USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17
USER  MOD reduce.3.24.130724 removed 586 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A  55 THR OG1 :   rot  141:sc=    0.62
USER  MOD Set 1.2: A  57 SER OG  :   rot  -84:sc=    0.62
USER  MOD Set 2.1: A   7 THR OG1 :   rot  180:sc=   0.438
USER  MOD Set 2.2: A   9 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A   1 MET CE  :methyl -178:sc=  -0.662   (180deg=-0.736)
USER  MOD Single : A   1 MET N   :NH3+    154:sc=    1.27   (180deg=1.24)
USER  MOD Single : A   2 GLN     :      amide:sc=       0  K(o=0,f=-2.1!)
USER  MOD Single : A   6 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  11 LYS NZ  :NH3+    162:sc=   0.932   (180deg=0.411)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  20 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  22 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  25 ASN     :      amide:sc=  -0.175  K(o=-0.17,f=-2.5!)
USER  MOD Single : A  27 LYS NZ  :NH3+    161:sc=    1.77   (180deg=1.55)
USER  MOD Single : A  29 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  31 GLN     :      amide:sc=  -0.586  K(o=-0.59,f=-2.7!)
USER  MOD Single : A  33 LYS NZ  :NH3+   -171:sc=-0.00224   (180deg=-0.147)
USER  MOD Single : A  40 GLN     :      amide:sc=       0  K(o=0,f=-0.52)
USER  MOD Single : A  41 GLN     :      amide:sc=   0.347  K(o=0.35,f=-3.1!)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=   0.875  K(o=0.87,f=-3.6!)
USER  MOD Single : A  59 TYR OH  :   rot  142:sc=   0.582
USER  MOD Single : A  60 ASN     :      amide:sc=  -0.457  X(o=-0.46,f=-0.14)
USER  MOD Single : A  62 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  63 LYS NZ  :NH3+    146:sc=    1.09   (180deg=0.35)
USER  MOD Single : A  65 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HD1:sc=       0  X(o=0,f=-0.0076)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -11.721   4.406  -6.671  1.00  9.67           N
ATOM      2  CA  MET A   1     -11.897   5.137  -5.396  1.00 10.38           C
ATOM      3  C   MET A   1     -10.564   5.611  -4.928  1.00  9.62           C
ATOM      4  O   MET A   1      -9.497   5.137  -5.317  1.00  9.62           O
ATOM      5  CB  MET A   1     -12.539   4.184  -4.374  1.00 13.77           C
ATOM      6  CG  MET A   1     -11.655   3.192  -3.615  1.00 16.29           C
ATOM      7  SD  MET A   1     -12.493   1.977  -2.554  1.00 17.17           S
ATOM      8  CE  MET A   1     -11.179   0.891  -1.928  1.00 16.11           C
ATOM      0  H1  MET A   1     -12.494   3.720  -6.787  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -11.735   5.080  -7.463  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -10.810   3.904  -6.660  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -12.546   6.003  -5.524  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -13.054   4.796  -3.634  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -13.302   3.608  -4.898  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -11.055   2.647  -4.344  1.00 16.29           H   new
ATOM      0  HG3 MET A   1     -10.963   3.762  -2.995  1.00 16.29           H   new
ATOM      0  HE1 MET A   1     -11.618   0.110  -1.307  1.00 16.11           H   new
ATOM      0  HE2 MET A   1     -10.653   0.435  -2.767  1.00 16.11           H   new
ATOM      0  HE3 MET A   1     -10.476   1.475  -1.334  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -10.678   6.675  -4.114  1.00  9.27           N
ATOM     21  CA  GLN A   2      -9.536   7.316  -3.540  1.00  9.07           C
ATOM     22  C   GLN A   2      -9.158   6.692  -2.241  1.00  8.72           C
ATOM     23  O   GLN A   2      -9.970   6.628  -1.318  1.00  8.22           O
ATOM     24  CB  GLN A   2      -9.754   8.820  -3.301  1.00 14.46           C
ATOM     25  CG  GLN A   2     -10.042   9.644  -4.557  1.00 17.01           C
ATOM     26  CD  GLN A   2      -9.946  11.106  -4.145  1.00 20.10           C
ATOM     27  OE1 GLN A   2     -10.023  11.355  -2.943  1.00 21.89           O
ATOM     28  NE2 GLN A   2      -9.591  11.984  -5.121  1.00 19.49           N
ATOM      0  H   GLN A   2     -11.570   7.095  -3.851  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -8.736   7.187  -4.269  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2     -10.584   8.945  -2.606  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2      -8.867   9.227  -2.815  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2      -9.324   9.415  -5.345  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2     -11.032   9.416  -4.952  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2      -9.557  11.679  -6.094  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2      -9.359  12.948  -4.880  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -7.872   6.306  -2.158  1.00  5.87           N
ATOM     38  CA  ILE A   3      -7.276   5.910  -0.920  1.00  5.07           C
ATOM     39  C   ILE A   3      -5.991   6.652  -0.792  1.00  4.01           C
ATOM     40  O   ILE A   3      -5.504   7.190  -1.785  1.00  4.61           O
ATOM     41  CB  ILE A   3      -6.854   4.491  -0.680  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -5.901   3.866  -1.712  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -8.110   3.607  -0.595  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -5.543   2.418  -1.381  1.00 10.83           C
ATOM      0  H   ILE A   3      -7.240   6.268  -2.957  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -8.093   6.102  -0.224  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -6.283   4.533   0.247  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -6.363   3.906  -2.698  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -4.988   4.459  -1.764  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -7.815   2.572  -0.421  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -8.740   3.948   0.226  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -8.666   3.673  -1.530  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -4.868   2.027  -2.142  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -5.054   2.377  -0.408  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -6.451   1.815  -1.357  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -5.455   6.788   0.434  1.00  4.55           N
ATOM     57  CA  PHE A   4      -4.221   7.468   0.680  1.00  4.68           C
ATOM     58  C   PHE A   4      -3.160   6.472   1.000  1.00  5.30           C
ATOM     59  O   PHE A   4      -3.345   5.701   1.940  1.00  5.58           O
ATOM     60  CB  PHE A   4      -4.276   8.359   1.932  1.00  4.83           C
ATOM     61  CG  PHE A   4      -5.428   9.299   1.852  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -5.440  10.421   1.057  1.00  8.34           C
ATOM     63  CD2 PHE A   4      -6.449   9.253   2.773  1.00  6.69           C
ATOM     64  CE1 PHE A   4      -6.328  11.465   1.159  1.00 10.61           C
ATOM     65  CE2 PHE A   4      -7.452  10.193   2.784  1.00  9.10           C
ATOM     66  CZ  PHE A   4      -7.434  11.292   1.957  1.00  8.90           C
ATOM      0  H   PHE A   4      -5.891   6.415   1.277  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -4.026   8.058  -0.216  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -4.366   7.739   2.824  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -3.347   8.920   2.027  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -4.687  10.488   0.286  1.00  8.34           H   new
ATOM      0  HD2 PHE A   4      -6.463   8.459   3.505  1.00  6.69           H   new
ATOM      0  HE1 PHE A   4      -6.162  12.391   0.629  1.00 10.61           H   new
ATOM      0  HE2 PHE A   4      -8.281  10.064   3.464  1.00  9.10           H   new
ATOM      0  HZ  PHE A   4      -8.257  11.992   1.935  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -1.984   6.616   0.362  1.00  4.44           N
ATOM     77  CA  VAL A   5      -0.815   5.996   0.903  1.00  3.87           C
ATOM     78  C   VAL A   5       0.039   6.974   1.635  1.00  4.93           C
ATOM     79  O   VAL A   5       0.665   7.897   1.116  1.00  6.84           O
ATOM     80  CB  VAL A   5       0.038   5.349  -0.147  1.00  2.99           C
ATOM     81  CG1 VAL A   5       1.370   4.865   0.451  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -0.615   4.112  -0.787  1.00  9.13           C
ATOM      0  H   VAL A   5      -1.844   7.143  -0.500  1.00  4.44           H   new
ATOM      0  HA  VAL A   5      -1.191   5.233   1.584  1.00  3.87           H   new
ATOM      0  HB  VAL A   5       0.181   6.121  -0.903  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       1.971   4.399  -0.330  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       1.911   5.714   0.868  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       1.172   4.138   1.239  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5       0.056   3.694  -1.537  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -0.810   3.365  -0.018  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -1.554   4.400  -1.260  1.00  9.13           H   new
ATOM     92  N   LYS A   6       0.210   6.903   2.967  1.00  6.04           N
ATOM     93  CA  LYS A   6       1.070   7.797   3.678  1.00  6.12           C
ATOM     94  C   LYS A   6       2.432   7.237   3.905  1.00  6.57           C
ATOM     95  O   LYS A   6       2.626   6.109   4.356  1.00  5.76           O
ATOM     96  CB  LYS A   6       0.384   8.095   5.021  1.00  7.45           C
ATOM     97  CG  LYS A   6       0.885   9.356   5.728  1.00 11.12           C
ATOM     98  CD  LYS A   6       0.035   9.690   6.955  1.00 14.54           C
ATOM     99  CE  LYS A   6       0.542  10.808   7.869  1.00 18.84           C
ATOM    100  NZ  LYS A   6      -0.349  10.927   9.045  1.00 20.55           N
ATOM      0  H   LYS A   6      -0.255   6.215   3.559  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       1.220   8.700   3.086  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6      -0.689   8.191   4.852  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6       0.527   7.242   5.684  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6       1.923   9.216   6.031  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6       0.866  10.195   5.033  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6      -0.964   9.960   6.612  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6      -0.067   8.784   7.553  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6       1.561  10.594   8.192  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6       0.571  11.752   7.325  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6      -0.004  11.687   9.666  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6      -1.314  11.150   8.728  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6      -0.355  10.028   9.568  1.00 20.55           H   new
ATOM    114  N   THR A   7       3.537   7.916   3.549  1.00  7.41           N
ATOM    115  CA  THR A   7       4.869   7.445   3.769  1.00  7.48           C
ATOM    116  C   THR A   7       5.430   7.541   5.146  1.00  8.75           C
ATOM    117  O   THR A   7       4.769   7.992   6.080  1.00  8.58           O
ATOM    118  CB  THR A   7       5.824   8.108   2.821  1.00  9.61           C
ATOM    119  OG1 THR A   7       6.115   9.466   3.119  1.00 11.78           O
ATOM    120  CG2 THR A   7       5.202   8.098   1.414  1.00  9.17           C
ATOM      0  H   THR A   7       3.501   8.827   3.091  1.00  7.41           H   new
ATOM      0  HA  THR A   7       4.765   6.375   3.592  1.00  7.48           H   new
