A   1     -12.614   3.160  -1.353  1.00 10.38           C
ATOM      3  C   MET A   1     -11.321   3.895  -1.260  1.00  9.62           C
ATOM      4  O   MET A   1     -10.279   3.521  -1.796  1.00  9.62           O
ATOM      5  CB  MET A   1     -12.690   2.180  -0.170  1.00 13.77           C
ATOM      6  CG  MET A   1     -11.682   1.041   0.000  1.00 16.29           C
ATOM      7  SD  MET A   1     -12.278  -0.128   1.259  1.00 17.17           S
ATOM      8  CE  MET A   1     -10.574  -0.524   1.748  1.00 16.11           C
ATOM      0  H1  MET A   1     -13.851   2.170  -2.690  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -12.794   3.284  -3.415  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -12.204   1.793  -2.857  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -13.434   3.873  -1.272  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -12.645   2.779   0.739  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -13.679   1.723  -0.202  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -11.539   0.525  -0.949  1.00 16.29           H   new
ATOM      0  HG3 MET A   1     -10.712   1.442   0.294  1.00 16.29           H   new
ATOM      0  HE1 MET A   1     -10.588  -1.260   2.552  1.00 16.11           H   new
ATOM      0  HE2 MET A   1     -10.035  -0.932   0.893  1.00 16.11           H   new
ATOM      0  HE3 MET A   1     -10.075   0.381   2.093  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -11.331   5.126  -0.719  1.00  9.27           N
ATOM     21  CA  GLN A   2     -10.139   5.829  -0.357  1.00  9.07           C
ATOM     22  C   GLN A   2      -9.490   5.326   0.887  1.00  8.72           C
ATOM     23  O   GLN A   2     -10.061   5.229   1.972  1.00  8.22           O
ATOM     24  CB  GLN A   2     -10.637   7.274  -0.189  1.00 14.46           C
ATOM     25  CG  GLN A   2      -9.426   8.206  -0.121  1.00 17.01           C
ATOM     26  CD  GLN A   2      -9.698   9.692  -0.300  1.00 20.10           C
ATOM     27  OE1 GLN A   2      -8.810  10.543  -0.332  1.00 21.89           O
ATOM     28  NE2 GLN A   2     -10.978  10.091  -0.528  1.00 19.49           N
ATOM      0  H   GLN A   2     -12.188   5.646  -0.528  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -9.356   5.709  -1.106  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2     -11.281   7.551  -1.024  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2     -11.235   7.365   0.718  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2      -8.940   8.063   0.844  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2      -8.714   7.896  -0.886  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2     -11.736   9.409  -0.508  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2     -11.180  11.072  -0.719  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -8.199   4.994   0.708  1.00  5.87           N
ATOM     38  CA  ILE A   3      -7.274   4.677   1.751  1.00  5.07           C
ATOM     39  C   ILE A   3      -6.098   5.593   1.754  1.00  4.01           C
ATOM     40  O   ILE A   3      -5.832   6.203   0.720  1.00  4.61           O
ATOM     41  CB  ILE A   3      -6.807   3.253   1.679  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -6.010   2.874   0.419  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -8.048   2.354   1.810  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -4.979   1.760   0.601  1.00 10.83           C
ATOM      0  H   ILE A   3      -7.777   4.944  -0.219  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -7.820   4.813   2.685  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -6.095   3.113   2.493  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -6.713   2.571  -0.357  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -5.497   3.764   0.054  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -7.746   1.308   1.762  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -8.538   2.547   2.764  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -8.741   2.569   0.997  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -4.475   1.572  -0.347  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -4.245   2.062   1.349  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -5.481   0.850   0.931  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -5.326   5.686   2.851  1.00  4.55           N
ATOM     57  CA  PHE A   4      -4.206   6.562   3.008  1.00  4.68           C
ATOM     58  C   PHE A   4      -2.949   5.805   3.264  1.00  5.30           C
ATOM     59  O   PHE A   4      -2.815   5.000   4.185  1.00  5.58           O
ATOM     60  CB  PHE A   4      -4.391   7.454   4.247  1.00  4.83           C
ATOM     61  CG  PHE A   4      -5.783   7.957   4.419  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -6.346   8.905   3.598  1.00  8.34           C
ATOM     63  CD2 PHE A   4      -6.333   7.605   5.629  1.00  6.69           C
ATOM     64  CE1 PHE A   4      -7.516   9.488   4.025  1.00 10.61           C
ATOM     65  CE2 PHE A   4      -7.511   8.197   6.019  1.00  9.10           C
ATOM     66  CZ  PHE A   4      -8.100   9.152   5.224  1.00  8.90           C
ATOM      0  H   PHE A   4      -5.494   5.114   3.679  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -4.143   7.137   2.084  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -4.105   6.891   5.135  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -3.713   8.304   4.176  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -5.889   9.180   2.659  1.00  8.34           H   new
ATOM      0  HD2 PHE A   4      -5.848   6.876   6.262  1.00  6.69           H   new
ATOM      0  HE1 PHE A   4      -7.990  10.231   3.401  1.00 10.61           H   new
ATOM      0  HE2 PHE A   4      -7.975   7.911   6.952  1.00  9.10           H   new
ATOM      0  HZ  PHE A   4      -9.014   9.634   5.539  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -1.935   6.073   2.422  1.00  4.44           N
ATOM     77  CA  VAL A   5      -0.648   5.490   2.645  1.00  3.87           C
ATOM     78  C   VAL A   5       0.330   6.539   3.049  1.00  4.93           C
ATOM     79  O   VAL A   5       0.588   7.475   2.294  1.00  6.84           O
ATOM     80  CB  VAL A   5      -0.140   4.809   1.409  1.00  2.99           C
ATOM     81  CG1 VAL A   5       1.185   4.058   1.627  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -1.262   3.819   1.051  1.00  9.13           C
ATOM      0  H   VAL A   5      -2.002   6.679   1.604  1.00  4.44           H   new
ATOM      0  HA  VAL A   5      -0.755   4.752   3.440  1.00  3.87           H   new
ATOM      0  HB  VAL A   5       0.081   5.533   0.625  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       1.495   3.589   0.693  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       1.952   4.761   1.952  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       1.048   3.292   2.390  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5      -0.986   3.266   0.153  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -1.409   3.122   1.876  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -2.187   4.367   0.870  1.00  9.13           H   new
ATOM     92  N   LYS A   6       0.848   6.578   4.290  1.00  6.04           N
ATOM     93  CA  LYS A   6       1.803   7.543   4.739  1.00  6.12           C
ATOM     94  C   LYS A   6       3.250   7.247   4.544  1.00  6.57           C
ATOM     95  O   LYS A   6       3.742   6.163   4.854  1.00  5.76           O
ATOM     96  CB  LYS A   6       1.658   7.862   6.237  1.00  7.45           C
ATOM     97  CG  LYS A   6       2.306   9.085   6.889  1.00 11.12           C
ATOM     98  CD  LYS A   6       1.902   9.409   8.329  1.00 14.54           C
ATOM     99  CE  LYS A   6       2.022  10.852   8.823  1.00 18.84           C
ATOM    100  NZ  LYS A   6       1.717  11.008  10.263  1.00 20.55           N
ATOM      0  H   LYS A   6       0.589   5.906   5.013  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       1.543   8.372   4.081  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6       0.589   7.933   6.437  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6       2.026   6.990   6.777  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6       3.387   8.947   6.865  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6       2.082   9.955   6.272  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6       0.864   9.102   8.457  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6       2.503   8.784   8.989  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6       3.034  11.210   8.633  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6       1.346  11.483   8.246  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6       1.817  12.007  10.533  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6       0.742  10.695  10.447  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6       2.377  10.431  10.822  1.00 20.55           H   new
ATOM    114  N   THR A   7       3.994   8.291   4.137  1.00  7.41           N
ATOM    115  CA  THR A   7       5.403   8.151   3.939  1.00  7.48           C
ATOM    116  C   THR A   7       6.284   8.364   5.122  1.00  8.75           C
ATOM    117  O   THR A   7       5.802   8.712   6.198  1.00  8.58           O
ATOM    118  CB  THR A   7       5.938   8.877   2.740  1.00  9.61           C
ATOM    119  OG1 THR A   7       5.943  10.289   2.895  1.00 11.78           O
ATOM    120  CG2 THR A   7       5.195   8.444   1.465  1.00  9.17           C
ATOM      0  H   THR A   7       3.625   9.223   3.947  1.00  7.41           H   new
ATOM      0  HA  THR A   7       5.459   7.080   3.742  1.00  7.48           H   new
ATOM      0  HB  THR A   7       6.985   8.591   2.641  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       5.813  10.714   2.022  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       5.599   8.983   0.608  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       5.325   7.372   1.314  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       4.134   8.670   1.568  1.00  9.17           H   new
ATOM    128  N   LEU A   8       7.601   8.147   4.955  1.00  9.84           N
ATOM    129  CA  LEU A   8       8.590   8.424   5.950  1.00 14.15           C
ATOM    130  C   LEU A   8       8.923   9.866   6.126  1.00 17.37           C
ATOM    131  O   LEU A   8       8.945  10.271   7.287  1.00 17.01           O
ATOM    132  CB  LEU A   8       9.783   7.566   5.497  1.00 16.63           C
ATOM    133  CG  LEU A   8      10.704   7.193   6.671  1.00 18.88           C
ATOM    134  CD1 LEU A   8      10.225   6.178   7.723  1.00 18.59           C
ATOM    135  CD2 LEU A   8      11.976   6.555   6.087  1.00 19.31           C
ATOM      0  H   LEU A   8       7.992   7.764   4.094  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       8.237   8.176   6.951  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8       9.416   6.657   5.022  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8      10.356   8.110   4.746  1.00 16.63           H   new
ATOM      0  HG  LEU A   8      10.799   8.144   7.196  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8      11.003   6.038   8.474  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8       9.320   6.551   8.203  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8      10.012   5.225   7.239  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8      12.650   6.279   6.898  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8      11.708   5.664   5.519  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8      12.472   7.269   5.430  1.00 19.31           H   new
