USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=18
USER  MOD reduce.3.24.130724 removed 586 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A   7 THR OG1 :   rot   97:sc=   0.933
USER  MOD Set 1.2: A   9 THR OG1 :   rot  180:sc=   0.535
USER  MOD Single : A   1 MET CE  :methyl  179:sc=       0   (180deg=-0.00324)
USER  MOD Single : A   1 MET N   :NH3+   -167:sc=     2.2   (180deg=2.16)
USER  MOD Single : A   2 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A   6 LYS NZ  :NH3+   -168:sc=       0   (180deg=-0.113)
USER  MOD Single : A  11 LYS NZ  :NH3+   -155:sc=    1.22   (180deg=0.879)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot  -94:sc=   0.785
USER  MOD Single : A  20 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  22 THR OG1 :   rot  180:sc= -0.0912
USER  MOD Single : A  25 ASN     :      amide:sc=       0  X(o=0,f=-0.013)
USER  MOD Single : A  27 LYS NZ  :NH3+   -112:sc=    1.02   (180deg=-0.586!)
USER  MOD Single : A  29 LYS NZ  :NH3+   -170:sc=    1.21   (180deg=1.13)
USER  MOD Single : A  31 GLN     :      amide:sc= -0.0259  K(o=-0.026,f=-1.3!)
USER  MOD Single : A  33 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  40 GLN     :      amide:sc=       0  K(o=0,f=-0.79)
USER  MOD Single : A  41 GLN     :      amide:sc=   0.718  K(o=0.72,f=-4.3!)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=  -0.119  X(o=-0.12,f=0)
USER  MOD Single : A  55 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  57 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  59 TYR OH  :   rot  -46:sc=  0.0719
USER  MOD Single : A  60 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  62 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  63 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  65 SER OG  :   rot   74:sc=    1.27
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HE2:sc=   0.751  K(o=0.75,f=-3.1!)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -11.861   4.399  -2.287  1.00  9.67           N
ATOM      2  CA  MET A   1     -11.599   4.944  -0.936  1.00 10.38           C
ATOM      3  C   MET A   1     -10.210   5.451  -0.752  1.00  9.62           C
ATOM      4  O   MET A   1      -9.304   5.163  -1.533  1.00  9.62           O
ATOM      5  CB  MET A   1     -11.974   4.018   0.233  1.00 13.77           C
ATOM      6  CG  MET A   1     -10.886   2.990   0.551  1.00 16.29           C
ATOM      7  SD  MET A   1     -11.517   1.782   1.755  1.00 17.17           S
ATOM      8  CE  MET A   1     -10.026   0.758   1.587  1.00 16.11           C
ATOM      0  H1  MET A   1     -12.885   4.271  -2.417  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -11.501   5.061  -3.004  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -11.381   3.482  -2.390  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -12.285   5.790  -0.897  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -12.167   4.621   1.120  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -12.901   3.497  -0.006  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -10.576   2.481  -0.361  1.00 16.29           H   new
ATOM      0  HG3 MET A   1     -10.005   3.491   0.952  1.00 16.29           H   new
ATOM      0  HE1 MET A   1     -10.100  -0.104   2.250  1.00 16.11           H   new
ATOM      0  HE2 MET A   1      -9.934   0.416   0.556  1.00 16.11           H   new
ATOM      0  HE3 MET A   1      -9.148   1.347   1.854  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -10.033   6.360   0.223  1.00  9.27           N
ATOM     21  CA  GLN A   2      -8.747   6.936   0.469  1.00  9.07           C
ATOM     22  C   GLN A   2      -7.932   6.184   1.463  1.00  8.72           C
ATOM     23  O   GLN A   2      -8.371   5.797   2.545  1.00  8.22           O
ATOM     24  CB  GLN A   2      -8.796   8.336   1.104  1.00 14.46           C
ATOM     25  CG  GLN A   2      -9.714   9.326   0.385  1.00 17.01           C
ATOM     26  CD  GLN A   2      -9.620  10.747   0.921  1.00 20.10           C
ATOM     27  OE1 GLN A   2     -10.242  11.075   1.930  1.00 21.89           O
ATOM     28  NE2 GLN A   2      -8.834  11.627   0.245  1.00 19.49           N
ATOM      0  H   GLN A   2     -10.775   6.695   0.838  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -8.323   6.933  -0.535  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2      -9.125   8.241   2.139  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2      -7.787   8.746   1.127  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2      -9.468   9.331  -0.677  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2     -10.744   8.982   0.472  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2      -8.330  11.325  -0.589  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2      -8.748  12.589   0.572  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -6.724   5.684   1.149  1.00  5.87           N
ATOM     38  CA  ILE A   3      -5.832   5.177   2.145  1.00  5.07           C
ATOM     39  C   ILE A   3      -4.538   5.909   2.043  1.00  4.01           C
ATOM     40  O   ILE A   3      -4.195   6.369   0.954  1.00  4.61           O
ATOM     41  CB  ILE A   3      -5.531   3.708   2.138  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -4.722   3.128   0.966  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -6.805   2.915   2.476  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -4.088   1.744   1.104  1.00 10.83           C