ATOM      0  HB  THR A   7       6.753   7.544   2.902  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       6.744   9.819   2.455  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       5.884   8.577   0.711  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       5.024   7.069   1.102  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       4.257   8.641   1.430  1.00  9.17           H   new
ATOM    128  N   LEU A   8       6.702   7.149   5.336  1.00  9.84           N
ATOM    129  CA  LEU A   8       7.298   7.243   6.632  1.00 14.15           C
ATOM    130  C   LEU A   8       7.761   8.616   6.979  1.00 17.37           C
ATOM    131  O   LEU A   8       7.965   9.034   8.117  1.00 17.01           O
ATOM    132  CB  LEU A   8       8.503   6.290   6.574  1.00 16.63           C
ATOM    133  CG  LEU A   8       9.274   6.159   7.899  1.00 18.88           C
ATOM    134  CD1 LEU A   8       8.436   5.628   9.074  1.00 18.59           C
ATOM    135  CD2 LEU A   8      10.362   5.085   7.725  1.00 19.31           C
ATOM      0  H   LEU A   8       7.309   6.773   4.607  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       6.567   6.989   7.399  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8       8.155   5.302   6.271  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8       9.189   6.638   5.801  1.00 16.63           H   new
ATOM      0  HG  LEU A   8       9.630   7.165   8.120  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8       9.058   5.568   9.967  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8       7.600   6.303   9.259  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8       8.055   4.636   8.830  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8      10.920   4.978   8.655  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8       9.896   4.133   7.470  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8      11.042   5.382   6.926  1.00 19.31           H   new
ATOM    147  N   THR A   9       8.002   9.483   5.979  1.00 18.33           N
ATOM    148  CA  THR A   9       8.337  10.865   6.124  1.00 19.24           C
ATOM    149  C   THR A   9       7.105  11.620   6.491  1.00 19.48           C
ATOM    150  O   THR A   9       7.015  12.315   7.501  1.00 23.14           O
ATOM    151  CB  THR A   9       9.137  11.623   5.106  1.00 18.97           C
ATOM    152  OG1 THR A   9       9.158  11.018   3.822  1.00 20.24           O
ATOM    153  CG2 THR A   9      10.558  11.834   5.656  1.00 19.70           C
ATOM      0  H   THR A   9       7.959   9.196   5.001  1.00 18.33           H   new
ATOM      0  HA  THR A   9       9.102  10.800   6.898  1.00 19.24           H   new
ATOM      0  HB  THR A   9       8.647  12.583   4.947  1.00 18.97           H   new
ATOM      0  HG1 THR A   9       9.694  11.565   3.211  1.00 20.24           H   new
ATOM      0 HG21 THR A   9      11.152  12.384   4.927  1.00 19.70           H   new
ATOM      0 HG22 THR A   9      10.508  12.401   6.585  1.00 19.70           H   new
ATOM      0 HG23 THR A   9      11.022  10.866   5.846  1.00 19.70           H   new
ATOM    161  N   GLY A  10       6.057  11.320   5.703  1.00 19.43           N
ATOM    162  CA  GLY A  10       4.749  11.817   6.001  1.00 18.74           C
ATOM    163  C   GLY A  10       4.152  12.418   4.776  1.00 17.62           C
ATOM    164  O   GLY A  10       3.323  13.325   4.835  1.00 19.74           O
ATOM      0  H   GLY A  10       6.113  10.739   4.867  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       4.116  11.008   6.367  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       4.804  12.563   6.794  1.00 18.74           H   new
ATOM    168  N   LYS A  11       4.654  12.044   3.585  1.00 13.56           N
ATOM    169  CA  LYS A  11       4.045  12.472   2.364  1.00 11.91           C
ATOM    170  C   LYS A  11       2.831  11.661   2.067  1.00 10.18           C
ATOM    171  O   LYS A  11       2.803  10.436   1.955  1.00  9.10           O
ATOM    172  CB  LYS A  11       5.145  12.387   1.292  1.00 13.43           C
ATOM    173  CG  LYS A  11       4.592  12.882  -0.046  1.00 16.69           C
ATOM    174  CD  LYS A  11       5.575  12.657  -1.196  1.00 17.92           C
ATOM    175  CE  LYS A  11       4.943  13.002  -2.547  1.00 20.81           C
ATOM    176  NZ  LYS A  11       5.835  12.845  -3.717  1.00 21.93           N
ATOM      0  H   LYS A  11       5.475  11.450   3.468  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       3.674  13.496   2.412  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       6.004  12.990   1.588  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       5.495  11.359   1.195  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       3.657  12.366  -0.264  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       4.360  13.944   0.029  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       6.464  13.269  -1.042  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       5.901  11.617  -1.200  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       4.066  12.371  -2.692  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       4.592  14.033  -2.513  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       5.264  12.799  -4.585  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       6.483  13.657  -3.771  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       6.386  11.968  -3.618  1.00 21.93           H   new
ATOM    190  N   THR A  12       1.660  12.320   2.017  1.00  9.63           N
ATOM    191  CA  THR A  12       0.450  11.601   1.760  1.00  9.85           C
ATOM    192  C   THR A  12       0.121  11.454   0.314  1.00 11.66           C
ATOM    193  O   THR A  12      -0.078  12.445  -0.387  1.00 12.33           O
ATOM    194  CB  THR A  12      -0.725  12.313   2.361  1.00 10.85           C
ATOM    195  OG1 THR A  12      -0.546  12.144   3.760  1.00 10.91           O
ATOM    196  CG2 THR A  12      -2.056  11.585   2.107  1.00  9.63           C
ATOM      0  H   THR A  12       1.550  13.325   2.151  1.00  9.63           H   new
ATOM      0  HA  THR A  12       0.627  10.618   2.196  1.00  9.85           H   new
ATOM      0  HB  THR A  12      -0.767  13.327   1.963  1.00 10.85           H   new
ATOM      0  HG1 THR A  12      -1.278  12.585   4.239  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -2.871  12.146   2.565  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -2.228  11.506   1.034  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -2.014  10.587   2.542  1.00  9.63           H   new
ATOM    204  N   ILE A  13       0.191  10.241  -0.262  1.00 10.42           N
ATOM    205  CA  ILE A  13       0.062   9.943  -1.655  1.00 11.84           C
ATOM    206  C   ILE A  13      -1.309   9.453  -1.971  1.00 10.55           C
ATOM    207  O   ILE A  13      -1.671   8.341  -1.590  1.00 11.92           O
ATOM    208  CB  ILE A  13       1.115   9.033  -2.214  1.00 14.86           C
ATOM    209  CG1 ILE A  13       2.546   9.500  -1.900  1.00 14.87           C
ATOM    210  CG2 ILE A  13       0.902   8.834  -3.724  1.00 17.08           C
ATOM    211  CD1 ILE A  13       3.617   8.465  -2.242  1.00 16.46           C
ATOM      0  H   ILE A  13       0.351   9.401   0.293  1.00 10.42           H   new
ATOM      0  HA  ILE A  13       0.229  10.893  -2.163  1.00 11.84           H   new
ATOM      0  HB  ILE A  13       1.004   8.070  -1.715  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       2.749  10.417  -2.453  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13       2.615   9.745  -0.840  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       1.674   8.171  -4.116  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13      -0.079   8.392  -3.898  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13       0.960   9.798  -4.230  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       4.601   8.864  -1.994  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       3.439   7.555  -1.669  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       3.576   8.237  -3.307  1.00 16.46           H   new
ATOM    223  N   THR A  14      -2.164  10.249  -2.638  1.00  9.39           N
ATOM    224  CA  THR A  14      -3.420   9.704  -3.050  1.00  9.63           C
ATOM    225  C   THR A  14      -3.289   8.735  -4.175  1.00 11.20           C
ATOM    226  O   THR A  14      -2.708   9.066  -5.208  1.00 11.63           O
ATOM    227  CB  THR A  14      -4.331  10.830  -3.441  1.00 10.38           C
ATOM    228  OG1 THR A  14      -4.436  11.789  -2.398  1.00 16.30           O
ATOM    229  CG2 THR A  14      -5.771  10.332  -3.645  1.00 11.66           C
ATOM      0  H   THR A  14      -1.999  11.225  -2.883  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -3.835   9.147  -2.210  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -3.905  11.252  -4.351  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -5.034  12.513  -2.678  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -6.409  11.169  -3.928  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -5.788   9.580  -4.434  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -6.139   9.893  -2.718  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -3.832   7.510  -4.059  1.00  8.29           N
ATOM    238  CA  LEU A  15      -3.983   6.625  -5.172  1.00  9.03           C
ATOM    239  C   LEU A  15      -5.396   6.387  -5.579  1.00  8.59           C
ATOM    240  O   LEU A  15      -6.306   6.467  -4.755  1.00  7.79           O
ATOM    241  CB  LEU A  15      -3.384   5.254  -4.812  1.00 11.08           C
ATOM    242  CG  LEU A  15      -1.910   5.203  -4.377  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -1.377   3.760  -4.366  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -0.927   6.020  -5.233  1.00 15.88           C
ATOM      0  H   LEU A  15      -4.172   7.127  -3.177  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -3.472   7.111  -6.004  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -3.984   4.828  -4.008  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -3.500   4.601  -5.677  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -1.942   5.649  -3.383  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15      -0.333   3.760  -4.054  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -1.964   3.161  -3.670  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -1.457   3.335  -5.367  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15       0.081   5.910  -4.834  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -0.952   5.658  -6.261  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -1.213   7.072  -5.211  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -5.645   6.097  -6.868  1.00 11.04           N
ATOM    257  CA  GLU A  16      -6.915   5.785  -7.446  1.00 11.50           C
ATOM    258  C   GLU A  16      -6.999   4.346  -7.820  1.00 10.13           C
ATOM    259  O   GLU A  16      -6.490   3.876  -8.837  1.00  9.83           O
ATOM    260  CB  GLU A  16      -7.041   6.646  -8.714  1.00 17.22           C
ATOM    261  CG  GLU A  16      -6.860   8.123  -8.359  1.00 23.33           C
ATOM    262  CD  GLU A  16      -6.899   9.070  -9.550  1.00 26.99           C
ATOM    263  OE1 GLU A  16      -7.956   9.130 -10.234  1.00 28.86           O
ATOM    264  OE2 GLU A  16      -5.878   9.760  -9.813  1.00 28.90           O
ATOM      0  H   GLU A  16      -4.897   6.080  -7.561  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -7.713   5.985  -6.731  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -6.291   6.344  -9.445  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -8.017   6.490  -9.175  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16      -7.641   8.412  -7.656  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16      -5.907   8.245  -7.845  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -7.626   3.489  -6.994  1.00  8.99           N