ATOM    147  N   THR A   9       8.978  10.645   5.032  1.00 18.33           N
ATOM    148  CA  THR A   9       8.889  12.068   5.143  1.00 19.24           C
ATOM    149  C   THR A   9       7.561  12.628   5.521  1.00 19.48           C
ATOM    150  O   THR A   9       7.572  13.328   6.533  1.00 23.14           O
ATOM    151  CB  THR A   9       9.416  12.897   4.009  1.00 18.97           C
ATOM    152  OG1 THR A   9       8.821  12.598   2.754  1.00 20.24           O
ATOM    153  CG2 THR A   9      10.942  12.828   3.830  1.00 19.70           C
ATOM      0  H   THR A   9       9.083  10.295   4.080  1.00 18.33           H   new
ATOM      0  HA  THR A   9       9.579  12.164   5.981  1.00 19.24           H   new
ATOM      0  HB  THR A   9       9.139  13.906   4.314  1.00 18.97           H   new
ATOM      0  HG1 THR A   9       9.209  13.174   2.063  1.00 20.24           H   new
ATOM      0 HG21 THR A   9      11.238  13.455   2.989  1.00 19.70           H   new
ATOM      0 HG22 THR A   9      11.431  13.182   4.737  1.00 19.70           H   new
ATOM      0 HG23 THR A   9      11.239  11.797   3.636  1.00 19.70           H   new
ATOM    161  N   GLY A  10       6.403  12.353   4.895  1.00 19.43           N
ATOM    162  CA  GLY A  10       5.088  12.497   5.439  1.00 18.74           C
ATOM    163  C   GLY A  10       4.172  13.136   4.453  1.00 17.62           C
ATOM    164  O   GLY A  10       3.520  14.166   4.618  1.00 19.74           O
ATOM      0  H   GLY A  10       6.386  12.004   3.937  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       4.698  11.519   5.723  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       5.129  13.099   6.346  1.00 18.74           H   new
ATOM    168  N   LYS A  11       4.078  12.451   3.299  1.00 13.56           N
ATOM    169  CA  LYS A  11       3.010  12.771   2.403  1.00 11.91           C
ATOM    170  C   LYS A  11       1.873  11.827   2.589  1.00 10.18           C
ATOM    171  O   LYS A  11       2.102  10.677   2.958  1.00  9.10           O
ATOM    172  CB  LYS A  11       3.517  12.598   0.962  1.00 13.43           C
ATOM    173  CG  LYS A  11       2.712  13.230  -0.175  1.00 16.69           C
ATOM    174  CD  LYS A  11       3.404  13.065  -1.530  1.00 17.92           C
ATOM    175  CE  LYS A  11       3.521  11.637  -2.068  1.00 20.81           C
ATOM    176  NZ  LYS A  11       4.078  11.655  -3.439  1.00 21.93           N
ATOM      0  H   LYS A  11       4.709  11.709   2.995  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       2.681  13.791   2.599  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       4.529  13.001   0.916  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       3.590  11.529   0.762  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       1.723  12.774  -0.216  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       2.566  14.290   0.030  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       2.864  13.663  -2.264  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       4.407  13.484  -1.454  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       4.162  11.045  -1.414  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       2.541  11.160  -2.071  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       3.418  11.180  -4.088  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       4.216  12.639  -3.745  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       4.991  11.158  -3.449  1.00 21.93           H   new
ATOM    190  N   THR A  12       0.626  12.294   2.398  1.00  9.63           N
ATOM    191  CA  THR A  12      -0.471  11.383   2.293  1.00  9.85           C
ATOM    192  C   THR A  12      -0.723  11.066   0.859  1.00 11.66           C
ATOM    193  O   THR A  12      -1.174  11.898   0.073  1.00 12.33           O
ATOM    194  CB  THR A  12      -1.783  11.879   2.824  1.00 10.85           C
ATOM    195  OG1 THR A  12      -1.621  12.430   4.123  1.00 10.91           O
ATOM    196  CG2 THR A  12      -2.885  10.814   2.951  1.00  9.63           C
ATOM      0  H   THR A  12       0.380  13.281   2.318  1.00  9.63           H   new
ATOM      0  HA  THR A  12      -0.159  10.531   2.897  1.00  9.85           H   new
ATOM      0  HB  THR A  12      -2.097  12.612   2.082  1.00 10.85           H   new
ATOM      0  HG1 THR A  12      -2.487  12.750   4.453  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -3.792  11.274   3.343  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -3.091  10.385   1.970  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -2.554  10.027   3.629  1.00  9.63           H   new
ATOM    204  N   ILE A  13      -0.413   9.850   0.374  1.00 10.42           N
ATOM    205  CA  ILE A  13      -0.798   9.240  -0.861  1.00 11.84           C
ATOM    206  C   ILE A  13      -2.216   8.803  -0.725  1.00 10.55           C
ATOM    207  O   ILE A  13      -2.539   8.079   0.216  1.00 11.92           O
ATOM    208  CB  ILE A  13       0.083   8.091  -1.255  1.00 14.86           C
ATOM    209  CG1 ILE A  13       1.589   8.403  -1.258  1.00 14.87           C
ATOM    210  CG2 ILE A  13      -0.330   7.591  -2.649  1.00 17.08           C
ATOM    211  CD1 ILE A  13       2.479   7.172  -1.418  1.00 16.46           C
ATOM      0  H   ILE A  13       0.180   9.222   0.917  1.00 10.42           H   new
ATOM      0  HA  ILE A  13      -0.688   9.971  -1.662  1.00 11.84           H   new
ATOM      0  HB  ILE A  13      -0.063   7.329  -0.490  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       1.803   9.101  -2.067  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13       1.847   8.906  -0.326  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       0.307   6.756  -2.940  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13      -1.369   7.263  -2.625  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13      -0.222   8.399  -3.372  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       3.526   7.476  -1.410  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       2.296   6.481  -0.595  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       2.251   6.679  -2.363  1.00 16.46           H   new
ATOM    223  N   THR A  14      -3.169   9.139  -1.612  1.00  9.39           N
ATOM    224  CA  THR A  14      -4.512   8.665  -1.487  1.00  9.63           C
ATOM    225  C   THR A  14      -4.887   7.752  -2.603  1.00 11.20           C
ATOM    226  O   THR A  14      -4.618   8.153  -3.735  1.00 11.63           O
ATOM    227  CB  THR A  14      -5.549   9.740  -1.339  1.00 10.38           C
ATOM    228  OG1 THR A  14      -5.449  10.683  -2.396  1.00 16.30           O
ATOM    229  CG2 THR A  14      -5.200  10.537  -0.071  1.00 11.66           C
ATOM      0  H   THR A  14      -3.008   9.742  -2.419  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -4.508   8.112  -0.548  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -6.535   9.275  -1.321  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -5.042  10.256  -3.178  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -5.933  11.331   0.073  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -5.212   9.871   0.792  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -4.207  10.974  -0.178  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -5.393   6.559  -2.242  1.00  8.29           N
ATOM    238  CA  LEU A  15      -5.611   5.552  -3.234  1.00  9.03           C
ATOM    239  C   LEU A  15      -6.989   4.986  -3.222  1.00  8.59           C
ATOM    240  O   LEU A  15      -7.465   4.704  -2.123  1.00  7.79           O
ATOM    241  CB  LEU A  15      -4.565   4.472  -2.906  1.00 11.08           C
ATOM    242  CG  LEU A  15      -3.103   4.842  -2.604  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -2.403   3.562  -2.117  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -2.418   5.262  -3.915  1.00 15.88           C
ATOM      0  H   LEU A  15      -5.646   6.295  -1.290  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -5.509   5.966  -4.237  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -4.938   3.920  -2.043  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -4.550   3.778  -3.746  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -3.053   5.645  -1.869  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15      -1.360   3.781  -1.891  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -2.899   3.195  -1.219  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -2.453   2.801  -2.896  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15      -1.380   5.527  -3.714  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -2.451   4.435  -4.624  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -2.937   6.122  -4.337  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -7.619   4.871  -4.404  1.00 11.04           N
ATOM    257  CA  GLU A  16      -8.919   4.391  -4.758  1.00 11.50           C
ATOM    258  C   GLU A  16      -8.825   2.962  -5.166  1.00 10.13           C
ATOM    259  O   GLU A  16      -8.566   2.665  -6.331  1.00  9.83           O
ATOM    260  CB  GLU A  16      -9.567   5.366  -5.756  1.00 17.22           C
ATOM    261  CG  GLU A  16     -11.042   5.176  -6.112  1.00 23.33           C
ATOM    262  CD  GLU A  16     -11.921   5.066  -4.874  1.00 26.99           C
ATOM    263  OE1 GLU A  16     -11.947   5.986  -4.014  1.00 28.90           O
ATOM    264  OE2 GLU A  16     -12.737   4.112  -4.761  1.00 28.86           O
ATOM      0  H   GLU A  16      -7.127   5.166  -5.247  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -9.608   4.379  -3.913  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -9.450   6.374  -5.358  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -8.994   5.321  -6.682  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16     -11.378   6.015  -6.721  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16     -11.155   4.277  -6.717  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -9.000   2.007  -4.235  1.00  8.99           N
ATOM    272  CA  VAL A  17      -8.957   0.603  -4.500  1.00  8.85           C
ATOM    273  C   VAL A  17     -10.225   0.032  -3.965  1.00  8.04           C
ATOM    274  O   VAL A  17     -10.976   0.680  -3.238  1.00  8.99           O
ATOM    275  CB  VAL A  17      -7.802   0.005  -3.752  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -6.523   0.657  -4.304  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -7.919   0.135  -2.224  1.00 10.54           C
ATOM      0  H   VAL A  17      -9.179   2.224  -3.255  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -8.843   0.398  -5.565  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -7.785  -1.073  -3.914  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -5.654   0.250  -3.786  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -6.440   0.449  -5.371  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -6.567   1.735  -4.147  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -7.048  -0.320  -1.752  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -7.970   1.189  -1.951  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -8.822  -0.372  -1.884  1.00 10.54           H   new
ATOM    287  N   GLU A  18     -10.598  -1.221  -4.280  1.00  7.29           N
ATOM    288  CA  GLU A  18     -11.749  -1.815  -3.673  1.00  7.08           C