ATOM      0  H   ILE A   3      -6.362   5.631   0.197  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -6.372   5.339   3.078  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -4.792   3.580   2.929  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -5.379   3.102   0.097  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -3.922   3.833   0.740  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -6.582   1.848   2.470  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -7.163   3.205   3.464  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -7.574   3.129   1.734  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -3.557   1.494   0.186  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -3.388   1.746   1.939  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -4.867   1.003   1.286  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -3.771   6.053   3.138  1.00  4.55           N
ATOM     57  CA  PHE A   4      -2.525   6.754   3.109  1.00  4.68           C
ATOM     58  C   PHE A   4      -1.382   5.847   3.415  1.00  5.30           C
ATOM     59  O   PHE A   4      -1.426   5.095   4.387  1.00  5.58           O
ATOM     60  CB  PHE A   4      -2.447   7.826   4.210  1.00  4.83           C
ATOM     61  CG  PHE A   4      -3.675   8.667   4.271  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -4.022   9.523   3.252  1.00  8.34           C
ATOM     63  CD2 PHE A   4      -4.501   8.541   5.363  1.00  6.69           C
ATOM     64  CE1 PHE A   4      -5.180  10.255   3.363  1.00 10.61           C
ATOM     65  CE2 PHE A   4      -5.576   9.381   5.533  1.00  9.10           C
ATOM     66  CZ  PHE A   4      -5.989  10.150   4.470  1.00  8.90           C
ATOM      0  H   PHE A   4      -4.018   5.679   4.054  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -2.468   7.181   2.108  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -2.293   7.342   5.174  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -1.581   8.464   4.032  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -3.394   9.619   2.378  1.00  8.34           H   new
ATOM      0  HD2 PHE A   4      -4.303   7.773   6.096  1.00  6.69           H   new
ATOM      0  HE1 PHE A   4      -5.460  10.926   2.565  1.00 10.61           H   new
ATOM      0  HE2 PHE A   4      -6.086   9.436   6.483  1.00  9.10           H   new
ATOM      0  HZ  PHE A   4      -6.938  10.665   4.504  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -0.304   6.015   2.628  1.00  4.44           N
ATOM     77  CA  VAL A   5       1.025   5.505   2.764  1.00  3.87           C
ATOM     78  C   VAL A   5       1.944   6.628   3.103  1.00  4.93           C
ATOM     79  O   VAL A   5       1.929   7.705   2.509  1.00  6.84           O
ATOM     80  CB  VAL A   5       1.497   4.930   1.462  1.00  2.99           C
ATOM     81  CG1 VAL A   5       2.767   4.085   1.658  1.00  5.28           C
ATOM     82  CG2 VAL A   5       0.480   4.110   0.649  1.00  9.13           C
ATOM      0  H   VAL A   5      -0.380   6.585   1.786  1.00  4.44           H   new
ATOM      0  HA  VAL A   5       1.023   4.739   3.540  1.00  3.87           H   new
ATOM      0  HB  VAL A   5       1.688   5.822   0.866  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       3.087   3.681   0.698  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       3.559   4.709   2.071  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       2.556   3.265   2.345  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5       0.950   3.753  -0.268  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5       0.144   3.258   1.240  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -0.376   4.737   0.398  1.00  9.13           H   new
ATOM     92  N   LYS A   6       2.717   6.332   4.163  1.00  6.04           N
ATOM     93  CA  LYS A   6       3.609   7.224   4.837  1.00  6.12           C
ATOM     94  C   LYS A   6       4.963   6.604   4.795  1.00  6.57           C
ATOM     95  O   LYS A   6       5.090   5.426   5.123  1.00  5.76           O
ATOM     96  CB  LYS A   6       3.124   7.402   6.285  1.00  7.45           C
ATOM     97  CG  LYS A   6       4.029   8.140   7.274  1.00 11.12           C
ATOM     98  CD  LYS A   6       3.265   8.329   8.586  1.00 14.54           C
ATOM     99  CE  LYS A   6       4.135   9.038   9.626  1.00 18.84           C
ATOM    100  NZ  LYS A   6       5.232   8.156  10.081  1.00 20.55           N
ATOM      0  H   LYS A   6       2.718   5.401   4.579  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       3.641   8.207   4.367  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6       2.170   7.929   6.252  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6       2.927   6.410   6.693  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6       4.943   7.572   7.447  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6       4.326   9.106   6.867  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6       2.361   8.910   8.405  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6       2.949   7.359   8.970  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6       4.550   9.951   9.199  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6       3.523   9.334  10.478  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6       5.684   8.569  10.922  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6       4.848   7.219  10.319  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6       5.937   8.059   9.322  1.00 20.55           H   new