ATOM    272  CA  VAL A  17      -7.662   2.064  -7.106  1.00  8.85           C
ATOM    273  C   VAL A  17      -9.091   1.722  -6.859  1.00  8.04           C
ATOM    274  O   VAL A  17      -9.822   2.556  -6.325  1.00  8.99           O
ATOM    275  CB  VAL A  17      -6.774   1.344  -6.135  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -5.387   1.300  -6.799  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -6.698   2.078  -4.786  1.00 10.54           C
ATOM      0  H   VAL A  17      -8.149   3.821  -6.184  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -7.288   1.750  -8.081  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -7.159   0.348  -5.919  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -4.685   0.786  -6.142  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -5.454   0.766  -7.747  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -5.037   2.317  -6.979  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -6.046   1.527  -4.108  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -6.298   3.080  -4.939  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -7.696   2.148  -4.353  1.00 10.54           H   new
ATOM    287  N   GLU A  18      -9.590   0.506  -7.144  1.00  7.29           N
ATOM    288  CA  GLU A  18     -10.930   0.070  -6.900  1.00  7.08           C
ATOM    289  C   GLU A  18     -10.830  -1.099  -5.981  1.00  6.45           C
ATOM    290  O   GLU A  18      -9.738  -1.653  -5.875  1.00  5.28           O
ATOM    291  CB  GLU A  18     -11.578  -0.341  -8.232  1.00 10.28           C
ATOM    292  CG  GLU A  18     -11.831   0.867  -9.136  1.00 12.65           C
ATOM    293  CD  GLU A  18     -12.383   0.605 -10.530  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -11.703  -0.142 -11.283  1.00 18.17           O
ATOM    295  OE2 GLU A  18     -13.435   1.195 -10.894  1.00 14.33           O
ATOM      0  H   GLU A  18      -9.018  -0.221  -7.574  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -11.543   0.856  -6.458  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18     -10.931  -1.052  -8.747  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -12.521  -0.852  -8.036  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -12.524   1.532  -8.621  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -10.891   1.408  -9.244  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -11.772  -1.609  -5.243  1.00  7.24           N
ATOM    303  CA  PRO A  19     -11.470  -2.365  -4.063  1.00  7.07           C
ATOM    304  C   PRO A  19     -11.231  -3.776  -4.477  1.00  6.65           C
ATOM    305  O   PRO A  19     -10.970  -4.520  -3.533  1.00  6.37           O
ATOM    306  CB  PRO A  19     -12.729  -2.133  -3.231  1.00  7.61           C
ATOM    307  CG  PRO A  19     -13.868  -2.020  -4.257  1.00  8.16           C
ATOM    308  CD  PRO A  19     -13.184  -1.328  -5.448  1.00  7.49           C
ATOM      0  HA  PRO A  19     -10.579  -2.092  -3.497  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -12.902  -2.957  -2.538  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -12.645  -1.226  -2.633  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.265  -2.998  -4.530  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -14.702  -1.433  -3.873  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -13.538  -1.725  -6.399  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -13.382  -0.256  -5.457  1.00  7.49           H   new
ATOM    316  N   SER A  20     -11.490  -4.149  -5.743  1.00  6.80           N
ATOM    317  CA  SER A  20     -11.210  -5.379  -6.418  1.00  6.28           C
ATOM    318  C   SER A  20      -9.761  -5.429  -6.761  1.00  8.45           C
ATOM    319  O   SER A  20      -9.325  -6.483  -7.220  1.00  7.26           O
ATOM    320  CB  SER A  20     -11.981  -5.642  -7.723  1.00  8.57           C
ATOM    321  OG  SER A  20     -13.367  -5.506  -7.444  1.00 11.13           O
ATOM      0  H   SER A  20     -11.958  -3.498  -6.373  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -11.532  -6.143  -5.710  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -11.676  -4.936  -8.496  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -11.764  -6.641  -8.100  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -13.883  -5.667  -8.262  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -8.962  -4.356  -6.619  1.00  7.50           N
ATOM    328  CA  ASP A  21      -7.588  -4.237  -6.993  1.00  7.70           C
ATOM    329  C   ASP A  21      -6.664  -4.811  -5.975  1.00  7.08           C
ATOM    330  O   ASP A  21      -6.855  -4.741  -4.762  1.00  8.11           O
ATOM    331  CB  ASP A  21      -7.162  -2.828  -7.439  1.00 11.00           C
ATOM    332  CG  ASP A  21      -7.724  -2.420  -8.794  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -7.345  -3.033  -9.827  1.00 14.36           O
ATOM    334  OD2 ASP A  21      -8.580  -1.505  -8.929  1.00 18.03           O
ATOM      0  H   ASP A  21      -9.313  -3.493  -6.203  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -7.500  -4.850  -7.890  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -7.485  -2.106  -6.689  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -6.074  -2.782  -7.478  1.00 11.00           H   new
ATOM    339  N   THR A  22      -5.593  -5.473  -6.448  1.00  5.37           N
ATOM    340  CA  THR A  22      -4.691  -6.236  -5.642  1.00  6.01           C
ATOM    341  C   THR A  22      -3.619  -5.330  -5.141  1.00  8.01           C
ATOM    342  O   THR A  22      -3.417  -4.240  -5.673  1.00  8.11           O
ATOM    343  CB  THR A  22      -3.980  -7.384  -6.294  1.00  8.92           C
ATOM    344  OG1 THR A  22      -3.336  -6.940  -7.480  1.00 10.22           O
ATOM    345  CG2 THR A  22      -4.917  -8.552  -6.645  1.00  9.65           C
ATOM      0  H   THR A  22      -5.345  -5.476  -7.437  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -5.339  -6.669  -4.880  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -3.253  -7.752  -5.569  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -2.871  -7.693  -7.902  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -4.343  -9.351  -7.114  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -5.386  -8.928  -5.736  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -5.687  -8.206  -7.335  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -2.933  -5.841  -4.103  1.00  8.32           N
ATOM    354  CA  ILE A  23      -1.975  -5.050  -3.394  1.00  9.92           C
ATOM    355  C   ILE A  23      -0.731  -4.946  -4.208  1.00 10.01           C
ATOM    356  O   ILE A  23       0.040  -3.995  -4.086  1.00  8.71           O
ATOM    357  CB  ILE A  23      -1.720  -5.545  -2.001  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -3.030  -5.695  -1.209  1.00 11.38           C
ATOM    359  CG2 ILE A  23      -0.610  -4.724  -1.323  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -3.540  -4.311  -0.811  1.00 12.30           C
ATOM      0  H   ILE A  23      -3.040  -6.794  -3.756  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -2.387  -4.050  -3.255  1.00  9.92           H   new
ATOM      0  HB  ILE A  23      -1.323  -6.559  -2.037  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -3.777  -6.211  -1.813  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -2.863  -6.303  -0.320  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23      -0.443  -5.101  -0.314  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       0.311  -4.811  -1.900  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23      -0.910  -3.677  -1.274  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -4.469  -4.413  -0.249  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -2.794  -3.813  -0.192  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -3.722  -3.718  -1.708  1.00 12.30           H   new
ATOM    372  N   GLU A  24      -0.543  -5.829  -5.205  1.00  9.54           N
ATOM    373  CA  GLU A  24       0.391  -5.625  -6.268  1.00 11.81           C
ATOM    374  C   GLU A  24       0.118  -4.473  -7.173  1.00 11.14           C
ATOM    375  O   GLU A  24       1.060  -3.815  -7.613  1.00 10.62           O
ATOM    376  CB  GLU A  24       0.309  -6.938  -7.064  1.00 19.24           C
ATOM    377  CG  GLU A  24       1.199  -7.140  -8.292  1.00 27.76           C
ATOM    378  CD  GLU A  24       0.759  -8.292  -9.185  1.00 32.92           C
ATOM    379  OE1 GLU A  24       0.662  -9.456  -8.712  1.00 36.51           O
ATOM    380  OE2 GLU A  24       0.623  -8.007 -10.405  1.00 34.80           O
ATOM      0  H   GLU A  24      -1.055  -6.709  -5.274  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       1.367  -5.380  -5.850  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24       0.522  -7.752  -6.371  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24      -0.725  -7.057  -7.389  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       1.208  -6.221  -8.878  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       2.223  -7.318  -7.962  1.00 27.76           H   new
ATOM    387  N   ASN A  25      -1.159  -4.103  -7.374  1.00  9.43           N
ATOM    388  CA  ASN A  25      -1.582  -3.024  -8.212  1.00 10.96           C
ATOM    389  C   ASN A  25      -1.330  -1.726  -7.525  1.00  9.68           C
ATOM    390  O   ASN A  25      -0.938  -0.728  -8.130  1.00  9.33           O
ATOM    391  CB  ASN A  25      -3.048  -3.160  -8.656  1.00 16.78           C
ATOM    392  CG  ASN A  25      -3.295  -2.513 -10.011  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -2.363  -2.343 -10.796  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -4.544  -2.118 -10.377  1.00 24.70           N
ATOM      0  H   ASN A  25      -1.940  -4.584  -6.927  1.00  9.43           H   new
ATOM      0  HA  ASN A  25      -0.992  -3.058  -9.128  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -3.316  -4.215  -8.704  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -3.697  -2.700  -7.911  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -4.696  -1.689 -11.290  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -5.328  -2.251  -9.739  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -1.500  -1.668  -6.192  1.00  6.52           N
ATOM    402  CA  VAL A  26      -1.192  -0.599  -5.294  1.00  5.53           C
ATOM    403  C   VAL A  26       0.246  -0.219  -5.201  1.00  4.42           C
ATOM    404  O   VAL A  26       0.601   0.958  -5.233  1.00  3.40           O
ATOM    405  CB  VAL A  26      -1.778  -0.865  -3.939  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -1.524   0.291  -2.956  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -3.273  -1.201  -4.070  1.00  8.12           C
ATOM      0  H   VAL A  26      -1.899  -2.462  -5.691  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -1.662   0.279  -5.736  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -1.271  -1.731  -3.513  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -1.967   0.051  -1.990  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26      -0.451   0.438  -2.836  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -1.974   1.205  -3.345  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -3.691  -1.393  -3.082  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -3.796  -0.362  -4.528  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -3.394  -2.087  -4.693  1.00  8.12           H   new
ATOM    417  N   LYS A  27       1.159  -1.191  -5.023  1.00  2.64           N