ATOM    289  C   GLU A  18     -11.226  -2.741  -2.629  1.00  6.45           C
ATOM    290  O   GLU A  18     -10.092  -3.196  -2.773  1.00  5.28           O
ATOM    291  CB  GLU A  18     -12.719  -2.467  -4.673  1.00 10.28           C
ATOM    292  CG  GLU A  18     -13.613  -1.561  -5.522  1.00 12.65           C
ATOM    293  CD  GLU A  18     -14.642  -0.770  -4.727  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -15.618  -1.360  -4.191  1.00 14.33           O
ATOM    295  OE2 GLU A  18     -14.513   0.483  -4.702  1.00 18.17           O
ATOM      0  H   GLU A  18     -10.109  -1.818  -4.947  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -12.384  -1.053  -3.221  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18     -12.130  -3.082  -5.353  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -13.367  -3.142  -4.114  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -12.983  -0.863  -6.074  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -14.133  -2.172  -6.260  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -11.891  -3.094  -1.569  1.00  7.24           N
ATOM    303  CA  PRO A  19     -11.307  -3.877  -0.520  1.00  7.07           C
ATOM    304  C   PRO A  19     -10.976  -5.299  -0.821  1.00  6.65           C
ATOM    305  O   PRO A  19     -10.254  -5.904  -0.030  1.00  6.37           O
ATOM    306  CB  PRO A  19     -12.358  -4.013   0.579  1.00  7.61           C
ATOM    307  CG  PRO A  19     -13.679  -3.611  -0.096  1.00  8.16           C
ATOM    308  CD  PRO A  19     -13.253  -2.692  -1.251  1.00  7.49           C
ATOM      0  HA  PRO A  19     -10.380  -3.350  -0.293  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -12.402  -5.033   0.961  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -12.132  -3.365   1.426  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.220  -4.484  -0.461  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -14.340  -3.094   0.600  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -13.911  -2.810  -2.112  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -13.297  -1.643  -0.958  1.00  7.49           H   new
ATOM    316  N   SER A  20     -11.352  -5.772  -2.022  1.00  6.80           N
ATOM    317  CA  SER A  20     -11.004  -7.083  -2.476  1.00  6.28           C
ATOM    318  C   SER A  20      -9.816  -6.969  -3.369  1.00  8.45           C
ATOM    319  O   SER A  20      -9.350  -7.994  -3.864  1.00  7.26           O
ATOM    320  CB  SER A  20     -12.080  -7.709  -3.379  1.00  8.57           C
ATOM    321  OG  SER A  20     -13.332  -7.594  -2.720  1.00 11.13           O
ATOM      0  H   SER A  20     -11.907  -5.236  -2.689  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -10.854  -7.687  -1.581  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -12.110  -7.202  -4.343  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -11.849  -8.756  -3.577  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -14.034  -7.986  -3.280  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -9.196  -5.792  -3.564  1.00  7.50           N
ATOM    328  CA  ASP A  21      -7.868  -5.734  -4.093  1.00  7.70           C
ATOM    329  C   ASP A  21      -6.775  -6.266  -3.231  1.00  7.08           C
ATOM    330  O   ASP A  21      -6.801  -6.275  -2.002  1.00  8.11           O
ATOM    331  CB  ASP A  21      -7.626  -4.318  -4.644  1.00 11.00           C
ATOM    332  CG  ASP A  21      -8.430  -4.020  -5.901  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -8.219  -4.772  -6.890  1.00 14.36           O
ATOM    334  OD2 ASP A  21      -9.273  -3.084  -5.910  1.00 18.03           O
ATOM      0  H   ASP A  21      -9.611  -4.884  -3.357  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -7.816  -6.456  -4.908  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -7.880  -3.588  -3.876  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -6.565  -4.196  -4.861  1.00 11.00           H   new
ATOM    339  N   THR A  22      -5.771  -6.825  -3.929  1.00  5.37           N
ATOM    340  CA  THR A  22      -4.684  -7.515  -3.306  1.00  6.01           C
ATOM    341  C   THR A  22      -3.629  -6.497  -3.037  1.00  8.01           C
ATOM    342  O   THR A  22      -3.660  -5.383  -3.557  1.00  8.11           O
ATOM    343  CB  THR A  22      -4.033  -8.504  -4.227  1.00  8.92           C
ATOM    344  OG1 THR A  22      -3.844  -7.992  -5.538  1.00 10.22           O
ATOM    345  CG2 THR A  22      -4.941  -9.725  -4.448  1.00  9.65           C
ATOM      0  H   THR A  22      -5.713  -6.797  -4.947  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -5.071  -8.028  -2.425  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -3.085  -8.744  -3.745  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -3.416  -8.674  -6.097  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -4.448 -10.428  -5.119  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -5.136 -10.211  -3.492  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -5.884  -9.402  -4.890  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -2.694  -6.740  -2.101  1.00  8.32           N
ATOM    354  CA  ILE A  23      -1.673  -5.791  -1.781  1.00  9.92           C
ATOM    355  C   ILE A  23      -0.721  -5.510  -2.892  1.00 10.01           C
ATOM    356  O   ILE A  23      -0.238  -4.392  -3.066  1.00  8.71           O
ATOM    357  CB  ILE A  23      -0.910  -6.282  -0.586  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -1.709  -6.614   0.686  1.00 11.38           C
ATOM    359  CG2 ILE A  23       0.289  -5.393  -0.216  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -2.581  -5.490   1.243  1.00 12.30           C
ATOM      0  H   ILE A  23      -2.646  -7.604  -1.561  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -2.182  -4.849  -1.578  1.00  9.92           H   new
ATOM      0  HB  ILE A  23      -0.564  -7.244  -0.964  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -2.348  -7.472   0.476  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -1.008  -6.921   1.462  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23       0.794  -5.808   0.656  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       0.985  -5.354  -1.054  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23      -0.061  -4.386   0.012  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -3.096  -5.839   2.138  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -1.955  -4.634   1.495  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -3.315  -5.194   0.494  1.00 12.30           H   new
ATOM    372  N   GLU A  24      -0.489  -6.563  -3.695  1.00  9.54           N
ATOM    373  CA  GLU A  24       0.066  -6.590  -5.012  1.00 11.81           C
ATOM    374  C   GLU A  24      -0.540  -5.507  -5.837  1.00 11.14           C
ATOM    375  O   GLU A  24       0.194  -4.690  -6.392  1.00 10.62           O
ATOM    376  CB  GLU A  24      -0.071  -7.936  -5.744  1.00 19.24           C
ATOM    377  CG  GLU A  24       0.939  -8.078  -6.884  1.00 27.76           C
ATOM    378  CD  GLU A  24       0.897  -9.399  -7.640  1.00 32.92           C
ATOM    379  OE1 GLU A  24       0.053 -10.284  -7.338  1.00 34.80           O
ATOM    380  OE2 GLU A  24       1.699  -9.423  -8.612  1.00 36.51           O
ATOM      0  H   GLU A  24      -0.719  -7.505  -3.380  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       1.137  -6.433  -4.881  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24       0.069  -8.750  -5.033  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24      -1.081  -8.030  -6.142  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       0.774  -7.268  -7.595  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       1.941  -7.945  -6.476  1.00 27.76           H   new
ATOM    387  N   ASN A  25      -1.869  -5.329  -5.936  1.00  9.43           N
ATOM    388  CA  ASN A  25      -2.460  -4.272  -6.697  1.00 10.96           C
ATOM    389  C   ASN A  25      -2.386  -2.899  -6.124  1.00  9.68           C
ATOM    390  O   ASN A  25      -2.494  -1.952  -6.901  1.00  9.33           O
ATOM    391  CB  ASN A  25      -3.897  -4.581  -7.149  1.00 16.78           C
ATOM    392  CG  ASN A  25      -4.044  -5.663  -8.209  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -3.044  -5.875  -8.894  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -5.272  -6.245  -8.266  1.00 24.70           N
ATOM      0  H   ASN A  25      -2.549  -5.934  -5.476  1.00  9.43           H   new
ATOM      0  HA  ASN A  25      -1.802  -4.247  -7.566  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -4.477  -4.876  -6.274  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -4.342  -3.662  -7.531  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -5.460  -6.973  -8.956  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -6.005  -5.954  -7.619  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -2.188  -2.740  -4.803  1.00  6.52           N
ATOM    402  CA  VAL A  26      -1.957  -1.475  -4.178  1.00  5.53           C
ATOM    403  C   VAL A  26      -0.596  -0.979  -4.528  1.00  4.42           C
ATOM    404  O   VAL A  26      -0.384   0.143  -4.984  1.00  3.40           O
ATOM    405  CB  VAL A  26      -2.109  -1.529  -2.687  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -1.888  -0.110  -2.137  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -3.467  -2.200  -2.419  1.00  8.12           C
ATOM      0  H   VAL A  26      -2.189  -3.521  -4.147  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -2.716  -0.789  -4.554  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -1.374  -2.132  -2.154  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -1.993  -0.120  -1.052  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26      -0.887   0.231  -2.402  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -2.627   0.566  -2.567  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -3.634  -2.267  -1.344  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -4.261  -1.608  -2.873  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -3.469  -3.201  -2.850  1.00  8.12           H   new
ATOM    417  N   LYS A  27       0.385  -1.898  -4.475  1.00  2.64           N
ATOM    418  CA  LYS A  27       1.669  -1.587  -5.023  1.00  4.14           C
ATOM    419  C   LYS A  27       1.781  -1.280  -6.476  1.00  5.58           C
ATOM    420  O   LYS A  27       2.663  -0.568  -6.955  1.00  4.11           O
ATOM    421  CB  LYS A  27       2.592  -2.798  -4.803  1.00  3.97           C
ATOM    422  CG  LYS A  27       2.903  -3.058  -3.328  1.00  7.45           C
ATOM    423  CD  LYS A  27       3.939  -4.142  -3.024  1.00  9.02           C
ATOM    424  CE  LYS A  27       4.034  -4.419  -1.523  1.00 12.90           C
ATOM    425  NZ  LYS A  27       5.220  -5.295  -1.387  1.00 15.47           N
ATOM      0  H   LYS A  27       0.296  -2.828  -4.066  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       1.926  -0.664  -4.503  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       2.125  -3.685  -5.231  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       3.526  -2.638  -5.342  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       3.247  -2.124  -2.883  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       1.973  -3.326  -2.826  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       3.672  -5.060  -3.548  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       4.914  -3.832  -3.400  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       4.154  -3.496  -0.955  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       3.134  -4.908  -1.151  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       5.109  -5.902  -0.550  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       5.312  -5.889  -2.236  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       6.073  -4.710  -1.279  1.00 15.47           H   new