ATOM    114  N   THR A   7       6.038   7.368   4.528  1.00  7.41           N
ATOM    115  CA  THR A   7       7.319   6.788   4.272  1.00  7.48           C
ATOM    116  C   THR A   7       8.189   6.868   5.479  1.00  8.75           C
ATOM    117  O   THR A   7       7.818   7.436   6.505  1.00  8.58           O
ATOM    118  CB  THR A   7       8.025   7.161   3.002  1.00  9.61           C
ATOM    119  OG1 THR A   7       8.398   8.530   2.942  1.00 11.78           O
ATOM    120  CG2 THR A   7       7.008   7.073   1.852  1.00  9.17           C
ATOM      0  H   THR A   7       6.019   8.387   4.490  1.00  7.41           H   new
ATOM      0  HA  THR A   7       7.086   5.744   4.062  1.00  7.48           H   new
ATOM      0  HB  THR A   7       8.893   6.504   2.946  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       9.336   8.625   3.209  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       7.495   7.340   0.914  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       6.623   6.056   1.784  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       6.184   7.761   2.041  1.00  9.17           H   new
ATOM    128  N   LEU A   8       9.479   6.496   5.398  1.00  9.84           N
ATOM    129  CA  LEU A   8      10.486   6.538   6.413  1.00 14.15           C
ATOM    130  C   LEU A   8      10.956   7.927   6.675  1.00 17.37           C
ATOM    131  O   LEU A   8      11.133   8.357   7.814  1.00 17.01           O
ATOM    132  CB  LEU A   8      11.586   5.502   6.127  1.00 16.63           C
ATOM    133  CG  LEU A   8      11.227   4.008   6.073  1.00 18.88           C
ATOM    134  CD1 LEU A   8      12.522   3.184   5.977  1.00 18.59           C
ATOM    135  CD2 LEU A   8      10.507   3.485   7.328  1.00 19.31           C
ATOM      0  H   LEU A   8       9.854   6.126   4.525  1.00  9.84           H   new
ATOM      0  HA  LEU A   8      10.053   6.234   7.366  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8      12.039   5.763   5.171  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8      12.356   5.625   6.889  1.00 16.63           H   new
ATOM      0  HG  LEU A   8      10.565   3.903   5.214  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8      12.276   2.123   5.938  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8      13.065   3.464   5.074  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8      13.144   3.381   6.850  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8      10.290   2.424   7.207  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8      11.145   3.628   8.200  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8       9.575   4.032   7.467  1.00 19.31           H   new
ATOM    147  N   THR A   9      11.142   8.729   5.612  1.00 18.33           N
ATOM    148  CA  THR A   9      11.304  10.148   5.677  1.00 19.24           C
ATOM    149  C   THR A   9      10.042  10.735   6.209  1.00 19.48           C
ATOM    150  O   THR A   9      10.100  11.430   7.222  1.00 23.14           O
ATOM    151  CB  THR A   9      11.445  10.818   4.343  1.00 18.97           C
ATOM    152  OG1 THR A   9      10.705  10.059   3.398  1.00 20.24           O
ATOM    153  CG2 THR A   9      12.940  10.923   3.996  1.00 19.70           C
ATOM      0  H   THR A   9      11.181   8.369   4.658  1.00 18.33           H   new
ATOM      0  HA  THR A   9      12.201  10.305   6.276  1.00 19.24           H   new
ATOM      0  HB  THR A   9      11.048  11.833   4.345  1.00 18.97           H   new
ATOM      0  HG1 THR A   9      10.778  10.476   2.514  1.00 20.24           H   new
ATOM      0 HG21 THR A   9      13.055  11.409   3.027  1.00 19.70           H   new
ATOM      0 HG22 THR A   9      13.450  11.510   4.760  1.00 19.70           H   new
ATOM      0 HG23 THR A   9      13.375   9.924   3.955  1.00 19.70           H   new
ATOM    161  N   GLY A  10       8.908  10.475   5.534  1.00 19.43           N
ATOM    162  CA  GLY A  10       7.686  10.990   6.068  1.00 18.74           C
ATOM    163  C   GLY A  10       6.632  11.306   5.064  1.00 17.62           C
ATOM    164  O   GLY A  10       5.636  11.916   5.449  1.00 19.74           O
ATOM      0  H   GLY A  10       8.834   9.940   4.669  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       7.284  10.264   6.775  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       7.909  11.895   6.632  1.00 18.74           H   new
ATOM    168  N   LYS A  11       6.756  10.999   3.760  1.00 13.56           N
ATOM    169  CA  LYS A  11       5.951  11.622   2.755  1.00 11.91           C
ATOM    170  C   LYS A  11       4.579  11.039   2.742  1.00 10.18           C
ATOM    171  O   LYS A  11       4.381   9.878   3.099  1.00  9.10           O
ATOM    172  CB  LYS A  11       6.650  11.492   1.392  1.00 13.43           C
ATOM    173  CG  LYS A  11       6.289  12.599   0.399  1.00 16.69           C
ATOM    174  CD  LYS A  11       6.544  12.058  -1.009  1.00 17.92           C
ATOM    175  CE  LYS A  11       6.364  13.112  -2.104  1.00 20.81           C
ATOM    176  NZ  LYS A  11       6.657  12.496  -3.417  1.00 21.93           N