ATOM    418  CA  LYS A  27       2.551  -0.952  -5.245  1.00  4.14           C
ATOM    419  C   LYS A  27       2.884  -0.552  -6.642  1.00  5.58           C
ATOM    420  O   LYS A  27       3.698   0.361  -6.767  1.00  4.11           O
ATOM    421  CB  LYS A  27       3.404  -2.177  -4.872  1.00  3.97           C
ATOM    422  CG  LYS A  27       3.353  -2.551  -3.390  1.00  7.45           C
ATOM    423  CD  LYS A  27       4.217  -3.765  -3.043  1.00  9.02           C
ATOM    424  CE  LYS A  27       4.234  -4.226  -1.584  1.00 12.90           C
ATOM    425  NZ  LYS A  27       5.127  -5.405  -1.541  1.00 15.47           N
ATOM      0  H   LYS A  27       0.934  -2.140  -4.726  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       2.788  -0.111  -4.593  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       3.070  -3.031  -5.462  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       4.440  -1.982  -5.150  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       3.681  -1.698  -2.796  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       2.320  -2.757  -3.109  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       3.883  -4.602  -3.656  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       5.243  -3.543  -3.338  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       4.599  -3.435  -0.929  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       3.231  -4.483  -1.244  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       5.437  -5.570  -0.562  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       4.615  -6.241  -1.888  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       5.958  -5.233  -2.143  1.00 15.47           H   new
ATOM    439  N   ALA A  28       2.258  -1.039  -7.728  1.00  6.61           N
ATOM    440  CA  ALA A  28       2.502  -0.546  -9.048  1.00  7.74           C
ATOM    441  C   ALA A  28       2.236   0.907  -9.240  1.00  9.17           C
ATOM    442  O   ALA A  28       3.071   1.557  -9.867  1.00 11.45           O
ATOM    443  CB  ALA A  28       1.649  -1.372 -10.026  1.00  7.68           C
ATOM      0  H   ALA A  28       1.569  -1.790  -7.689  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       3.570  -0.657  -9.235  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28       1.815  -1.017 -11.043  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       1.932  -2.423  -9.957  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28       0.595  -1.262  -9.771  1.00  7.68           H   new
ATOM    449  N   LYS A  29       1.202   1.569  -8.690  1.00  8.96           N
ATOM    450  CA  LYS A  29       1.057   2.992  -8.684  1.00  7.90           C
ATOM    451  C   LYS A  29       2.173   3.755  -8.059  1.00  6.92           C
ATOM    452  O   LYS A  29       2.741   4.717  -8.575  1.00  6.87           O
ATOM    453  CB  LYS A  29      -0.252   3.411  -7.993  1.00 10.28           C
ATOM    454  CG  LYS A  29      -1.459   2.532  -8.323  1.00 14.94           C
ATOM    455  CD  LYS A  29      -1.956   2.774  -9.750  1.00 19.69           C
ATOM    456  CE  LYS A  29      -3.386   2.252  -9.908  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -3.732   2.462 -11.331  1.00 24.98           N
ATOM      0  H   LYS A  29       0.430   1.089  -8.227  1.00  8.96           H   new
ATOM      0  HA  LYS A  29       1.057   3.249  -9.743  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -0.097   3.401  -6.914  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29      -0.481   4.439  -8.273  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -1.190   1.483  -8.204  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29      -2.264   2.737  -7.617  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -1.923   3.839  -9.979  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -1.298   2.275 -10.461  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -3.450   1.197  -9.641  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -4.074   2.789  -9.254  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -4.700   2.125 -11.506  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -3.672   3.475 -11.557  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -3.068   1.933 -11.932  1.00 24.98           H   new
ATOM    471  N   ILE A  30       2.729   3.340  -6.907  1.00  4.57           N
ATOM    472  CA  ILE A  30       3.848   3.954  -6.261  1.00  5.58           C
ATOM    473  C   ILE A  30       5.109   3.813  -7.042  1.00  7.26           C
ATOM    474  O   ILE A  30       5.907   4.745  -7.122  1.00  9.46           O
ATOM    475  CB  ILE A  30       3.986   3.373  -4.885  1.00  5.36           C
ATOM    476  CG1 ILE A  30       2.741   3.641  -4.022  1.00  2.94           C
ATOM    477  CG2 ILE A  30       5.137   4.123  -4.195  1.00  2.78           C
ATOM    478  CD1 ILE A  30       2.610   2.606  -2.906  1.00  2.00           C
ATOM      0  H   ILE A  30       2.377   2.529  -6.397  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       3.664   5.026  -6.192  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       4.142   2.298  -4.980  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       2.803   4.640  -3.590  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       1.849   3.619  -4.648  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       5.274   3.732  -3.187  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       6.055   3.984  -4.766  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       4.899   5.185  -4.143  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       1.721   2.821  -2.313  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       2.524   1.610  -3.341  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       3.492   2.647  -2.266  1.00  2.00           H   new
ATOM    490  N   GLN A  31       5.289   2.741  -7.835  1.00  7.06           N
ATOM    491  CA  GLN A  31       6.319   2.593  -8.816  1.00  8.67           C
ATOM    492  C   GLN A  31       6.087   3.589  -9.899  1.00 10.90           C
ATOM    493  O   GLN A  31       7.020   4.345 -10.169  1.00  9.63           O
ATOM    494  CB  GLN A  31       6.467   1.155  -9.343  1.00  9.12           C
ATOM    495  CG  GLN A  31       7.794   0.901 -10.063  1.00 10.76           C
ATOM    496  CD  GLN A  31       7.975  -0.606 -10.171  1.00 13.78           C
ATOM    497  OE1 GLN A  31       7.090  -1.403  -9.864  1.00 14.48           O
ATOM    498  NE2 GLN A  31       9.187  -1.071 -10.576  1.00 14.76           N
ATOM      0  H   GLN A  31       4.676   1.927  -7.787  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       7.280   2.793  -8.343  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       6.377   0.460  -8.508  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       5.645   0.941 -10.026  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       7.787   1.358 -11.052  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       8.621   1.348  -9.511  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       9.925  -0.415 -10.832  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       9.358  -2.075 -10.624  1.00 14.76           H   new
ATOM    507  N   ASP A  32       4.905   3.694 -10.532  1.00 10.93           N
ATOM    508  CA  ASP A  32       4.613   4.682 -11.523  1.00 14.01           C
ATOM    509  C   ASP A  32       4.907   6.086 -11.120  1.00 14.04           C
ATOM    510  O   ASP A  32       5.411   6.782 -12.000  1.00 13.39           O
ATOM    511  CB  ASP A  32       3.219   4.260 -12.015  1.00 18.01           C
ATOM    512  CG  ASP A  32       2.590   5.141 -13.085  1.00 24.33           C
ATOM    513  OD1 ASP A  32       3.101   5.183 -14.237  1.00 25.17           O
ATOM    514  OD2 ASP A  32       1.624   5.878 -12.753  1.00 26.29           O
ATOM      0  H   ASP A  32       4.123   3.066 -10.346  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       5.286   4.713 -12.380  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       3.286   3.244 -12.403  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       2.547   4.230 -11.157  1.00 18.01           H   new
ATOM    519  N   LYS A  33       4.554   6.430  -9.868  1.00 14.22           N
ATOM    520  CA  LYS A  33       4.708   7.728  -9.289  1.00 14.00           C
ATOM    521  C   LYS A  33       6.096   7.962  -8.802  1.00 12.37           C
ATOM    522  O   LYS A  33       6.891   8.483  -9.582  1.00 12.17           O
ATOM    523  CB  LYS A  33       3.837   7.961  -8.043  1.00 18.62           C
ATOM    524  CG  LYS A  33       2.353   8.098  -8.390  1.00 24.00           C
ATOM    525  CD  LYS A  33       1.549   8.630  -7.202  1.00 27.61           C
ATOM    526  CE  LYS A  33       0.042   8.811  -7.395  1.00 27.64           C
ATOM    527  NZ  LYS A  33      -0.165   9.689  -8.569  1.00 30.06           N
ATOM      0  H   LYS A  33       4.136   5.760  -9.222  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       4.421   8.394 -10.103  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       3.971   7.131  -7.349  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       4.173   8.863  -7.531  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33       2.237   8.770  -9.240  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       1.958   7.129  -8.694  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33       1.702   7.953  -6.362  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33       1.970   9.594  -6.915  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -0.441   7.846  -7.550  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33      -0.406   9.252  -6.505  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -1.169   9.953  -8.633  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33       0.413  10.548  -8.466  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33       0.116   9.184  -9.434  1.00 30.06           H   new
ATOM    541  N   GLU A  34       6.448   7.564  -7.566  1.00 10.11           N
ATOM    542  CA  GLU A  34       7.717   7.820  -6.958  1.00 10.07           C
ATOM    543  C   GLU A  34       8.870   7.041  -7.488  1.00  9.32           C
ATOM    544  O   GLU A  34      10.018   7.481  -7.541  1.00 11.61           O
ATOM    545  CB  GLU A  34       7.602   7.535  -5.451  1.00 14.77           C
ATOM    546  CG  GLU A  34       6.445   8.258  -4.757  1.00 18.75           C
ATOM    547  CD  GLU A  34       6.389   9.770  -4.919  1.00 22.28           C
ATOM    548  OE1 GLU A  34       7.253  10.473  -4.330  1.00 25.19           O
ATOM    549  OE2 GLU A  34       5.414  10.313  -5.503  1.00 21.95           O
ATOM      0  H   GLU A  34       5.817   7.038  -6.962  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       7.937   8.862  -7.191  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       7.483   6.461  -5.305  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       8.536   7.821  -4.967  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       5.510   7.841  -5.131  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       6.492   8.031  -3.692  1.00 18.75           H   new
ATOM    556  N   GLY A  35       8.676   5.782  -7.920  1.00  7.22           N
ATOM    557  CA  GLY A  35       9.769   4.970  -8.356  1.00  6.29           C
ATOM    558  C   GLY A  35      10.322   4.073  -7.303  1.00  6.93           C
ATOM    559  O   GLY A  35      11.534   3.920  -7.159  1.00  7.41           O
ATOM      0  H   GLY A  35       7.764   5.327  -7.967  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       9.442   4.362  -9.200  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35      10.566   5.618  -8.720  1.00  6.29           H   new