ATOM    439  N   ALA A  28       0.918  -1.869  -7.324  1.00  6.61           N
ATOM    440  CA  ALA A  28       0.813  -1.513  -8.705  1.00  7.74           C
ATOM    441  C   ALA A  28       0.100  -0.222  -8.919  1.00  9.17           C
ATOM    442  O   ALA A  28       0.532   0.589  -9.737  1.00 11.45           O
ATOM    443  CB  ALA A  28       0.090  -2.671  -9.415  1.00  7.68           C
ATOM      0  H   ALA A  28       0.277  -2.611  -7.042  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       1.811  -1.359  -9.116  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28      -0.012  -2.441 -10.475  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       0.668  -3.588  -9.297  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28      -0.899  -2.806  -8.976  1.00  7.68           H   new
ATOM    449  N   LYS A  29      -0.910   0.094  -8.089  1.00  8.96           N
ATOM    450  CA  LYS A  29      -1.486   1.402  -8.048  1.00  7.90           C
ATOM    451  C   LYS A  29      -0.547   2.523  -7.765  1.00  6.92           C
ATOM    452  O   LYS A  29      -0.368   3.531  -8.448  1.00  6.87           O
ATOM    453  CB  LYS A  29      -2.662   1.403  -7.057  1.00 10.28           C
ATOM    454  CG  LYS A  29      -3.646   2.572  -7.128  1.00 14.94           C
ATOM    455  CD  LYS A  29      -4.363   2.703  -8.474  1.00 19.69           C
ATOM    456  CE  LYS A  29      -5.719   1.999  -8.409  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -5.951   1.398  -9.742  1.00 24.98           N
ATOM      0  H   LYS A  29      -1.333  -0.567  -7.437  1.00  8.96           H   new
ATOM      0  HA  LYS A  29      -1.825   1.606  -9.064  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -3.225   0.481  -7.202  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29      -2.251   1.370  -6.048  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -4.391   2.454  -6.341  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29      -3.109   3.498  -6.923  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -4.501   3.755  -8.722  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -3.754   2.266  -9.265  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -5.720   1.233  -7.634  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -6.510   2.706  -8.160  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -6.867   0.905  -9.746  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -5.957   2.147 -10.464  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -5.192   0.719  -9.954  1.00 24.98           H   new
ATOM    471  N   ILE A  30       0.261   2.335  -6.706  1.00  4.57           N
ATOM    472  CA  ILE A  30       1.420   3.101  -6.367  1.00  5.58           C
ATOM    473  C   ILE A  30       2.453   3.123  -7.440  1.00  7.26           C
ATOM    474  O   ILE A  30       2.994   4.194  -7.709  1.00  9.46           O
ATOM    475  CB  ILE A  30       2.016   2.644  -5.069  1.00  5.36           C
ATOM    476  CG1 ILE A  30       1.030   2.718  -3.890  1.00  2.94           C
ATOM    477  CG2 ILE A  30       3.244   3.524  -4.781  1.00  2.78           C
ATOM    478  CD1 ILE A  30       1.488   1.931  -2.663  1.00  2.00           C
ATOM      0  H   ILE A  30       0.088   1.587  -6.034  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       1.071   4.127  -6.253  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       2.288   1.593  -5.169  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       0.888   3.762  -3.610  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       0.060   2.340  -4.213  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       3.701   3.215  -3.841  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       3.968   3.415  -5.589  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       2.935   4.567  -4.709  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       0.745   2.027  -1.871  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       1.603   0.880  -2.927  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       2.443   2.324  -2.315  1.00  2.00           H   new
ATOM    490  N   GLN A  31       2.830   2.061  -8.174  1.00  7.06           N
ATOM    491  CA  GLN A  31       3.720   2.169  -9.288  1.00  8.67           C
ATOM    492  C   GLN A  31       3.238   2.986 -10.438  1.00 10.90           C
ATOM    493  O   GLN A  31       4.008   3.787 -10.965  1.00  9.63           O
ATOM    494  CB  GLN A  31       4.187   0.787  -9.774  1.00  9.12           C
ATOM    495  CG  GLN A  31       5.325   0.846 -10.794  1.00 10.76           C
ATOM    496  CD  GLN A  31       5.805  -0.502 -11.314  1.00 13.78           C
ATOM    497  OE1 GLN A  31       6.992  -0.767 -11.499  1.00 14.48           O
ATOM    498  NE2 GLN A  31       4.836  -1.375 -11.699  1.00 14.76           N
ATOM      0  H   GLN A  31       2.511   1.110  -7.991  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       4.563   2.729  -8.883  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       4.511   0.200  -8.915  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       3.341   0.262 -10.217  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       5.000   1.449 -11.642  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       6.170   1.364 -10.341  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       3.854  -1.148 -11.542  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       5.091  -2.256 -12.144  1.00 14.76           H   new
ATOM    507  N   ASP A  32       1.938   2.864 -10.762  1.00 10.93           N
ATOM    508  CA  ASP A  32       1.296   3.632 -11.783  1.00 14.01           C
ATOM    509  C   ASP A  32       1.178   5.077 -11.441  1.00 14.04           C
ATOM    510  O   ASP A  32       1.587   5.922 -12.236  1.00 13.39           O
ATOM    511  CB  ASP A  32      -0.124   3.078 -11.987  1.00 18.01           C
ATOM    512  CG  ASP A  32      -0.225   1.962 -13.017  1.00 24.33           C
ATOM    513  OD1 ASP A  32       0.842   1.552 -13.547  1.00 25.17           O
ATOM    514  OD2 ASP A  32      -1.377   1.528 -13.286  1.00 26.29           O
ATOM      0  H   ASP A  32       1.312   2.207 -10.296  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       1.909   3.552 -12.681  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32      -0.497   2.708 -11.032  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32      -0.779   3.895 -12.290  1.00 18.01           H   new
ATOM    519  N   LYS A  33       0.660   5.428 -10.250  1.00 14.22           N
ATOM    520  CA  LYS A  33       0.608   6.811  -9.893  1.00 14.00           C
ATOM    521  C   LYS A  33       1.940   7.418  -9.613  1.00 12.37           C
ATOM    522  O   LYS A  33       2.305   8.363 -10.311  1.00 12.17           O
ATOM    523  CB  LYS A  33      -0.300   6.994  -8.665  1.00 18.62           C
ATOM    524  CG  LYS A  33      -1.809   6.801  -8.822  1.00 24.00           C
ATOM    525  CD  LYS A  33      -2.512   7.840  -9.698  1.00 27.61           C
ATOM    526  CE  LYS A  33      -3.914   7.448 -10.169  1.00 27.64           C
ATOM    527  NZ  LYS A  33      -4.725   8.526 -10.779  1.00 30.06           N
ATOM      0  H   LYS A  33       0.289   4.779  -9.556  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       0.207   7.332 -10.762  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       0.042   6.300  -7.897  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33      -0.135   8.001  -8.281  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33      -1.991   5.812  -9.243  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33      -2.266   6.815  -7.832  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33      -2.580   8.775  -9.142  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33      -1.892   8.034 -10.573  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -3.818   6.640 -10.894  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33      -4.462   7.048  -9.316  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -5.652   8.147 -11.059  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33      -4.859   9.293 -10.089  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33      -4.235   8.897 -11.618  1.00 30.06           H   new
ATOM    541  N   GLU A  34       2.629   6.985  -8.543  1.00 10.11           N
ATOM    542  CA  GLU A  34       3.816   7.595  -8.027  1.00 10.07           C
ATOM    543  C   GLU A  34       5.107   7.367  -8.734  1.00  9.32           C
ATOM    544  O   GLU A  34       5.975   8.233  -8.832  1.00 11.61           O
ATOM    545  CB  GLU A  34       3.943   7.115  -6.572  1.00 14.77           C
ATOM    546  CG  GLU A  34       2.785   7.457  -5.632  1.00 18.75           C
ATOM    547  CD  GLU A  34       2.287   8.894  -5.558  1.00 22.28           C
ATOM    548  OE1 GLU A  34       3.033   9.747  -5.008  1.00 25.19           O
ATOM    549  OE2 GLU A  34       1.181   9.151  -6.104  1.00 21.95           O
ATOM      0  H   GLU A  34       2.343   6.165  -8.009  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       3.672   8.667  -8.161  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       4.066   6.032  -6.580  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       4.857   7.536  -6.153  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       1.938   6.831  -5.913  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       3.081   7.160  -4.626  1.00 18.75           H   new
ATOM    556  N   GLY A  35       5.301   6.159  -9.293  1.00  7.22           N
ATOM    557  CA  GLY A  35       6.532   5.732  -9.883  1.00  6.29           C
ATOM    558  C   GLY A  35       7.450   5.156  -8.860  1.00  6.93           C
ATOM    559  O   GLY A  35       8.540   5.653  -8.584  1.00  7.41           O
ATOM      0  H   GLY A  35       4.569   5.450  -9.336  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       6.330   4.988 -10.654  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35       7.015   6.577 -10.374  1.00  6.29           H   new
ATOM    563  N   ILE A  36       6.967   4.081  -8.211  1.00  5.86           N
ATOM    564  CA  ILE A  36       7.672   3.335  -7.215  1.00  6.07           C
ATOM    565  C   ILE A  36       7.527   1.886  -7.533  1.00  6.36           C
ATOM    566  O   ILE A  36       6.410   1.371  -7.510  1.00  6.18           O
ATOM    567  CB  ILE A  36       7.143   3.419  -5.814  1.00  7.47           C
ATOM    568  CG1 ILE A  36       6.790   4.867  -5.432  1.00  8.52           C
ATOM    569  CG2 ILE A  36       8.261   2.837  -4.932  1.00  7.36           C
ATOM    570  CD1 ILE A  36       6.543   5.090  -3.941  1.00  9.49           C
ATOM      0  H   ILE A  36       6.033   3.713  -8.392  1.00  5.86           H   new