ATOM      0  H   LYS A  11       7.420  10.313   3.400  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       5.838  12.683   2.979  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       7.729  11.495   1.547  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       6.393  10.527   0.954  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       5.245  12.891   0.514  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       6.891  13.489   0.582  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       7.558  11.661  -1.060  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       5.866  11.226  -1.200  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       5.346  13.501  -2.089  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       7.030  13.957  -1.927  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       6.953  13.233  -4.088  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       7.421  11.798  -3.310  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       5.803  12.023  -3.777  1.00 21.93           H   new
ATOM    190  N   THR A  12       3.501  11.760   2.386  1.00  9.63           N
ATOM    191  CA  THR A  12       2.165  11.257   2.473  1.00  9.85           C
ATOM    192  C   THR A  12       1.676  11.150   1.070  1.00 11.66           C
ATOM    193  O   THR A  12       1.333  12.084   0.347  1.00 12.33           O
ATOM    194  CB  THR A  12       1.220  11.979   3.389  1.00 10.85           C
ATOM    195  OG1 THR A  12       1.665  12.010   4.737  1.00 10.91           O
ATOM    196  CG2 THR A  12      -0.053  11.119   3.453  1.00  9.63           C
ATOM      0  H   THR A  12       3.559  12.714   2.030  1.00  9.63           H   new
ATOM      0  HA  THR A  12       2.195  10.289   2.973  1.00  9.85           H   new
ATOM      0  HB  THR A  12       1.105  12.994   3.009  1.00 10.85           H   new
ATOM      0  HG1 THR A  12       1.013  12.493   5.286  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -0.782  11.596   4.108  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -0.475  11.019   2.453  1.00  9.63           H   new
ATOM      0 HG23 THR A  12       0.194  10.132   3.843  1.00  9.63           H   new
ATOM    204  N   ILE A  13       1.536   9.864   0.700  1.00 10.42           N
ATOM    205  CA  ILE A  13       0.888   9.422  -0.495  1.00 11.84           C
ATOM    206  C   ILE A  13      -0.479   8.890  -0.233  1.00 10.55           C
ATOM    207  O   ILE A  13      -0.570   7.930   0.531  1.00 11.92           O
ATOM    208  CB  ILE A  13       1.762   8.430  -1.204  1.00 14.86           C
ATOM    209  CG1 ILE A  13       3.228   8.859  -1.389  1.00 14.87           C
ATOM    210  CG2 ILE A  13       1.205   8.149  -2.609  1.00 17.08           C
ATOM    211  CD1 ILE A  13       4.254   8.006  -0.644  1.00 16.46           C
ATOM      0  H   ILE A  13       1.894   9.093   1.264  1.00 10.42           H   new
ATOM      0  HA  ILE A  13       0.744  10.282  -1.149  1.00 11.84           H   new
ATOM      0  HB  ILE A  13       1.753   7.555  -0.555  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       3.465   8.837  -2.453  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13       3.332   9.893  -1.060  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       1.845   7.428  -3.117  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13       0.197   7.744  -2.526  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13       1.177   9.076  -3.182  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       5.256   8.389  -0.839  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       4.052   8.046   0.426  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       4.187   6.974  -0.988  1.00 16.46           H   new
ATOM    223  N   THR A  14      -1.467   9.518  -0.895  1.00  9.39           N
ATOM    224  CA  THR A  14      -2.857   9.246  -0.702  1.00  9.63           C
ATOM    225  C   THR A  14      -3.303   8.431  -1.867  1.00 11.20           C
ATOM    226  O   THR A  14      -3.147   8.871  -3.005  1.00 11.63           O
ATOM    227  CB  THR A  14      -3.734  10.447  -0.502  1.00 10.38           C
ATOM    228  OG1 THR A  14      -3.420  11.142   0.696  1.00 16.30           O
ATOM    229  CG2 THR A  14      -5.239  10.132  -0.485  1.00 11.66           C
ATOM      0  H   THR A  14      -1.291  10.243  -1.591  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -2.964   8.711   0.242  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -3.525  11.069  -1.372  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -4.000  10.825   1.420  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -5.802  11.053  -0.336  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -5.527   9.680  -1.434  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -5.456   9.439   0.327  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -3.696   7.158  -1.683  1.00  8.29           N
ATOM    238  CA  LEU A  15      -4.150   6.392  -2.802  1.00  9.03           C
ATOM    239  C   LEU A  15      -5.633   6.243  -2.821  1.00  8.59           C
ATOM    240  O   LEU A  15      -6.254   6.121  -1.766  1.00  7.79           O
ATOM    241  CB  LEU A  15      -3.348   5.080  -2.838  1.00 11.08           C
ATOM    242  CG  LEU A  15      -1.826   5.228  -3.002  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -1.000   3.981  -2.646  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -1.426   5.581  -4.445  1.00 15.88           C