ATOM    563  N   ILE A  36       9.511   3.444  -6.433  1.00  5.86           N
ATOM    564  CA  ILE A  36       9.886   2.497  -5.430  1.00  6.07           C
ATOM    565  C   ILE A  36       9.618   1.107  -5.895  1.00  6.36           C
ATOM    566  O   ILE A  36       8.440   0.786  -6.043  1.00  6.18           O
ATOM    567  CB  ILE A  36       9.184   2.669  -4.116  1.00  7.47           C
ATOM    568  CG1 ILE A  36       9.177   4.129  -3.635  1.00  8.52           C
ATOM    569  CG2 ILE A  36       9.914   1.830  -3.053  1.00  7.36           C
ATOM    570  CD1 ILE A  36      10.513   4.872  -3.618  1.00  9.49           C
ATOM      0  H   ILE A  36       8.505   3.615  -6.434  1.00  5.86           H   new
ATOM      0  HA  ILE A  36      10.949   2.679  -5.269  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       8.151   2.350  -4.257  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36       8.489   4.689  -4.268  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       8.768   4.149  -2.625  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       9.414   1.946  -2.092  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       9.900   0.780  -3.345  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36      10.946   2.169  -2.968  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36      10.359   5.889  -3.258  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36      11.209   4.354  -2.958  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36      10.925   4.903  -4.627  1.00  9.49           H   new
ATOM    582  N   PRO A  37      10.513   0.198  -6.147  1.00  8.65           N
ATOM    583  CA  PRO A  37      10.229  -1.110  -6.662  1.00  9.18           C
ATOM    584  C   PRO A  37       9.433  -1.967  -5.739  1.00  9.85           C
ATOM    585  O   PRO A  37       9.473  -1.655  -4.550  1.00  8.51           O
ATOM    586  CB  PRO A  37      11.600  -1.756  -6.844  1.00 11.42           C
ATOM    587  CG  PRO A  37      12.388  -0.572  -7.427  1.00  9.27           C
ATOM    588  CD  PRO A  37      11.855   0.580  -6.560  1.00  8.33           C
ATOM      0  HA  PRO A  37       9.635  -1.019  -7.571  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37      12.020  -2.111  -5.903  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37      11.570  -2.609  -7.522  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      13.465  -0.702  -7.325  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      12.184  -0.421  -8.487  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      12.496   0.743  -5.694  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      11.837   1.513  -7.123  1.00  8.33           H   new
ATOM    596  N   PRO A  38       8.617  -2.924  -6.068  1.00  8.71           N
ATOM    597  CA  PRO A  38       7.685  -3.473  -5.126  1.00  9.08           C
ATOM    598  C   PRO A  38       8.273  -4.435  -4.152  1.00  9.28           C
ATOM    599  O   PRO A  38       7.614  -4.739  -3.159  1.00  6.50           O
ATOM    600  CB  PRO A  38       6.601  -4.075  -6.019  1.00 10.31           C
ATOM    601  CG  PRO A  38       7.331  -4.455  -7.317  1.00 10.81           C
ATOM    602  CD  PRO A  38       8.383  -3.341  -7.442  1.00 12.00           C
ATOM      0  HA  PRO A  38       7.298  -2.714  -4.447  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       6.143  -4.947  -5.552  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       5.802  -3.359  -6.209  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       7.790  -5.442  -7.251  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       6.656  -4.474  -8.172  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       9.297  -3.706  -7.910  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       8.020  -2.515  -8.054  1.00 12.00           H   new
ATOM    610  N   ASP A  39       9.533  -4.868  -4.337  1.00 11.20           N
ATOM    611  CA  ASP A  39      10.232  -5.762  -3.468  1.00 14.96           C
ATOM    612  C   ASP A  39      10.610  -4.998  -2.246  1.00 13.99           C
ATOM    613  O   ASP A  39      10.723  -5.475  -1.118  1.00 13.75           O
ATOM    614  CB  ASP A  39      11.344  -6.544  -4.187  1.00 24.16           C
ATOM    615  CG  ASP A  39      10.781  -7.320  -5.369  1.00 31.06           C
ATOM    616  OD1 ASP A  39      10.800  -6.743  -6.489  1.00 34.22           O
ATOM    617  OD2 ASP A  39      10.476  -8.527  -5.173  1.00 35.55           O
ATOM      0  H   ASP A  39      10.094  -4.578  -5.138  1.00 11.20           H   new
ATOM      0  HA  ASP A  39       9.596  -6.583  -3.135  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      12.115  -5.855  -4.532  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      11.821  -7.232  -3.489  1.00 24.16           H   new
ATOM    622  N   GLN A  40      10.798  -3.678  -2.422  1.00 11.60           N
ATOM    623  CA  GLN A  40      11.264  -2.748  -1.440  1.00 10.76           C
ATOM    624  C   GLN A  40      10.158  -2.244  -0.579  1.00  8.01           C
ATOM    625  O   GLN A  40      10.342  -1.627   0.469  1.00  8.96           O
ATOM    626  CB  GLN A  40      11.966  -1.522  -2.049  1.00 11.14           C
ATOM    627  CG  GLN A  40      13.075  -1.914  -3.027  1.00 14.85           C
ATOM    628  CD  GLN A  40      13.930  -0.707  -3.385  1.00 16.11           C
ATOM    629  OE1 GLN A  40      13.600   0.452  -3.138  1.00 20.52           O
ATOM    630  NE2 GLN A  40      15.165  -0.924  -3.911  1.00 18.16           N
ATOM      0  H   GLN A  40      10.610  -3.228  -3.318  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      11.982  -3.317  -0.849  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      11.231  -0.905  -2.565  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      12.388  -0.913  -1.249  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      13.700  -2.690  -2.584  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      12.636  -2.336  -3.931  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      15.468  -1.874  -4.127  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      15.789  -0.137  -4.090  1.00 18.16           H   new
ATOM    639  N   GLN A  41       8.909  -2.360  -1.066  1.00  6.52           N
ATOM    640  CA  GLN A  41       7.862  -1.738  -0.316  1.00  3.87           C
ATOM    641  C   GLN A  41       7.190  -2.644   0.657  1.00  4.79           C
ATOM    642  O   GLN A  41       7.005  -3.852   0.516  1.00  6.34           O
ATOM    643  CB  GLN A  41       6.754  -1.246  -1.262  1.00  4.20           C
ATOM    644  CG  GLN A  41       7.163  -0.071  -2.152  1.00  3.20           C
ATOM    645  CD  GLN A  41       6.032   0.421  -3.044  1.00  4.89           C
ATOM    646  OE1 GLN A  41       4.922   0.733  -2.614  1.00  5.21           O
ATOM    647  NE2 GLN A  41       6.237   0.436  -4.388  1.00  7.13           N
ATOM      0  H   GLN A  41       8.634  -2.848  -1.918  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       8.353  -0.930   0.227  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.439  -2.075  -1.896  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       5.889  -0.953  -0.668  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       7.507   0.751  -1.524  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       8.006  -0.370  -2.775  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       7.149   0.181  -4.768  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       5.479   0.702  -5.017  1.00  7.13           H   new
ATOM    656  N   ARG A  42       6.700  -2.070   1.771  1.00  5.73           N
ATOM    657  CA  ARG A  42       5.806  -2.729   2.671  1.00  6.97           C
ATOM    658  C   ARG A  42       4.805  -1.732   3.145  1.00  7.15           C
ATOM    659  O   ARG A  42       5.072  -0.710   3.775  1.00  7.33           O
ATOM    660  CB  ARG A  42       6.514  -3.201   3.952  1.00 13.23           C
ATOM    661  CG  ARG A  42       7.293  -4.498   3.726  1.00 21.27           C
ATOM    662  CD  ARG A  42       8.011  -4.983   4.987  1.00 26.14           C
ATOM    663  NE  ARG A  42       6.992  -5.247   6.041  1.00 32.26           N
ATOM    664  CZ  ARG A  42       7.033  -4.644   7.265  1.00 34.32           C
ATOM    665  NH1 ARG A  42       7.800  -3.534   7.467  1.00 35.30           N
ATOM    666  NH2 ARG A  42       6.173  -5.050   8.245  1.00 36.39           N
ATOM      0  H   ARG A  42       6.933  -1.118   2.054  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       5.380  -3.576   2.134  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       7.195  -2.424   4.298  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       5.776  -3.353   4.740  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       6.608  -5.273   3.382  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       8.025  -4.344   2.933  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       8.579  -5.889   4.774  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       8.724  -4.233   5.329  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       6.236  -5.902   5.841  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42       8.350  -3.147   6.700  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42       7.824  -3.091   8.385  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42       5.506  -5.799   8.060  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42       6.198  -4.604   9.162  1.00 36.39           H   new
ATOM    680  N   LEU A  43       3.559  -2.191   2.929  1.00  4.65           N
ATOM    681  CA  LEU A  43       2.419  -1.375   3.212  1.00  3.51           C
ATOM    682  C   LEU A  43       1.773  -1.942   4.429  1.00  5.56           C
ATOM    683  O   LEU A  43       1.341  -3.093   4.419  1.00  4.19           O
ATOM    684  CB  LEU A  43       1.539  -1.461   1.953  1.00  3.74           C
ATOM    685  CG  LEU A  43       2.091  -0.920   0.623  1.00  6.32           C
ATOM    686  CD1 LEU A  43       1.461  -1.535  -0.638  1.00  6.41           C
ATOM    687  CD2 LEU A  43       1.991   0.612   0.711  1.00  9.55           C
ATOM      0  H   LEU A  43       3.342  -3.118   2.562  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       2.636  -0.327   3.419  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       1.282  -2.509   1.801  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       0.609  -0.932   2.164  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       3.130  -1.225   0.496  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       1.914  -1.091  -1.525  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       1.633  -2.611  -0.643  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43       0.389  -1.339  -0.642  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       2.370   1.055  -0.210  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       0.949   0.901   0.850  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       2.582   0.967   1.555  1.00  9.55           H   new
ATOM    699  N   ILE A  44       1.628  -1.174   5.524  1.00  4.58           N
ATOM    700  CA  ILE A  44       1.189  -1.695   6.782  1.00  5.55           C
ATOM    701  C   ILE A  44      -0.119  -0.988   6.881  1.00  5.46           C
ATOM    702  O   ILE A  44      -0.223   0.219   6.670  1.00  6.04           O
ATOM    703  CB  ILE A  44       2.031  -1.383   7.983  1.00  6.80           C
ATOM    704  CG1 ILE A  44       3.347  -2.178   7.968  1.00 10.31           C
ATOM    705  CG2 ILE A  44       1.325  -1.614   9.329  1.00  7.39           C
ATOM    706  CD1 ILE A  44       4.459  -1.678   8.888  1.00 13.90           C