ATOM      0  HA  ILE A  36       8.677   3.756  -7.241  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       6.213   2.864  -5.691  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36       7.600   5.521  -5.754  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       5.899   5.167  -5.983  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       7.951   2.863  -3.887  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       8.458   1.806  -5.227  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36       9.168   3.429  -5.056  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36       6.301   6.138  -3.765  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36       5.712   4.466  -3.612  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36       7.439   4.826  -3.380  1.00  9.49           H   new
ATOM    582  N   PRO A  37       8.503   1.066  -7.789  1.00  8.65           N
ATOM    583  CA  PRO A  37       8.367  -0.285  -8.247  1.00  9.18           C
ATOM    584  C   PRO A  37       7.920  -1.195  -7.155  1.00  9.85           C
ATOM    585  O   PRO A  37       8.259  -0.936  -6.002  1.00  8.51           O
ATOM    586  CB  PRO A  37       9.776  -0.673  -8.689  1.00 11.42           C
ATOM    587  CG  PRO A  37      10.785   0.290  -8.044  1.00  9.27           C
ATOM    588  CD  PRO A  37       9.875   1.525  -7.941  1.00  8.33           C
ATOM      0  HA  PRO A  37       7.622  -0.366  -9.039  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37       9.994  -1.700  -8.394  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37       9.855  -0.630  -9.775  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      11.142  -0.056  -7.074  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      11.665   0.461  -8.665  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      10.166   2.142  -7.091  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37       9.972   2.144  -8.833  1.00  8.33           H   new
ATOM    596  N   PRO A  38       7.283  -2.275  -7.498  1.00  8.71           N
ATOM    597  CA  PRO A  38       6.921  -3.253  -6.514  1.00  9.08           C
ATOM    598  C   PRO A  38       8.124  -3.872  -5.891  1.00  9.28           C
ATOM    599  O   PRO A  38       7.984  -4.557  -4.879  1.00  6.50           O
ATOM    600  CB  PRO A  38       5.866  -4.132  -7.182  1.00 10.31           C
ATOM    601  CG  PRO A  38       6.158  -3.995  -8.685  1.00 10.81           C
ATOM    602  CD  PRO A  38       6.607  -2.526  -8.761  1.00 12.00           C
ATOM      0  HA  PRO A  38       6.450  -2.859  -5.614  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       5.945  -5.168  -6.854  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       4.857  -3.797  -6.940  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       6.935  -4.682  -9.019  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       5.277  -4.190  -9.296  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       7.275  -2.360  -9.606  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       5.755  -1.859  -8.892  1.00 12.00           H   new
ATOM    610  N   ASP A  39       9.353  -3.740  -6.423  1.00 11.20           N
ATOM    611  CA  ASP A  39      10.546  -4.255  -5.827  1.00 14.96           C
ATOM    612  C   ASP A  39      10.919  -3.582  -4.551  1.00 13.99           C
ATOM    613  O   ASP A  39      11.527  -4.108  -3.620  1.00 13.75           O
ATOM    614  CB  ASP A  39      11.696  -4.007  -6.818  1.00 24.16           C
ATOM    615  CG  ASP A  39      11.438  -4.448  -8.252  1.00 31.06           C
ATOM    616  OD1 ASP A  39      11.185  -5.656  -8.504  1.00 35.55           O
ATOM    617  OD2 ASP A  39      11.411  -3.563  -9.148  1.00 34.22           O
ATOM      0  H   ASP A  39       9.522  -3.255  -7.304  1.00 11.20           H   new
ATOM      0  HA  ASP A  39      10.369  -5.308  -5.605  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      11.925  -2.941  -6.821  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      12.584  -4.523  -6.453  1.00 24.16           H   new
ATOM    622  N   GLN A  40      10.632  -2.270  -4.484  1.00 11.60           N
ATOM    623  CA  GLN A  40      11.151  -1.344  -3.525  1.00 10.76           C
ATOM    624  C   GLN A  40      10.161  -1.196  -2.422  1.00  8.01           C
ATOM    625  O   GLN A  40      10.562  -1.095  -1.264  1.00  8.96           O
ATOM    626  CB  GLN A  40      11.555  -0.011  -4.179  1.00 11.14           C
ATOM    627  CG  GLN A  40      12.835  -0.143  -5.006  1.00 14.85           C
ATOM    628  CD  GLN A  40      13.330   1.195  -5.536  1.00 16.11           C
ATOM    629  OE1 GLN A  40      12.625   1.885  -6.272  1.00 20.52           O
ATOM    630  NE2 GLN A  40      14.604   1.511  -5.180  1.00 18.16           N
ATOM      0  H   GLN A  40       9.994  -1.827  -5.145  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      12.076  -1.729  -3.096  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      10.745   0.339  -4.818  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      11.699   0.743  -3.405  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      13.614  -0.597  -4.393  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      12.654  -0.817  -5.843  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      15.130   0.891  -4.565  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      15.033   2.368  -5.528  1.00 18.16           H   new
ATOM    639  N   GLN A  41       8.854  -1.195  -2.739  1.00  6.52           N
ATOM    640  CA  GLN A  41       7.939  -0.970  -1.664  1.00  3.87           C
ATOM    641  C   GLN A  41       7.711  -2.100  -0.720  1.00  4.79           C
ATOM    642  O   GLN A  41       7.510  -3.240  -1.137  1.00  6.34           O
ATOM    643  CB  GLN A  41       6.531  -0.678  -2.211  1.00  4.20           C
ATOM    644  CG  GLN A  41       6.378   0.409  -3.276  1.00  3.20           C
ATOM    645  CD  GLN A  41       5.021   0.328  -3.961  1.00  4.89           C
ATOM    646  OE1 GLN A  41       3.993   0.372  -3.287  1.00  5.21           O
ATOM    647  NE2 GLN A  41       5.017   0.098  -5.302  1.00  7.13           N
ATOM      0  H   GLN A  41       8.452  -1.338  -3.665  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       8.422  -0.152  -1.130  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.136  -1.606  -2.624  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       5.896  -0.409  -1.367  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       6.497   1.390  -2.816  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       7.169   0.307  -4.019  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       5.897   0.071  -5.817  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       4.134  -0.047  -5.792  1.00  7.13           H   new
ATOM    656  N   ARG A  42       7.664  -1.860   0.603  1.00  5.73           N
ATOM    657  CA  ARG A  42       7.097  -2.725   1.590  1.00  6.97           C
ATOM    658  C   ARG A  42       6.033  -1.868   2.186  1.00  7.15           C
ATOM    659  O   ARG A  42       6.167  -0.681   2.481  1.00  7.33           O
ATOM    660  CB  ARG A  42       8.086  -3.319   2.607  1.00 13.23           C
ATOM    661  CG  ARG A  42       7.548  -4.063   3.830  1.00 21.27           C
ATOM    662  CD  ARG A  42       8.671  -4.521   4.762  1.00 26.14           C
ATOM    663  NE  ARG A  42       9.504  -5.527   4.045  1.00 32.26           N
ATOM    664  CZ  ARG A  42      10.841  -5.721   4.236  1.00 34.32           C
ATOM    665  NH1 ARG A  42      11.688  -5.104   5.112  1.00 35.30           N
ATOM    666  NH2 ARG A  42      11.357  -6.637   3.365  1.00 36.39           N
ATOM      0  H   ARG A  42       8.047  -1.006   1.008  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       6.717  -3.651   1.158  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       8.738  -4.006   2.067  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       8.712  -2.504   2.969  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       6.865  -3.414   4.378  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       6.972  -4.929   3.503  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       9.282  -3.670   5.064  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       8.255  -4.954   5.672  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       9.038  -6.118   3.357  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42      11.334  -4.385   5.743  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42      12.674  -5.362   5.135  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42      10.751  -7.084   2.677  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42      12.348  -6.874   3.402  1.00 36.39           H   new
ATOM    680  N   LEU A  43       4.832  -2.454   2.337  1.00  4.65           N
ATOM    681  CA  LEU A  43       3.718  -1.754   2.897  1.00  3.51           C
ATOM    682  C   LEU A  43       3.492  -2.337   4.250  1.00  5.56           C
ATOM    683  O   LEU A  43       3.533  -3.563   4.350  1.00  4.19           O
ATOM    684  CB  LEU A  43       2.371  -1.759   2.156  1.00  3.74           C
ATOM    685  CG  LEU A  43       2.502  -1.066   0.789  1.00  6.32           C
ATOM    686  CD1 LEU A  43       1.514  -1.521  -0.299  1.00  6.41           C
ATOM    687  CD2 LEU A  43       2.524   0.459   0.983  1.00  9.55           C
ATOM      0  H   LEU A  43       4.632  -3.418   2.070  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       4.013  -0.705   2.857  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       2.029  -2.785   2.018  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       1.617  -1.250   2.757  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       3.456  -1.395   0.377  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       1.702  -0.964  -1.217  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       1.646  -2.586  -0.488  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43       0.493  -1.336   0.036  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       2.617   0.948   0.013  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       1.599   0.778   1.463  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       3.372   0.734   1.610  1.00  9.55           H   new
ATOM    699  N   ILE A  44       3.133  -1.581   5.302  1.00  4.58           N
ATOM    700  CA  ILE A  44       3.048  -1.912   6.691  1.00  5.55           C
ATOM    701  C   ILE A  44       1.662  -1.505   7.058  1.00  5.46           C
ATOM    702  O   ILE A  44       1.162  -0.472   6.617  1.00  6.04           O
ATOM    703  CB  ILE A  44       4.153  -1.298   7.498  1.00  6.80           C
ATOM    704  CG1 ILE A  44       5.427  -2.029   7.044  1.00 10.31           C
ATOM    705  CG2 ILE A  44       3.971  -1.309   9.026  1.00  7.39           C
ATOM    706  CD1 ILE A  44       6.757  -1.516   7.595  1.00 13.90           C
ATOM      0  H   ILE A  44       2.868  -0.607   5.153  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       3.203  -2.969   6.907  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       4.185  -0.225   7.306  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       5.330  -3.080   7.318  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       5.472  -1.986   5.956  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       4.833  -0.838   9.499  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44       3.068  -0.758   9.289  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       3.883  -2.338   9.375  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       7.573  -2.119   7.196  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       6.896  -0.476   7.300  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       6.752  -1.587   8.683  1.00 13.90           H   new