ATOM      0  H   LEU A  15      -3.701   6.670  -0.787  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -3.954   6.915  -3.738  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -3.543   4.532  -1.916  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -3.725   4.469  -3.658  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -1.599   6.026  -2.295  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15       0.059   4.191  -2.796  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -1.173   3.715  -1.603  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -1.300   3.151  -3.286  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15      -0.342   5.675  -4.509  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -1.763   4.793  -5.119  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -1.889   6.525  -4.730  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -6.268   6.293  -4.005  1.00 11.04           N
ATOM    257  CA  GLU A  16      -7.610   5.873  -4.267  1.00 11.50           C
ATOM    258  C   GLU A  16      -7.589   4.404  -4.516  1.00 10.13           C
ATOM    259  O   GLU A  16      -7.315   3.950  -5.626  1.00  9.83           O
ATOM    260  CB  GLU A  16      -8.158   6.631  -5.488  1.00 17.22           C
ATOM    261  CG  GLU A  16      -9.523   6.184  -6.016  1.00 23.33           C
ATOM    262  CD  GLU A  16     -10.575   6.269  -4.920  1.00 26.99           C
ATOM    263  OE1 GLU A  16     -10.686   7.306  -4.212  1.00 28.90           O
ATOM    264  OE2 GLU A  16     -11.374   5.312  -4.733  1.00 28.86           O
ATOM      0  H   GLU A  16      -5.808   6.654  -4.841  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -8.260   6.090  -3.419  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -8.221   7.689  -5.232  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -7.434   6.542  -6.298  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16      -9.816   6.811  -6.858  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16      -9.458   5.161  -6.387  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -7.967   3.614  -3.495  1.00  8.99           N
ATOM    272  CA  VAL A  17      -7.987   2.196  -3.677  1.00  8.85           C
ATOM    273  C   VAL A  17      -9.374   1.712  -3.428  1.00  8.04           C
ATOM    274  O   VAL A  17     -10.144   2.294  -2.665  1.00  8.99           O
ATOM    275  CB  VAL A  17      -7.120   1.522  -2.655  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -5.668   2.003  -2.815  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -7.586   1.776  -1.211  1.00 10.54           C
ATOM      0  H   VAL A  17      -8.250   3.943  -2.572  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -7.637   1.971  -4.685  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -7.193   0.449  -2.832  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -5.038   1.513  -2.072  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -5.310   1.755  -3.814  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -5.625   3.083  -2.672  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -6.919   1.263  -0.518  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -7.568   2.846  -1.006  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -8.601   1.399  -1.085  1.00 10.54           H   new
ATOM    287  N   GLU A  18      -9.737   0.600  -4.092  1.00  7.29           N
ATOM    288  CA  GLU A  18     -10.986   0.008  -3.728  1.00  7.08           C
ATOM    289  C   GLU A  18     -10.684  -0.990  -2.663  1.00  6.45           C
ATOM    290  O   GLU A  18      -9.512  -1.297  -2.454  1.00  5.28           O
ATOM    291  CB  GLU A  18     -11.593  -0.675  -4.965  1.00 10.28           C
ATOM    292  CG  GLU A  18     -11.807   0.267  -6.151  1.00 12.65           C
ATOM    293  CD  GLU A  18     -12.679  -0.202  -7.308  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -12.193  -1.012  -8.141  1.00 14.33           O
ATOM    295  OE2 GLU A  18     -13.877   0.182  -7.370  1.00 18.17           O
ATOM      0  H   GLU A  18      -9.208   0.136  -4.831  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -11.703   0.744  -3.365  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18     -10.940  -1.491  -5.275  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -12.549  -1.120  -4.690  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -12.238   1.191  -5.766  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -10.826   0.517  -6.556  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -11.656  -1.451  -1.933  1.00  7.24           N
ATOM    303  CA  PRO A  19     -11.441  -2.375  -0.857  1.00  7.07           C
ATOM    304  C   PRO A  19     -11.353  -3.754  -1.416  1.00  6.65           C
ATOM    305  O   PRO A  19     -10.943  -4.662  -0.695  1.00  6.37           O
ATOM    306  CB  PRO A  19     -12.610  -2.248   0.116  1.00  7.61           C
ATOM    307  CG  PRO A  19     -13.721  -1.622  -0.743  1.00  8.16           C
ATOM    308  CD  PRO A  19     -12.961  -0.821  -1.812  1.00  7.49           C