ATOM      0  H   ILE A  44       1.819  -0.172   5.536  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       1.199  -2.785   6.794  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       2.232  -0.315   7.904  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       3.124  -3.211   8.234  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       3.728  -2.187   6.947  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       2.005  -1.364  10.144  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44       0.439  -0.982   9.388  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       1.030  -2.660   9.410  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       5.333  -2.322   8.786  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       4.726  -0.657   8.614  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       4.113  -1.698   9.921  1.00 13.90           H   new
ATOM    718  N   PHE A  45      -1.162  -1.742   7.274  1.00  6.75           N
ATOM    719  CA  PHE A  45      -2.470  -1.294   7.637  1.00  4.70           C
ATOM    720  C   PHE A  45      -2.648  -1.632   9.078  1.00  6.34           C
ATOM    721  O   PHE A  45      -2.694  -2.798   9.466  1.00  5.45           O
ATOM    722  CB  PHE A  45      -3.566  -2.023   6.842  1.00  5.51           C
ATOM    723  CG  PHE A  45      -4.982  -1.569   6.938  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -5.190  -0.217   7.069  1.00  6.86           C
ATOM    725  CD2 PHE A  45      -6.035  -2.453   6.909  1.00  5.87           C
ATOM    726  CE1 PHE A  45      -6.479   0.260   7.042  1.00  6.68           C
ATOM    727  CE2 PHE A  45      -7.326  -1.980   6.900  1.00  6.64           C
ATOM    728  CZ  PHE A  45      -7.527  -0.631   7.076  1.00  6.84           C
ATOM      0  H   PHE A  45      -1.079  -2.756   7.343  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -2.557  -0.227   7.431  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -3.284  -1.984   5.790  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -3.540  -3.071   7.141  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -4.356   0.458   7.191  1.00  6.86           H   new
ATOM      0  HD2 PHE A  45      -5.848  -3.517   6.893  1.00  5.87           H   new
ATOM      0  HE1 PHE A  45      -6.667   1.322   6.995  1.00  6.68           H   new
ATOM      0  HE2 PHE A  45      -8.161  -2.651   6.758  1.00  6.64           H   new
ATOM      0  HZ  PHE A  45      -8.528  -0.263   7.244  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -2.530  -0.594   9.925  1.00  6.53           N
ATOM    739  CA  ALA A  46      -2.550  -0.664  11.353  1.00  7.15           C
ATOM    740  C   ALA A  46      -1.363  -1.344  11.944  1.00  9.00           C
ATOM    741  O   ALA A  46      -0.280  -0.767  12.024  1.00 11.15           O
ATOM    742  CB  ALA A  46      -3.906  -1.198  11.844  1.00  8.99           C
ATOM      0  H   ALA A  46      -2.412   0.361   9.587  1.00  6.53           H   new
ATOM      0  HA  ALA A  46      -2.454   0.353  11.734  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -3.906  -1.246  12.933  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -4.702  -0.532  11.510  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -4.073  -2.195  11.437  1.00  8.99           H   new
ATOM    748  N   GLY A  47      -1.479  -2.592  12.434  1.00  9.35           N
ATOM    749  CA  GLY A  47      -0.346  -3.369  12.831  1.00 11.68           C
ATOM    750  C   GLY A  47      -0.068  -4.591  12.024  1.00 11.14           C
ATOM    751  O   GLY A  47       0.514  -5.498  12.618  1.00 13.93           O
ATOM      0  H   GLY A  47      -2.373  -3.068  12.556  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47       0.536  -2.729  12.798  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47      -0.484  -3.669  13.870  1.00 11.68           H   new
ATOM    755  N   LYS A  48      -0.411  -4.742  10.733  1.00 10.47           N
ATOM    756  CA  LYS A  48      -0.010  -5.832   9.899  1.00  8.82           C
ATOM    757  C   LYS A  48       0.158  -5.412   8.479  1.00  7.68           C
ATOM    758  O   LYS A  48      -0.325  -4.356   8.074  1.00  6.47           O
ATOM    759  CB  LYS A  48      -1.060  -6.955   9.862  1.00  9.74           C
ATOM    760  CG  LYS A  48      -2.382  -6.674   9.144  1.00 14.14           C
ATOM    761  CD  LYS A  48      -3.340  -7.859   9.285  1.00 16.32           C
ATOM    762  CE  LYS A  48      -4.649  -7.505   8.577  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -5.725  -8.521   8.632  1.00 23.92           N
ATOM      0  H   LYS A  48      -1.000  -4.067  10.245  1.00 10.47           H   new
ATOM      0  HA  LYS A  48       0.928  -6.178  10.333  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -0.602  -7.826   9.392  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -1.290  -7.232  10.891  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48      -2.842  -5.777   9.558  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48      -2.193  -6.477   8.089  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -2.902  -8.756   8.847  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48      -3.524  -8.076  10.337  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -5.031  -6.580   9.008  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -4.426  -7.300   7.530  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -6.560  -8.171   8.120  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -5.393  -9.402   8.191  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -5.979  -8.704   9.624  1.00 23.92           H   new
ATOM    777  N   GLN A  49       0.936  -6.228   7.746  1.00  8.89           N
ATOM    778  CA  GLN A  49       1.323  -6.007   6.387  1.00  7.18           C
ATOM    779  C   GLN A  49       0.280  -6.514   5.451  1.00  8.23           C
ATOM    780  O   GLN A  49      -0.341  -7.533   5.747  1.00  9.70           O
ATOM    781  CB  GLN A  49       2.714  -6.480   5.933  1.00 11.67           C
ATOM    782  CG  GLN A  49       3.019  -7.978   5.988  1.00 15.82           C
ATOM    783  CD  GLN A  49       4.432  -8.193   5.466  1.00 20.21           C
ATOM    784  OE1 GLN A  49       5.404  -7.545   5.850  1.00 23.23           O
ATOM    785  NE2 GLN A  49       4.541  -9.104   4.462  1.00 20.67           N
ATOM      0  H   GLN A  49       1.318  -7.094   8.126  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       1.412  -4.921   6.351  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       2.860  -6.147   4.905  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       3.457  -5.966   6.543  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       2.931  -8.347   7.010  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       2.302  -8.535   5.385  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       3.721  -9.630   4.160  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       5.443  -9.261   4.011  1.00 20.67           H   new
ATOM    794  N   LEU A  50      -0.013  -5.738   4.392  1.00  6.51           N
ATOM    795  CA  LEU A  50      -0.904  -6.080   3.326  1.00  7.41           C
ATOM    796  C   LEU A  50      -0.109  -6.893   2.364  1.00  8.27           C
ATOM    797  O   LEU A  50       1.027  -6.556   2.034  1.00  8.34           O
ATOM    798  CB  LEU A  50      -1.429  -4.831   2.598  1.00  7.13           C
ATOM    799  CG  LEU A  50      -2.194  -3.852   3.505  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -2.438  -2.575   2.684  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -3.466  -4.453   4.127  1.00  8.14           C
ATOM      0  H   LEU A  50       0.399  -4.813   4.273  1.00  6.51           H   new
ATOM      0  HA  LEU A  50      -1.767  -6.615   3.722  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50      -0.588  -4.307   2.144  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -2.085  -5.145   1.786  1.00  7.13           H   new
ATOM      0  HG  LEU A  50      -1.597  -3.612   4.385  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -2.980  -1.850   3.291  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50      -1.482  -2.150   2.379  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -3.025  -2.818   1.799  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -3.953  -3.706   4.754  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -4.148  -4.762   3.334  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -3.200  -5.318   4.734  1.00  8.14           H   new
ATOM    813  N   GLU A  51      -0.676  -8.045   1.963  1.00  9.43           N
ATOM    814  CA  GLU A  51      -0.066  -8.971   1.060  1.00 11.90           C
ATOM    815  C   GLU A  51      -0.431  -8.804  -0.375  1.00 11.49           C
ATOM    816  O   GLU A  51      -1.607  -8.734  -0.731  1.00  9.88           O
ATOM    817  CB  GLU A  51      -0.470 -10.356   1.592  1.00 16.56           C
ATOM    818  CG  GLU A  51       0.014 -10.560   3.029  1.00 26.06           C
ATOM    819  CD  GLU A  51      -0.044 -11.979   3.576  1.00 29.86           C
ATOM    820  OE1 GLU A  51       0.769 -12.838   3.142  1.00 33.44           O
ATOM    821  OE2 GLU A  51      -0.900 -12.240   4.463  1.00 32.13           O
ATOM      0  H   GLU A  51      -1.598  -8.343   2.281  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       1.012  -8.808   1.043  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51      -1.554 -10.462   1.552  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51      -0.051 -11.131   0.951  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       1.045 -10.213   3.093  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51      -0.579  -9.919   3.682  1.00 26.06           H   new
ATOM    828  N   ASP A  52       0.566  -8.841  -1.277  1.00 12.71           N
ATOM    829  CA  ASP A  52       0.611  -8.518  -2.669  1.00 16.56           C
ATOM    830  C   ASP A  52      -0.495  -9.174  -3.422  1.00 15.83           C
ATOM    831  O   ASP A  52      -1.115  -8.533  -4.269  1.00 17.21           O
ATOM    832  CB  ASP A  52       1.987  -8.870  -3.258  1.00 21.05           C
ATOM    833  CG  ASP A  52       3.117  -8.137  -2.549  1.00 25.12           C
ATOM    834  OD1 ASP A  52       3.422  -8.498  -1.381  1.00 25.82           O
ATOM    835  OD2 ASP A  52       3.734  -7.176  -3.083  1.00 28.37           O
ATOM      0  H   ASP A  52       1.489  -9.149  -0.971  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       0.465  -7.443  -2.771  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       2.149  -9.945  -3.182  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       2.002  -8.619  -4.319  1.00 21.05           H   new
ATOM    840  N   GLY A  53      -0.728 -10.478  -3.191  1.00 15.00           N
ATOM    841  CA  GLY A  53      -1.540 -11.408  -3.913  1.00 11.77           C
ATOM    842  C   GLY A  53      -2.988 -11.253  -3.597  1.00 11.10           C
ATOM    843  O   GLY A  53      -3.862 -11.906  -4.165  1.00 11.25           O
ATOM      0  H   GLY A  53      -0.287 -10.935  -2.393  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -1.386 -11.268  -4.983  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53      -1.225 -12.424  -3.676  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -3.405 -10.451  -2.601  1.00  8.53           N
ATOM    848  CA  ARG A  54      -4.758 -10.226  -2.195  1.00  9.05           C
ATOM    849  C   ARG A  54      -5.276  -8.919  -2.687  1.00  8.96           C
ATOM    850  O   ARG A  54      -4.608  -8.100  -3.318  1.00 11.60           O
ATOM    851  CB  ARG A  54      -4.694 -10.175  -0.659  1.00  7.97           C
ATOM    852  CG  ARG A  54      -4.462 -11.441   0.169  1.00  9.62           C
ATOM    853  CD  ARG A  54      -5.630 -12.425   0.266  1.00 12.20           C