ATOM    718  N   PHE A  45       0.977  -2.337   7.864  1.00  6.75           N
ATOM    719  CA  PHE A  45      -0.168  -1.881   8.589  1.00  4.70           C
ATOM    720  C   PHE A  45       0.013  -2.052  10.058  1.00  6.34           C
ATOM    721  O   PHE A  45       0.243  -3.141  10.582  1.00  5.45           O
ATOM    722  CB  PHE A  45      -1.386  -2.671   8.082  1.00  5.51           C
ATOM    723  CG  PHE A  45      -2.733  -2.231   8.541  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -3.042  -0.920   8.815  1.00  5.87           C
ATOM    725  CD2 PHE A  45      -3.737  -3.151   8.733  1.00  6.86           C
ATOM    726  CE1 PHE A  45      -4.307  -0.475   9.119  1.00  6.64           C
ATOM    727  CE2 PHE A  45      -5.038  -2.770   8.967  1.00  6.68           C
ATOM    728  CZ  PHE A  45      -5.284  -1.439   9.205  1.00  6.84           C
ATOM      0  H   PHE A  45       1.214  -3.318   8.013  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -0.315  -0.814   8.421  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -1.376  -2.641   6.992  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -1.256  -3.713   8.374  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -2.242  -0.195   8.790  1.00  5.87           H   new
ATOM      0  HD2 PHE A  45      -3.497  -4.203   8.699  1.00  6.86           H   new
ATOM      0  HE1 PHE A  45      -4.521   0.571   9.281  1.00  6.64           H   new
ATOM      0  HE2 PHE A  45      -5.840  -3.493   8.964  1.00  6.68           H   new
ATOM      0  HZ  PHE A  45      -6.286  -1.137   9.471  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -0.062  -0.961  10.841  1.00  6.53           N
ATOM    739  CA  ALA A  46       0.203  -0.975  12.246  1.00  7.15           C
ATOM    740  C   ALA A  46       1.612  -1.288  12.614  1.00  9.00           C
ATOM    741  O   ALA A  46       2.335  -0.327  12.872  1.00 11.15           O
ATOM    742  CB  ALA A  46      -0.777  -1.922  12.960  1.00  8.99           C
ATOM      0  H   ALA A  46      -0.315  -0.039  10.485  1.00  6.53           H   new
ATOM      0  HA  ALA A  46       0.048   0.049  12.587  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -0.566  -1.925  14.029  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -1.799  -1.582  12.793  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -0.661  -2.931  12.565  1.00  8.99           H   new
ATOM    748  N   GLY A  47       2.127  -2.531  12.621  1.00  9.35           N
ATOM    749  CA  GLY A  47       3.461  -2.872  13.007  1.00 11.68           C
ATOM    750  C   GLY A  47       3.937  -4.066  12.253  1.00 11.14           C
ATOM    751  O   GLY A  47       5.074  -4.523  12.360  1.00 13.93           O
ATOM      0  H   GLY A  47       1.580  -3.345  12.341  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47       4.126  -2.029  12.820  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47       3.495  -3.074  14.078  1.00 11.68           H   new
ATOM    755  N   LYS A  48       2.993  -4.617  11.469  1.00 10.47           N
ATOM    756  CA  LYS A  48       3.076  -5.834  10.722  1.00  8.82           C
ATOM    757  C   LYS A  48       3.058  -5.607   9.250  1.00  7.68           C
ATOM    758  O   LYS A  48       2.420  -4.656   8.802  1.00  6.47           O
ATOM    759  CB  LYS A  48       1.981  -6.815  11.174  1.00  9.74           C
ATOM    760  CG  LYS A  48       1.944  -8.277  10.725  1.00 14.14           C
ATOM    761  CD  LYS A  48       0.695  -9.065  11.125  1.00 16.32           C
ATOM    762  CE  LYS A  48      -0.588  -8.615  10.423  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -1.732  -9.130  11.207  1.00 23.92           N
ATOM      0  H   LYS A  48       2.086  -4.166  11.348  1.00 10.47           H   new
ATOM      0  HA  LYS A  48       4.044  -6.287  10.935  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48       2.003  -6.825  12.264  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48       1.028  -6.375  10.879  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48       2.037  -8.306   9.639  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48       2.817  -8.785  11.134  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48       0.862 -10.120  10.909  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48       0.555  -8.978  12.202  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -0.627  -7.528  10.358  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -0.620  -8.997   9.403  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -2.622  -8.840  10.754  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -1.686 -10.168  11.247  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -1.693  -8.744  12.172  1.00 23.92           H   new
ATOM    777  N   GLN A  49       3.772  -6.424   8.455  1.00  8.89           N
ATOM    778  CA  GLN A  49       4.004  -6.261   7.053  1.00  7.18           C
ATOM    779  C   GLN A  49       2.928  -6.931   6.270  1.00  8.23           C
ATOM    780  O   GLN A  49       2.275  -7.838   6.785  1.00  9.70           O
ATOM    781  CB  GLN A  49       5.373  -6.817   6.627  1.00 11.67           C
ATOM    782  CG  GLN A  49       6.577  -6.277   7.402  1.00 15.82           C
ATOM    783  CD  GLN A  49       7.879  -7.017   7.132  1.00 20.21           C
ATOM    784  OE1 GLN A  49       7.838  -8.081   6.516  1.00 23.23           O
ATOM    785  NE2 GLN A  49       9.001  -6.372   7.550  1.00 20.67           N
ATOM      0  H   GLN A  49       4.221  -7.263   8.822  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       3.997  -5.191   6.848  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       5.353  -7.902   6.732  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       5.519  -6.602   5.568  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       6.712  -5.225   7.153  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       6.359  -6.326   8.469  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       8.923  -5.490   8.056  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       9.920  -6.770   7.357  1.00 20.67           H   new
ATOM    794  N   LEU A  50       2.815  -6.385   5.046  1.00  6.51           N
ATOM    795  CA  LEU A  50       1.693  -6.772   4.248  1.00  7.41           C
ATOM    796  C   LEU A  50       2.215  -7.420   3.012  1.00  8.27           C
ATOM    797  O   LEU A  50       3.047  -6.876   2.287  1.00  8.34           O
ATOM    798  CB  LEU A  50       0.891  -5.545   3.782  1.00  7.13           C
ATOM    799  CG  LEU A  50       0.101  -4.736   4.825  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -0.439  -3.484   4.114  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -1.054  -5.557   5.422  1.00  8.14           C
ATOM      0  H   LEU A  50       3.459  -5.714   4.626  1.00  6.51           H   new
ATOM      0  HA  LEU A  50       1.058  -7.428   4.843  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50       1.586  -4.863   3.293  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50       0.186  -5.881   3.022  1.00  7.13           H   new
ATOM      0  HG  LEU A  50       0.752  -4.465   5.656  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -1.008  -2.881   4.822  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50       0.394  -2.899   3.725  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -1.087  -3.784   3.290  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -1.589  -4.953   6.155  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -1.738  -5.854   4.627  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -0.654  -6.447   5.908  1.00  8.14           H   new
ATOM    813  N   GLU A  51       1.772  -8.638   2.655  1.00  9.43           N
ATOM    814  CA  GLU A  51       2.320  -9.414   1.586  1.00 11.90           C
ATOM    815  C   GLU A  51       1.464  -9.384   0.366  1.00 11.49           C
ATOM    816  O   GLU A  51       0.282  -9.047   0.420  1.00  9.88           O
ATOM    817  CB  GLU A  51       2.356 -10.836   2.169  1.00 16.56           C
ATOM    818  CG  GLU A  51       3.252 -11.922   1.571  1.00 26.06           C
ATOM    819  CD  GLU A  51       4.736 -11.601   1.472  1.00 29.86           C
ATOM    820  OE1 GLU A  51       5.289 -10.642   0.869  1.00 32.13           O
ATOM    821  OE2 GLU A  51       5.447 -12.512   1.975  1.00 33.44           O
ATOM      0  H   GLU A  51       0.999  -9.102   3.132  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       3.291  -9.037   1.265  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51       2.631 -10.741   3.219  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51       1.335 -11.216   2.140  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       3.138 -12.826   2.169  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51       2.886 -12.154   0.571  1.00 26.06           H   new
ATOM    828  N   ASP A  52       1.959  -9.799  -0.813  1.00 12.71           N
ATOM    829  CA  ASP A  52       1.381  -9.363  -2.046  1.00 16.56           C
ATOM    830  C   ASP A  52       0.027  -9.928  -2.310  1.00 15.83           C
ATOM    831  O   ASP A  52      -0.912  -9.150  -2.466  1.00 17.21           O
ATOM    832  CB  ASP A  52       2.283  -9.826  -3.202  1.00 21.05           C
ATOM    833  CG  ASP A  52       3.567  -9.011  -3.259  1.00 25.12           C
ATOM    834  OD1 ASP A  52       3.470  -7.824  -3.670  1.00 25.82           O
ATOM    835  OD2 ASP A  52       4.641  -9.425  -2.745  1.00 28.37           O
ATOM      0  H   ASP A  52       2.753 -10.431  -0.913  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       1.290  -8.279  -1.973  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       2.525 -10.882  -3.078  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       1.746  -9.731  -4.146  1.00 21.05           H   new
ATOM    840  N   GLY A  53      -0.074 -11.268  -2.349  1.00 15.00           N
ATOM    841  CA  GLY A  53      -1.255 -11.903  -2.847  1.00 11.77           C
ATOM    842  C   GLY A  53      -2.296 -12.213  -1.827  1.00 11.10           C
ATOM    843  O   GLY A  53      -3.000 -13.205  -2.006  1.00 11.25           O
ATOM      0  H   GLY A  53       0.656 -11.909  -2.038  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -1.698 -11.261  -3.609  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53      -0.967 -12.831  -3.340  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -2.427 -11.416  -0.751  1.00  8.53           N
ATOM    848  CA  ARG A  54      -3.583 -11.317   0.084  1.00  9.05           C
ATOM    849  C   ARG A  54      -4.346 -10.047  -0.077  1.00  8.96           C
ATOM    850  O   ARG A  54      -3.795  -9.076  -0.592  1.00 11.60           O
ATOM    851  CB  ARG A  54      -3.094 -11.464   1.535  1.00  7.97           C
ATOM    852  CG  ARG A  54      -2.319 -12.722   1.932  1.00  9.62           C
ATOM    853  CD  ARG A  54      -2.156 -12.864   3.447  1.00 12.20           C
ATOM    854  NE  ARG A  54      -0.886 -13.628   3.604  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -0.239 -13.749   4.799  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -0.824 -13.397   5.981  1.00 23.38           N
ATOM    857  NH2 ARG A  54       0.903 -14.494   4.725  1.00 25.50           N