ATOM      0  HA  PRO A  19     -10.512  -2.161  -0.328  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -12.908  -3.218   0.515  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -12.357  -1.617   0.968  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.355  -2.386  -1.193  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -14.370  -0.978  -0.149  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -13.492  -0.838  -2.764  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -12.864   0.225  -1.520  1.00  7.49           H   new
ATOM    316  N   SER A  20     -11.652  -3.877  -2.722  1.00  6.80           N
ATOM    317  CA  SER A  20     -11.445  -5.099  -3.434  1.00  6.28           C
ATOM    318  C   SER A  20     -10.085  -5.288  -4.012  1.00  8.45           C
ATOM    319  O   SER A  20      -9.751  -6.274  -4.667  1.00  7.26           O
ATOM    320  CB  SER A  20     -12.389  -5.201  -4.644  1.00  8.57           C
ATOM    321  OG  SER A  20     -13.642  -5.716  -4.219  1.00 11.13           O
ATOM      0  H   SER A  20     -12.040  -3.123  -3.288  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -11.620  -5.851  -2.665  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -12.522  -4.220  -5.100  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -11.955  -5.850  -5.405  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -14.247  -5.781  -4.987  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -9.231  -4.256  -3.886  1.00  7.50           N
ATOM    328  CA  ASP A  21      -7.976  -4.123  -4.559  1.00  7.70           C
ATOM    329  C   ASP A  21      -6.970  -4.894  -3.776  1.00  7.08           C
ATOM    330  O   ASP A  21      -6.956  -4.916  -2.547  1.00  8.11           O
ATOM    331  CB  ASP A  21      -7.484  -2.673  -4.708  1.00 11.00           C
ATOM    332  CG  ASP A  21      -8.056  -1.863  -5.862  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -8.553  -2.462  -6.854  1.00 14.36           O
ATOM    334  OD2 ASP A  21      -7.912  -0.612  -5.816  1.00 18.03           O
ATOM      0  H   ASP A  21      -9.431  -3.464  -3.275  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -8.109  -4.498  -5.574  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -7.705  -2.144  -3.781  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -6.399  -2.693  -4.813  1.00 11.00           H   new
ATOM    339  N   THR A  22      -6.102  -5.632  -4.492  1.00  5.37           N
ATOM    340  CA  THR A  22      -5.014  -6.318  -3.867  1.00  6.01           C
ATOM    341  C   THR A  22      -3.920  -5.396  -3.451  1.00  8.01           C
ATOM    342  O   THR A  22      -3.734  -4.249  -3.854  1.00  8.11           O
ATOM    343  CB  THR A  22      -4.502  -7.373  -4.803  1.00  8.92           C
ATOM    344  OG1 THR A  22      -4.244  -7.071  -6.166  1.00 10.22           O
ATOM    345  CG2 THR A  22      -5.380  -8.635  -4.855  1.00  9.65           C
ATOM      0  H   THR A  22      -6.154  -5.753  -5.503  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -5.382  -6.781  -2.952  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -3.536  -7.499  -4.314  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -3.916  -7.874  -6.623  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -4.946  -9.352  -5.552  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -5.434  -9.082  -3.862  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -6.383  -8.367  -5.187  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -3.090  -5.820  -2.482  1.00  8.32           N
ATOM    354  CA  ILE A  23      -1.921  -5.181  -1.960  1.00  9.92           C
ATOM    355  C   ILE A  23      -0.831  -5.178  -2.975  1.00 10.01           C
ATOM    356  O   ILE A  23      -0.079  -4.214  -3.110  1.00  8.71           O
ATOM    357  CB  ILE A  23      -1.471  -5.895  -0.720  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -2.689  -5.779   0.213  1.00 11.38           C
ATOM    359  CG2 ILE A  23      -0.250  -5.159  -0.144  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -2.587  -6.360   1.622  1.00 12.30           C
ATOM      0  H   ILE A  23      -3.259  -6.710  -2.014  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -2.162  -4.147  -1.713  1.00  9.92           H   new
ATOM      0  HB  ILE A  23      -1.172  -6.932  -0.875  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -2.934  -4.721   0.308  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -3.533  -6.259  -0.283  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23       0.089  -5.667   0.759  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       0.553  -5.155  -0.881  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23      -0.525  -4.133   0.099  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -3.526  -6.198   2.151  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -2.385  -7.429   1.561  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -1.777  -5.868   2.161  1.00 12.30           H   new
ATOM    372  N   GLU A  24      -0.938  -6.104  -3.945  1.00  9.54           N
ATOM    373  CA  GLU A  24      -0.264  -6.091  -5.206  1.00 11.81           C
ATOM    374  C   GLU A  24      -0.553  -4.913  -6.071  1.00 11.14           C
ATOM    375  O   GLU A  24       0.298  -4.180  -6.573  1.00 10.62           O
ATOM    376  CB  GLU A  24      -0.481  -7.437  -5.918  1.00 19.24           C
ATOM    377  CG  GLU A  24       0.382  -7.642  -7.164  1.00 27.76           C
ATOM    378  CD  GLU A  24       0.152  -8.891  -8.002  1.00 32.92           C
ATOM    379  OE1 GLU A  24      -0.803  -8.756  -8.812  1.00 34.80           O