ATOM    854  NE  ARG A  54      -5.052 -13.657   0.873  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -5.759 -14.810   1.062  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -7.115 -14.830   0.906  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -5.068 -15.863   1.590  1.00 25.50           N
ATOM      0  H   ARG A  54      -2.743  -9.919  -2.036  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -5.416 -11.000  -2.590  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -3.901  -9.474  -0.397  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -5.632  -9.738  -0.316  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -3.606 -11.970  -0.251  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -4.186 -11.140   1.180  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -6.434 -12.022   0.882  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -6.054 -12.632  -0.717  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -4.074 -13.638   1.163  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -7.611 -13.978   0.646  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -7.632 -15.697   1.050  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54      -4.079 -15.761   1.819  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -5.541 -16.752   1.755  1.00 25.50           H   new
ATOM    871  N   THR A  55      -6.607  -8.758  -2.579  1.00  9.05           N
ATOM    872  CA  THR A  55      -7.290  -7.550  -2.923  1.00  9.03           C
ATOM    873  C   THR A  55      -7.342  -6.681  -1.713  1.00  8.15           C
ATOM    874  O   THR A  55      -7.033  -7.176  -0.631  1.00  5.91           O
ATOM    875  CB  THR A  55      -8.691  -7.754  -3.420  1.00 11.15           C
ATOM    876  OG1 THR A  55      -9.399  -8.560  -2.490  1.00 11.95           O
ATOM    877  CG2 THR A  55      -8.688  -8.531  -4.747  1.00 11.71           C
ATOM      0  H   THR A  55      -7.228  -9.493  -2.241  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -6.732  -7.098  -3.743  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -9.148  -6.773  -3.549  1.00 11.15           H   new
ATOM      0  HG1 THR A  55     -10.317  -8.228  -2.402  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -9.713  -8.668  -5.090  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -8.127  -7.971  -5.495  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -8.222  -9.505  -4.597  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -7.776  -5.415  -1.846  1.00  6.91           N
ATOM    886  CA  LEU A  56      -8.114  -4.456  -0.840  1.00  8.29           C
ATOM    887  C   LEU A  56      -9.403  -4.815  -0.183  1.00  8.05           C
ATOM    888  O   LEU A  56      -9.514  -4.517   1.005  1.00 10.17           O
ATOM    889  CB  LEU A  56      -8.286  -3.087  -1.520  1.00  6.60           C
ATOM    890  CG  LEU A  56      -6.947  -2.396  -1.827  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -7.121  -1.061  -2.571  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -6.169  -1.998  -0.561  1.00  9.85           C
ATOM      0  H   LEU A  56      -7.905  -5.018  -2.777  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -7.325  -4.433  -0.089  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -8.843  -3.216  -2.448  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -8.883  -2.441  -0.877  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -6.420  -3.143  -2.421  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -6.142  -0.620  -2.760  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -7.629  -1.236  -3.519  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -7.715  -0.380  -1.962  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -5.234  -1.515  -0.845  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -6.768  -1.307   0.032  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -5.953  -2.889   0.028  1.00  9.85           H   new
ATOM    904  N   SER A  57     -10.373  -5.461  -0.854  1.00  8.92           N
ATOM    905  CA  SER A  57     -11.670  -5.924  -0.469  1.00  9.00           C
ATOM    906  C   SER A  57     -11.607  -7.010   0.550  1.00  9.44           C
ATOM    907  O   SER A  57     -12.402  -7.077   1.486  1.00 10.91           O
ATOM    908  CB  SER A  57     -12.576  -6.310  -1.650  1.00 10.32           C
ATOM    909  OG  SER A  57     -11.997  -7.216  -2.577  1.00 13.59           O
ATOM      0  H   SER A  57     -10.211  -5.694  -1.834  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -12.144  -5.060  -0.003  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -13.492  -6.751  -1.257  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -12.862  -5.402  -2.182  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -11.458  -6.719  -3.227  1.00 13.59           H   new
ATOM    915  N   ASP A  58     -10.581  -7.878   0.597  1.00  9.11           N
ATOM    916  CA  ASP A  58     -10.370  -8.901   1.574  1.00  7.91           C
ATOM    917  C   ASP A  58     -10.206  -8.321   2.937  1.00  9.12           C
ATOM    918  O   ASP A  58     -10.837  -8.687   3.927  1.00  8.61           O
ATOM    919  CB  ASP A  58      -9.155  -9.670   1.028  1.00  8.41           C
ATOM    920  CG  ASP A  58      -8.866 -10.961   1.781  1.00 11.50           C
ATOM    921  OD1 ASP A  58      -9.759 -11.850   1.782  1.00 10.05           O
ATOM    922  OD2 ASP A  58      -7.842 -11.201   2.474  1.00 11.70           O
ATOM      0  H   ASP A  58      -9.841  -7.862  -0.105  1.00  9.11           H   new
ATOM      0  HA  ASP A  58     -11.213  -9.578   1.712  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -9.324  -9.902  -0.024  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -8.276  -9.027   1.075  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -9.394  -7.249   2.972  1.00  7.97           N
ATOM    928  CA  TYR A  59      -8.998  -6.496   4.121  1.00  8.45           C
ATOM    929  C   TYR A  59     -10.052  -5.552   4.591  1.00 10.98           C
ATOM    930  O   TYR A  59     -10.013  -4.965   5.671  1.00 12.95           O
ATOM    931  CB  TYR A  59      -7.717  -5.677   3.889  1.00  7.94           C
ATOM    932  CG  TYR A  59      -6.449  -6.443   3.731  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -5.877  -7.003   4.849  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -5.976  -6.697   2.465  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -4.769  -7.801   4.681  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -4.930  -7.574   2.303  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -4.272  -8.032   3.421  1.00  6.76           C
ATOM    938  OH  TYR A  59      -3.162  -8.897   3.316  1.00  7.63           O
ATOM      0  H   TYR A  59      -8.978  -6.878   2.118  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -8.818  -7.256   4.881  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -7.860  -5.069   2.996  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -7.597  -4.990   4.727  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -6.286  -6.821   5.832  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -6.421  -6.213   1.608  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -4.289  -8.246   5.540  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -4.630  -7.897   1.317  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -3.253  -9.450   2.512  1.00  7.63           H   new
ATOM    948  N   ASN A  60     -11.084  -5.341   3.756  1.00 12.38           N
ATOM    949  CA  ASN A  60     -12.067  -4.305   3.827  1.00 13.94           C
ATOM    950  C   ASN A  60     -11.584  -2.910   3.624  1.00 14.16           C
ATOM    951  O   ASN A  60     -12.037  -1.957   4.257  1.00 14.26           O
ATOM    952  CB  ASN A  60     -13.136  -4.399   4.928  1.00 19.23           C
ATOM    953  CG  ASN A  60     -13.979  -5.657   4.775  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -13.951  -6.500   5.670  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -14.624  -5.760   3.582  1.00 24.09           N
ATOM      0  H   ASN A  60     -11.244  -5.954   2.957  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -12.610  -4.563   2.918  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -12.655  -4.398   5.906  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -13.780  -3.520   4.889  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -15.153  -6.603   3.359  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -14.579  -4.994   2.910  1.00 24.09           H   new
ATOM    962  N   ILE A  61     -10.542  -2.646   2.816  1.00 11.08           N
ATOM    963  CA  ILE A  61      -9.938  -1.350   2.791  1.00 11.78           C
ATOM    964  C   ILE A  61     -10.854  -0.545   1.935  1.00 13.74           C
ATOM    965  O   ILE A  61     -11.263  -0.978   0.859  1.00 14.60           O
ATOM    966  CB  ILE A  61      -8.523  -1.326   2.294  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -7.713  -2.068   3.371  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -7.883   0.053   2.066  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -6.356  -2.670   3.009  1.00 11.42           C
ATOM      0  H   ILE A  61     -10.119  -3.325   2.183  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -9.831  -0.952   3.800  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -8.522  -1.775   1.301  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -7.553  -1.374   4.196  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -8.338  -2.876   3.751  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -6.862  -0.075   1.708  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -8.461   0.604   1.325  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -7.872   0.608   3.004  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -5.927  -3.154   3.886  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -6.485  -3.406   2.215  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -5.687  -1.880   2.667  1.00 11.42           H   new
ATOM    981  N   GLN A  62     -11.325   0.599   2.462  1.00 13.97           N
ATOM    982  CA  GLN A  62     -12.355   1.476   1.997  1.00 15.52           C
ATOM    983  C   GLN A  62     -11.830   2.732   1.391  1.00 13.94           C
ATOM    984  O   GLN A  62     -10.633   3.017   1.404  1.00 12.15           O
ATOM    985  CB  GLN A  62     -13.170   1.842   3.249  1.00 19.53           C
ATOM    986  CG  GLN A  62     -14.154   0.760   3.701  1.00 26.38           C
ATOM    987  CD  GLN A  62     -14.693   1.162   5.066  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -15.630   1.956   5.136  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -14.179   0.660   6.221  1.00 32.71           N
ATOM      0  H   GLN A  62     -10.926   0.952   3.332  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -12.932   0.978   1.218  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -12.481   2.054   4.067  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -13.724   2.760   3.052  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -14.968   0.660   2.983  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -13.657  -0.209   3.757  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -13.402   0.000   6.189  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -14.571   0.943   7.119  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -12.715   3.680   1.035  1.00 11.73           N
ATOM    999  CA  LYS A  63     -12.494   5.002   0.535  1.00 11.97           C
ATOM   1000  C   LYS A  63     -11.888   5.852   1.599  1.00 10.41           C