ATOM      0  H   ARG A  54      -1.674 -10.800  -0.445  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -4.284 -12.101  -0.202  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -2.462 -10.604   1.758  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -3.966 -11.396   2.185  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -2.835 -13.599   1.543  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -1.334 -12.699   1.466  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -2.099 -11.891   3.935  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -2.998 -13.395   3.891  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -0.483 -14.080   2.783  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -1.776 -13.030   5.990  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -0.310 -13.501   6.856  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54       1.193 -14.896   3.833  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54       1.466 -14.649   5.561  1.00 25.50           H   new
ATOM    871  N   THR A  55      -5.617  -9.959   0.355  1.00  9.05           N
ATOM    872  CA  THR A  55      -6.438  -8.825   0.065  1.00  9.03           C
ATOM    873  C   THR A  55      -6.300  -7.867   1.197  1.00  8.15           C
ATOM    874  O   THR A  55      -5.651  -8.111   2.213  1.00  5.91           O
ATOM    875  CB  THR A  55      -7.882  -9.092  -0.241  1.00 11.15           C
ATOM    876  OG1 THR A  55      -8.650  -9.509   0.878  1.00 11.95           O
ATOM    877  CG2 THR A  55      -7.936 -10.294  -1.200  1.00 11.71           C
ATOM      0  H   THR A  55      -6.079 -10.680   0.910  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -6.071  -8.418  -0.877  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -8.286  -8.156  -0.626  1.00 11.15           H   new
ATOM      0  HG1 THR A  55      -8.398 -10.423   1.125  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -8.974 -10.518  -1.445  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -7.391 -10.056  -2.113  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -7.481 -11.162  -0.722  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -6.906  -6.680   1.015  1.00  6.91           N
ATOM    886  CA  LEU A  56      -7.034  -5.697   2.046  1.00  8.29           C
ATOM    887  C   LEU A  56      -7.914  -6.199   3.138  1.00  8.05           C
ATOM    888  O   LEU A  56      -7.508  -6.210   4.299  1.00 10.17           O
ATOM    889  CB  LEU A  56      -7.478  -4.394   1.360  1.00  6.60           C
ATOM    890  CG  LEU A  56      -6.498  -3.866   0.298  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -7.240  -3.005  -0.738  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -5.352  -3.101   0.982  1.00  9.85           C
ATOM      0  H   LEU A  56      -7.318  -6.396   0.126  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -6.097  -5.487   2.561  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -8.448  -4.557   0.891  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -7.617  -3.627   2.121  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -6.059  -4.704  -0.243  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -6.532  -2.640  -1.482  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -8.005  -3.606  -1.230  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -7.710  -2.158  -0.238  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -4.661  -2.729   0.226  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -5.760  -2.262   1.545  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -4.822  -3.770   1.661  1.00  9.85           H   new
ATOM    904  N   SER A  57      -9.049  -6.821   2.772  1.00  8.92           N
ATOM    905  CA  SER A  57      -9.895  -7.336   3.804  1.00  9.00           C
ATOM    906  C   SER A  57      -9.342  -8.425   4.658  1.00  9.44           C
ATOM    907  O   SER A  57      -9.712  -8.608   5.816  1.00 10.91           O
ATOM    908  CB  SER A  57     -11.122  -8.021   3.181  1.00 10.32           C
ATOM    909  OG  SER A  57     -11.931  -7.022   2.577  1.00 13.59           O
ATOM      0  H   SER A  57      -9.370  -6.963   1.814  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -10.074  -6.446   4.408  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -10.811  -8.757   2.440  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -11.686  -8.557   3.944  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -12.719  -7.440   2.172  1.00 13.59           H   new
ATOM    915  N   ASP A  58      -8.475  -9.297   4.113  1.00  9.11           N
ATOM    916  CA  ASP A  58      -7.782 -10.295   4.867  1.00  7.91           C
ATOM    917  C   ASP A  58      -6.906  -9.902   6.006  1.00  9.12           C
ATOM    918  O   ASP A  58      -6.996 -10.469   7.094  1.00  8.61           O
ATOM    919  CB  ASP A  58      -6.883 -11.186   3.992  1.00  8.41           C
ATOM    920  CG  ASP A  58      -7.513 -12.015   2.882  1.00 11.50           C
ATOM    921  OD1 ASP A  58      -7.977 -13.094   3.336  1.00 11.70           O
ATOM    922  OD2 ASP A  58      -7.502 -11.726   1.655  1.00 10.05           O
ATOM      0  H   ASP A  58      -8.249  -9.308   3.118  1.00  9.11           H   new
ATOM      0  HA  ASP A  58      -8.660 -10.784   5.290  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -6.130 -10.544   3.535  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -6.356 -11.872   4.655  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -6.125  -8.832   5.767  1.00  7.97           N
ATOM    928  CA  TYR A  59      -5.466  -8.084   6.792  1.00  8.45           C
ATOM    929  C   TYR A  59      -6.381  -7.272   7.642  1.00 10.98           C
ATOM    930  O   TYR A  59      -5.891  -6.692   8.609  1.00 12.95           O
ATOM    931  CB  TYR A  59      -4.456  -7.193   6.049  1.00  7.94           C
ATOM    932  CG  TYR A  59      -3.299  -8.016   5.597  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -2.550  -8.662   6.553  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -2.964  -8.145   4.270  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -1.461  -9.395   6.144  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -1.883  -8.883   3.849  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -1.092  -9.450   4.820  1.00  6.76           C
ATOM    938  OH  TYR A  59       0.104 -10.133   4.515  1.00  7.63           O
ATOM      0  H   TYR A  59      -5.947  -8.476   4.828  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -4.994  -8.763   7.502  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -4.935  -6.720   5.192  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -4.112  -6.392   6.704  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -2.811  -8.595   7.599  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -3.573  -7.648   3.530  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -0.884  -9.939   6.877  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -1.664  -9.012   2.799  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -0.061 -10.774   3.792  1.00  7.63           H   new
ATOM    948  N   ASN A  60      -7.649  -7.067   7.242  1.00 12.38           N
ATOM    949  CA  ASN A  60      -8.632  -6.198   7.811  1.00 13.94           C
ATOM    950  C   ASN A  60      -8.338  -4.747   7.642  1.00 14.16           C
ATOM    951  O   ASN A  60      -8.659  -3.972   8.542  1.00 14.26           O
ATOM    952  CB  ASN A  60      -9.044  -6.561   9.247  1.00 19.23           C
ATOM    953  CG  ASN A  60      -9.489  -8.017   9.232  1.00 22.65           C
ATOM    954  OD1 ASN A  60      -8.869  -8.936   9.765  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -10.685  -8.319   8.658  1.00 24.09           N
ATOM      0  H   ASN A  60      -8.022  -7.565   6.434  1.00 12.38           H   new
ATOM      0  HA  ASN A  60      -9.518  -6.385   7.204  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60      -8.210  -6.421   9.934  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60      -9.852  -5.915   9.591  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -11.034  -9.277   8.681  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -11.232  -7.587   8.205  1.00 24.09           H   new
ATOM    962  N   ILE A  61      -7.803  -4.405   6.456  1.00 11.08           N
ATOM    963  CA  ILE A  61      -7.727  -3.073   5.942  1.00 11.78           C
ATOM    964  C   ILE A  61      -9.035  -2.670   5.352  1.00 13.74           C
ATOM    965  O   ILE A  61      -9.578  -3.357   4.489  1.00 14.60           O
ATOM    966  CB  ILE A  61      -6.607  -3.087   4.944  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -5.288  -3.319   5.700  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -6.536  -1.704   4.277  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -4.119  -3.603   4.758  1.00 11.42           C
ATOM      0  H   ILE A  61      -7.402  -5.096   5.822  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -7.524  -2.333   6.716  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -6.769  -3.867   4.200  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -5.059  -2.441   6.304  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -5.409  -4.156   6.387  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -5.727  -1.693   3.547  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -7.480  -1.493   3.775  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -6.350  -0.943   5.035  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -3.212  -3.760   5.341  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -4.333  -4.497   4.172  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -3.978  -2.755   4.088  1.00 11.42           H   new
ATOM    981  N   GLN A  62      -9.622  -1.511   5.700  1.00 13.97           N
ATOM    982  CA  GLN A  62     -10.974  -1.088   5.500  1.00 15.52           C
ATOM    983  C   GLN A  62     -10.971   0.292   4.939  1.00 13.94           C
ATOM    984  O   GLN A  62      -9.960   0.874   4.548  1.00 12.15           O
ATOM    985  CB  GLN A  62     -11.751  -1.201   6.823  1.00 19.53           C
ATOM    986  CG  GLN A  62     -11.023  -0.511   7.978  1.00 26.38           C
ATOM    987  CD  GLN A  62     -11.902  -0.322   9.206  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -12.794   0.521   9.285  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -11.669  -1.067  10.320  1.00 32.71           N
ATOM      0  H   GLN A  62      -9.083  -0.788   6.177  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -11.483  -1.730   4.782  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -12.739  -0.758   6.702  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -11.901  -2.253   7.066  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -10.147  -1.100   8.252  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -10.662   0.461   7.643  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -10.941  -1.781  10.313  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -12.222  -0.911  11.163  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -12.137   0.944   4.787  1.00 11.73           N
ATOM    999  CA  LYS A  63     -12.227   2.319   4.403  1.00 11.97           C
ATOM   1000  C   LYS A  63     -11.648   3.208   5.449  1.00 10.41           C
ATOM   1001  O   LYS A  63     -11.812   3.057   6.659  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -13.665   2.788   4.124  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -14.605   2.863   5.328  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -15.953   3.222   4.699  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -17.173   2.912   5.568  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -17.295   1.456   5.800  1.00 25.97           N