ATOM    380  OE2 GLU A  24       0.870  -9.916  -7.853  1.00 36.51           O
ATOM      0  H   GLU A  24      -1.540  -6.921  -3.839  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       0.798  -5.968  -4.993  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24      -0.277  -8.243  -5.214  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24      -1.530  -7.519  -6.201  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       0.242  -6.776  -7.812  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       1.426  -7.640  -6.850  1.00 27.76           H   new
ATOM    387  N   ASN A  25      -1.849  -4.591  -6.226  1.00  9.43           N
ATOM    388  CA  ASN A  25      -2.431  -3.455  -6.872  1.00 10.96           C
ATOM    389  C   ASN A  25      -2.053  -2.142  -6.276  1.00  9.68           C
ATOM    390  O   ASN A  25      -1.755  -1.196  -7.002  1.00  9.33           O
ATOM    391  CB  ASN A  25      -3.957  -3.649  -6.853  1.00 16.78           C
ATOM    392  CG  ASN A  25      -4.530  -2.920  -8.060  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -4.653  -1.697  -8.077  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -4.953  -3.662  -9.119  1.00 24.70           N
ATOM      0  H   ASN A  25      -2.574  -5.204  -5.852  1.00  9.43           H   new
ATOM      0  HA  ASN A  25      -2.041  -3.409  -7.889  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -4.208  -4.709  -6.891  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -4.382  -3.254  -5.930  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -5.373  -3.204  -9.928  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -4.851  -4.677  -9.104  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -1.993  -2.018  -4.938  1.00  6.52           N
ATOM    402  CA  VAL A  26      -1.379  -0.993  -4.152  1.00  5.53           C
ATOM    403  C   VAL A  26       0.076  -0.795  -4.402  1.00  4.42           C
ATOM    404  O   VAL A  26       0.508   0.270  -4.841  1.00  3.40           O
ATOM    405  CB  VAL A  26      -1.562  -1.221  -2.681  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -0.941  -0.097  -1.834  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -3.090  -1.259  -2.510  1.00  8.12           C
ATOM      0  H   VAL A  26      -2.427  -2.721  -4.340  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -1.900  -0.092  -4.475  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -1.066  -2.131  -2.343  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -1.100  -0.308  -0.777  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26       0.129  -0.038  -2.036  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -1.411   0.853  -2.089  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -3.335  -1.423  -1.460  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -3.517  -0.311  -2.839  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -3.503  -2.070  -3.110  1.00  8.12           H   new
ATOM    417  N   LYS A  27       0.992  -1.775  -4.304  1.00  2.64           N
ATOM    418  CA  LYS A  27       2.321  -1.695  -4.826  1.00  4.14           C
ATOM    419  C   LYS A  27       2.516  -1.191  -6.215  1.00  5.58           C
ATOM    420  O   LYS A  27       3.344  -0.315  -6.461  1.00  4.11           O
ATOM    421  CB  LYS A  27       3.100  -3.012  -4.674  1.00  3.97           C
ATOM    422  CG  LYS A  27       3.466  -3.460  -3.257  1.00  7.45           C
ATOM    423  CD  LYS A  27       4.038  -4.869  -3.428  1.00  9.02           C
ATOM    424  CE  LYS A  27       4.705  -5.397  -2.157  1.00 12.90           C
ATOM    425  NZ  LYS A  27       5.303  -6.733  -2.374  1.00 15.47           N
ATOM      0  H   LYS A  27       0.798  -2.662  -3.840  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       2.721  -0.909  -4.185  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       2.512  -3.805  -5.136  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       4.023  -2.924  -5.247  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       4.197  -2.788  -2.806  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       2.592  -3.464  -2.605  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       3.237  -5.548  -3.721  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       4.766  -4.865  -4.240  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       5.478  -4.699  -1.833  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       3.969  -5.452  -1.355  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       4.775  -7.443  -1.828  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       5.260  -6.972  -3.385  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       6.295  -6.724  -2.062  1.00 15.47           H   new
ATOM    439  N   ALA A  28       1.713  -1.641  -7.195  1.00  6.61           N
ATOM    440  CA  ALA A  28       1.880  -1.229  -8.555  1.00  7.74           C
ATOM    441  C   ALA A  28       1.529   0.188  -8.850  1.00  9.17           C
ATOM    442  O   ALA A  28       2.139   0.912  -9.635  1.00 11.45           O
ATOM    443  CB  ALA A  28       1.135  -2.105  -9.576  1.00  7.68           C
ATOM      0  H   ALA A  28       0.944  -2.294  -7.045  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       2.957  -1.350  -8.669  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28       1.314  -1.724 -10.581  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       1.496  -3.131  -9.507  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28       0.066  -2.081  -9.364  1.00  7.68           H   new