ATOM   1001  O   LYS A  63     -12.250   5.829   2.774  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -13.672   5.712  -0.152  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -14.802   6.212   0.749  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -15.829   7.092   0.033  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -15.310   8.492  -0.299  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -15.382   9.420   0.851  1.00 25.97           N
ATOM      0  H   LYS A  63     -13.714   3.490   1.109  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -11.802   4.857  -0.295  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -13.278   6.564  -0.705  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -14.100   5.027  -0.884  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -15.314   5.353   1.182  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -14.370   6.775   1.576  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -16.137   6.600  -0.889  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -16.717   7.182   0.658  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -14.276   8.420  -0.637  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -15.889   8.902  -1.127  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -14.579  10.079   0.816  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -16.272   9.956   0.809  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -15.346   8.878   1.738  1.00 25.97           H   new
ATOM   1020  N   GLU A  64     -10.885   6.667   1.228  1.00 10.04           N
ATOM   1021  CA  GLU A  64     -10.134   7.591   2.020  1.00 10.94           C
ATOM   1022  C   GLU A  64      -9.572   6.932   3.233  1.00  9.74           C
ATOM   1023  O   GLU A  64      -9.303   7.598   4.232  1.00  9.42           O
ATOM   1024  CB  GLU A  64     -10.908   8.900   2.250  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -11.223   9.565   0.909  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -12.075  10.793   1.194  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -11.603  11.606   2.033  1.00 32.61           O
ATOM   1028  OE2 GLU A  64     -13.082  11.067   0.488  1.00 31.72           O
ATOM      0  H   GLU A  64     -10.566   6.677   0.259  1.00 10.04           H   new
ATOM      0  HA  GLU A  64      -9.252   7.912   1.466  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64     -11.833   8.695   2.790  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64     -10.320   9.576   2.871  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64     -10.304   9.847   0.396  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -11.754   8.874   0.254  1.00 24.16           H   new
ATOM   1035  N   SER A  65      -9.205   5.642   3.131  1.00  6.85           N
ATOM   1036  CA  SER A  65      -8.366   4.939   4.051  1.00  6.90           C
ATOM   1037  C   SER A  65      -6.941   5.326   3.855  1.00  4.72           C
ATOM   1038  O   SER A  65      -6.700   5.823   2.756  1.00  3.91           O
ATOM   1039  CB  SER A  65      -8.491   3.406   4.017  1.00  7.28           C
ATOM   1040  OG  SER A  65      -8.013   2.704   5.155  1.00 10.56           O
ATOM      0  H   SER A  65      -9.514   5.054   2.357  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -8.723   5.242   5.036  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -9.542   3.153   3.877  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -7.956   3.040   3.141  1.00  7.28           H   new
ATOM      0  HG  SER A  65      -8.144   1.742   5.024  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -6.227   5.216   4.989  1.00  4.48           N
ATOM   1047  CA  THR A  66      -4.835   5.496   5.157  1.00  3.80           C
ATOM   1048  C   THR A  66      -4.080   4.231   5.382  1.00  4.60           C
ATOM   1049  O   THR A  66      -4.219   3.564   6.406  1.00  5.33           O
ATOM   1050  CB  THR A  66      -4.440   6.484   6.214  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -5.068   7.724   5.924  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -2.915   6.679   6.177  1.00  3.40           C
ATOM      0  H   THR A  66      -6.660   4.906   5.859  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -4.576   5.987   4.219  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -4.742   6.124   7.198  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -4.822   8.383   6.607  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -2.621   7.396   6.943  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -2.422   5.725   6.364  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -2.620   7.054   5.197  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -3.269   3.971   4.341  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -2.289   2.930   4.372  1.00  3.85           C
ATOM   1062  C   LEU A  67      -0.993   3.577   4.719  1.00  3.80           C
ATOM   1063  O   LEU A  67      -0.795   4.776   4.531  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -2.126   2.151   3.056  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -3.392   1.719   2.296  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -3.100   0.894   1.031  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -4.279   0.921   3.266  1.00  8.12           C
ATOM      0  H   LEU A  67      -3.294   4.491   3.464  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -2.618   2.189   5.100  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -1.527   2.762   2.381  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -1.547   1.253   3.272  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -3.898   2.618   1.945  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -4.039   0.625   0.547  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -2.494   1.484   0.344  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -2.560  -0.012   1.304  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -5.185   0.602   2.751  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -3.735   0.045   3.620  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -4.546   1.550   4.116  1.00  8.12           H   new
ATOM   1079  N   HIS A  68      -0.057   2.752   5.222  1.00  2.94           N
ATOM   1080  CA  HIS A  68       1.140   3.276   5.805  1.00  4.17           C
ATOM   1081  C   HIS A  68       2.281   2.636   5.092  1.00  5.32           C
ATOM   1082  O   HIS A  68       2.295   1.406   5.092  1.00  7.70           O
ATOM   1083  CB  HIS A  68       1.212   3.041   7.323  1.00  5.57           C
ATOM   1084  CG  HIS A  68       0.341   4.047   8.015  1.00  9.95           C
ATOM   1085  ND1 HIS A  68      -0.808   3.632   8.656  1.00 13.74           N
ATOM   1086  CD2 HIS A  68       0.490   5.342   8.401  1.00 12.79           C
ATOM   1087  CE1 HIS A  68      -1.256   4.688   9.387  1.00 14.75           C
ATOM   1088  NE2 HIS A  68      -0.492   5.759   9.276  1.00 16.30           N
ATOM      0  H   HIS A  68      -0.126   1.734   5.226  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       1.167   4.360   5.689  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68       0.883   2.030   7.563  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       2.241   3.132   7.670  1.00  5.57           H   new
ATOM      0  HD2 HIS A  68       1.293   5.978   8.059  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68      -2.147   4.654   9.997  1.00 14.75           H   new
ATOM      0  HE2 HIS A  68      -0.601   6.668   9.725  1.00 16.30           H   new
ATOM   1096  N   LEU A  69       3.233   3.361   4.478  1.00  5.29           N
ATOM   1097  CA  LEU A  69       4.233   2.748   3.661  1.00  3.97           C
ATOM   1098  C   LEU A  69       5.561   2.886   4.321  1.00  5.07           C
ATOM   1099  O   LEU A  69       6.050   4.001   4.497  1.00  4.34           O
ATOM   1100  CB  LEU A  69       4.255   3.420   2.277  1.00  6.08           C
ATOM   1101  CG  LEU A  69       5.348   3.124   1.236  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       5.423   1.651   0.803  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       5.159   4.045   0.019  1.00  6.87           C
ATOM      0  H   LEU A  69       3.310   4.376   4.548  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       4.005   1.690   3.534  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       3.301   3.190   1.803  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       4.273   4.496   2.452  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       6.304   3.327   1.719  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       6.219   1.528   0.068  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       5.632   1.027   1.672  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       4.472   1.353   0.362  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       5.933   3.836  -0.719  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       4.179   3.867  -0.423  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       5.231   5.086   0.336  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       6.257   1.754   4.529  1.00  4.29           N
ATOM   1116  CA  VAL A  70       7.624   1.756   4.950  1.00  6.26           C
ATOM   1117  C   VAL A  70       8.424   0.915   4.015  1.00  9.22           C
ATOM   1118  O   VAL A  70       7.986  -0.062   3.411  1.00  9.36           O
ATOM   1119  CB  VAL A  70       7.758   1.524   6.426  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       7.273   2.646   7.358  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       7.023   0.222   6.787  1.00  8.54           C
ATOM      0  H   VAL A  70       5.864   0.821   4.403  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       8.076   2.744   4.865  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       8.833   1.478   6.600  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       7.427   2.349   8.395  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70       7.835   3.557   7.154  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70       6.212   2.828   7.187  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       7.111   0.039   7.858  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       5.970   0.313   6.520  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       7.466  -0.610   6.239  1.00  8.54           H   new
ATOM   1131  N   LEU A  71       9.704   1.314   3.913  1.00 12.71           N
ATOM   1132  CA  LEU A  71      10.517   0.789   2.860  1.00 16.06           C
ATOM   1133  C   LEU A  71      11.565  -0.120   3.402  1.00 18.09           C
ATOM   1134  O   LEU A  71      11.778  -0.187   4.612  1.00 19.26           O
ATOM   1135  CB  LEU A  71      11.228   1.901   2.072  1.00 17.10           C
ATOM   1136  CG  LEU A  71      10.347   2.979   1.418  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      11.283   3.840   0.552  1.00 19.57           C
ATOM   1138  CD2 LEU A  71       9.126   2.415   0.672  1.00 17.51           C
ATOM      0  H   LEU A  71      10.165   1.977   4.536  1.00 12.71           H   new
ATOM      0  HA  LEU A  71       9.843   0.247   2.197  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      11.925   2.399   2.746  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      11.823   1.431   1.289  1.00 17.10           H   new
ATOM      0  HG  LEU A  71       9.874   3.600   2.179  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71      10.706   4.625   0.062  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      12.049   4.292   1.183  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      11.758   3.214  -0.203  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71       8.554   3.235   0.238  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71       9.461   1.747  -0.121  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71       8.496   1.863   1.370  1.00 17.51           H   new