ATOM      0  H   LYS A  63     -13.044   0.502   4.935  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -11.659   2.389   3.475  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -13.619   3.776   3.666  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -14.106   2.116   3.388  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -14.650   1.914   5.863  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -14.282   3.618   6.045  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -15.955   4.286   4.462  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -16.052   2.685   3.755  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -17.087   3.431   6.523  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -18.075   3.285   5.083  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -18.245   1.241   6.165  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -17.145   0.948   4.905  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -16.581   1.154   6.493  1.00 25.97           H   new
ATOM   1020  N   GLU A  64     -10.895   4.138   4.835  1.00 10.04           N
ATOM   1021  CA  GLU A  64     -10.007   5.089   5.428  1.00 10.94           C
ATOM   1022  C   GLU A  64      -8.967   4.468   6.296  1.00  9.74           C
ATOM   1023  O   GLU A  64      -8.658   4.878   7.414  1.00  9.42           O
ATOM   1024  CB  GLU A  64     -10.665   6.233   6.218  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -11.531   7.066   5.271  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -12.457   8.043   5.982  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -11.962   8.810   6.851  1.00 32.61           O
ATOM   1028  OE2 GLU A  64     -13.669   8.136   5.652  1.00 31.72           O
ATOM      0  H   GLU A  64     -10.912   4.231   3.819  1.00 10.04           H   new
ATOM      0  HA  GLU A  64      -9.550   5.529   4.541  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64     -11.274   5.829   7.026  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64      -9.901   6.860   6.677  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64     -10.882   7.622   4.595  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -12.130   6.394   4.656  1.00 24.16           H   new
ATOM   1035  N   SER A  65      -8.200   3.484   5.795  1.00  6.85           N
ATOM   1036  CA  SER A  65      -7.233   2.868   6.649  1.00  6.90           C
ATOM   1037  C   SER A  65      -5.896   3.493   6.444  1.00  4.72           C
ATOM   1038  O   SER A  65      -5.703   3.931   5.311  1.00  3.91           O
ATOM   1039  CB  SER A  65      -7.029   1.388   6.285  1.00  7.28           C
ATOM   1040  OG  SER A  65      -8.257   0.740   6.584  1.00 10.56           O
ATOM      0  H   SER A  65      -8.243   3.126   4.841  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -7.604   2.986   7.667  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -6.775   1.277   5.231  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -6.209   0.954   6.858  1.00  7.28           H   new
ATOM      0  HG  SER A  65      -8.962   1.091   6.001  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -5.043   3.513   7.484  1.00  4.48           N
ATOM   1047  CA  THR A  66      -3.783   4.185   7.412  1.00  3.80           C
ATOM   1048  C   THR A  66      -2.713   3.163   7.237  1.00  4.60           C
ATOM   1049  O   THR A  66      -2.474   2.394   8.167  1.00  5.33           O
ATOM   1050  CB  THR A  66      -3.482   5.086   8.573  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -4.272   6.266   8.566  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -2.091   5.695   8.329  1.00  3.40           C
ATOM      0  H   THR A  66      -5.228   3.061   8.380  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -3.828   4.858   6.556  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -3.623   4.486   9.472  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -4.041   6.819   9.341  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -1.835   6.359   9.155  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -1.351   4.897   8.262  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -2.100   6.261   7.398  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -2.071   3.120   6.056  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -0.974   2.247   5.774  1.00  3.85           C
ATOM   1062  C   LEU A  67       0.289   3.027   5.901  1.00  3.80           C
ATOM   1063  O   LEU A  67       0.280   4.257   5.935  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -1.125   1.597   4.388  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -2.394   0.783   4.082  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -2.209  -0.169   2.888  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -2.905   0.108   5.366  1.00  8.12           C
ATOM      0  H   LEU A  67      -2.325   3.716   5.268  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -0.954   1.425   6.489  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -1.054   2.390   3.643  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -0.268   0.940   4.237  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -3.181   1.461   3.751  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -3.134  -0.719   2.715  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -1.958   0.408   1.998  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -1.404  -0.871   3.104  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -3.804  -0.467   5.142  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -2.136  -0.558   5.757  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -3.138   0.870   6.110  1.00  8.12           H   new
ATOM   1079  N   HIS A  68       1.443   2.352   6.042  1.00  2.94           N
ATOM   1080  CA  HIS A  68       2.720   2.992   5.971  1.00  4.17           C
ATOM   1081  C   HIS A  68       3.572   2.386   4.910  1.00  5.32           C
ATOM   1082  O   HIS A  68       3.768   1.174   4.828  1.00  7.70           O
ATOM   1083  CB  HIS A  68       3.564   2.816   7.245  1.00  5.57           C
ATOM   1084  CG  HIS A  68       4.923   3.451   7.244  1.00  9.95           C
ATOM   1085  ND1 HIS A  68       5.197   4.763   6.915  1.00 13.74           N
ATOM   1086  CD2 HIS A  68       6.076   2.987   7.796  1.00 12.79           C
ATOM   1087  CE1 HIS A  68       6.470   5.019   7.320  1.00 14.75           C
ATOM   1088  NE2 HIS A  68       7.042   3.969   7.879  1.00 16.30           N
ATOM      0  H   HIS A  68       1.491   1.347   6.208  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       2.474   4.039   5.792  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68       3.000   3.220   8.086  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       3.687   1.748   7.427  1.00  5.57           H   new
ATOM      0  HD1 HIS A  68       4.564   5.417   6.455  1.00 13.74           H   new
ATOM      0  HD2 HIS A  68       6.219   1.970   8.130  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68       6.958   5.975   7.198  1.00 14.75           H   new
ATOM   1096  N   LEU A  69       4.108   3.248   4.028  1.00  5.29           N
ATOM   1097  CA  LEU A  69       5.006   2.857   2.986  1.00  3.97           C
ATOM   1098  C   LEU A  69       6.444   2.980   3.356  1.00  5.07           C
ATOM   1099  O   LEU A  69       6.861   4.074   3.731  1.00  4.34           O
ATOM   1100  CB  LEU A  69       4.685   3.664   1.717  1.00  6.08           C
ATOM   1101  CG  LEU A  69       5.697   3.664   0.559  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       5.722   2.265  -0.080  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       5.108   4.621  -0.492  1.00  6.87           C
ATOM      0  H   LEU A  69       3.910   4.249   4.040  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       4.851   1.794   2.803  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       3.736   3.298   1.325  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       4.527   4.700   2.017  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       6.695   3.944   0.896  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       6.437   2.254  -0.903  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       6.017   1.529   0.668  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       4.729   2.020  -0.458  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       5.776   4.674  -1.351  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       4.133   4.254  -0.812  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       4.997   5.615  -0.058  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       7.195   1.866   3.287  1.00  4.29           N
ATOM   1116  CA  VAL A  70       8.607   1.912   3.509  1.00  6.26           C
ATOM   1117  C   VAL A  70       9.230   1.378   2.266  1.00  9.22           C
ATOM   1118  O   VAL A  70       8.573   0.778   1.416  1.00  9.36           O
ATOM   1119  CB  VAL A  70       9.183   1.115   4.642  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       8.624   1.845   5.874  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       8.807  -0.375   4.577  1.00  8.54           C
ATOM      0  H   VAL A  70       6.827   0.938   3.079  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       8.815   2.949   3.773  1.00  6.26           H   new
ATOM      0  HB  VAL A  70      10.272   1.074   4.638  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       8.977   1.352   6.780  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70       8.963   2.881   5.868  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70       7.535   1.820   5.848  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       9.252  -0.900   5.422  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       7.723  -0.479   4.616  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       9.179  -0.804   3.647  1.00  8.54           H   new
ATOM   1131  N   LEU A  71      10.492   1.740   1.975  1.00 12.71           N
ATOM   1132  CA  LEU A  71      11.313   1.218   0.927  1.00 16.06           C
ATOM   1133  C   LEU A  71      12.279   0.231   1.487  1.00 18.09           C
ATOM   1134  O   LEU A  71      13.179   0.561   2.257  1.00 19.26           O
ATOM   1135  CB  LEU A  71      12.068   2.324   0.171  1.00 17.10           C
ATOM   1136  CG  LEU A  71      11.024   3.287  -0.420  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      11.573   4.635  -0.918  1.00 19.57           C
ATOM   1138  CD2 LEU A  71      10.125   2.779  -1.559  1.00 17.51           C
ATOM      0  H   LEU A  71      10.976   2.456   2.517  1.00 12.71           H   new
ATOM      0  HA  LEU A  71      10.656   0.727   0.209  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      12.740   2.856   0.844  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      12.683   1.895  -0.620  1.00 17.10           H   new
ATOM      0  HG  LEU A  71      10.425   3.394   0.484  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71      10.755   5.237  -1.314  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      12.045   5.164  -0.090  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      12.309   4.461  -1.703  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71       9.444   3.573  -1.867  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71      10.744   2.483  -2.406  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71       9.549   1.921  -1.213  1.00 17.51           H   new