ATOM    449  N   LYS A  29       0.466   0.608  -8.141  1.00  8.96           N
ATOM    450  CA  LYS A  29       0.002   1.955  -8.272  1.00  7.90           C
ATOM    451  C   LYS A  29       0.970   2.913  -7.668  1.00  6.92           C
ATOM    452  O   LYS A  29       1.150   4.007  -8.200  1.00  6.87           O
ATOM    453  CB  LYS A  29      -1.369   1.950  -7.574  1.00 10.28           C
ATOM    454  CG  LYS A  29      -2.242   3.176  -7.847  1.00 14.94           C
ATOM    455  CD  LYS A  29      -3.663   3.089  -7.287  1.00 19.69           C
ATOM    456  CE  LYS A  29      -4.617   3.791  -8.255  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -5.985   3.287  -7.998  1.00 24.98           N
ATOM      0  H   LYS A  29      -0.064   0.029  -7.489  1.00  8.96           H   new
ATOM      0  HA  LYS A  29      -0.088   2.284  -9.307  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -1.914   1.059  -7.885  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29      -1.211   1.868  -6.499  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -1.753   4.054  -7.425  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29      -2.300   3.331  -8.924  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -3.955   2.047  -7.158  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -3.711   3.557  -6.304  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -4.576   4.871  -8.114  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -4.326   3.593  -9.287  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -6.624   3.618  -8.749  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -5.975   2.247  -7.985  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -6.319   3.641  -7.079  1.00 24.98           H   new
ATOM    471  N   ILE A  30       1.648   2.539  -6.568  1.00  4.57           N
ATOM    472  CA  ILE A  30       2.729   3.256  -5.966  1.00  5.58           C
ATOM    473  C   ILE A  30       3.842   3.410  -6.944  1.00  7.26           C
ATOM    474  O   ILE A  30       4.453   4.475  -7.023  1.00  9.46           O
ATOM    475  CB  ILE A  30       3.215   2.755  -4.638  1.00  5.36           C
ATOM    476  CG1 ILE A  30       2.118   2.887  -3.568  1.00  2.94           C
ATOM    477  CG2 ILE A  30       4.454   3.460  -4.060  1.00  2.78           C
ATOM    478  CD1 ILE A  30       2.260   2.022  -2.316  1.00  2.00           C
ATOM      0  H   ILE A  30       1.426   1.679  -6.067  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       2.310   4.229  -5.710  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       3.487   1.723  -4.857  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       2.074   3.930  -3.255  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       1.161   2.653  -4.034  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       4.712   3.014  -3.100  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       5.291   3.347  -4.749  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       4.238   4.519  -3.921  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       1.422   2.212  -1.645  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       2.266   0.970  -2.600  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       3.193   2.266  -1.809  1.00  2.00           H   new
ATOM    490  N   GLN A  31       4.208   2.365  -7.707  1.00  7.06           N
ATOM    491  CA  GLN A  31       5.326   2.373  -8.598  1.00  8.67           C
ATOM    492  C   GLN A  31       5.036   3.307  -9.722  1.00 10.90           C
ATOM    493  O   GLN A  31       5.813   4.224  -9.985  1.00  9.63           O
ATOM    494  CB  GLN A  31       5.623   0.983  -9.186  1.00  9.12           C
ATOM    495  CG  GLN A  31       6.716   0.906 -10.253  1.00 10.76           C
ATOM    496  CD  GLN A  31       6.789  -0.399 -11.033  1.00 13.78           C
ATOM    497  OE1 GLN A  31       5.718  -0.972 -11.229  1.00 14.48           O
ATOM    498  NE2 GLN A  31       8.001  -0.903 -11.389  1.00 14.76           N
ATOM      0  H   GLN A  31       3.704   1.478  -7.703  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       6.199   2.688  -8.026  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       5.900   0.320  -8.367  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       4.701   0.591  -9.615  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       6.566   1.722 -10.960  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       7.680   1.074  -9.772  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       8.851  -0.373 -11.196  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       8.060  -1.811 -11.849  1.00 14.76           H   new
ATOM    507  N   ASP A  32       3.802   3.260 -10.255  1.00 10.93           N
ATOM    508  CA  ASP A  32       3.269   4.095 -11.286  1.00 14.01           C
ATOM    509  C   ASP A  32       3.283   5.539 -10.918  1.00 14.04           C
ATOM    510  O   ASP A  32       3.727   6.339 -11.741  1.00 13.39           O
ATOM    511  CB  ASP A  32       1.862   3.617 -11.684  1.00 18.01           C
ATOM    512  CG  ASP A  32       1.331   4.375 -12.892  1.00 24.33           C
ATOM    513  OD1 ASP A  32       1.954   4.125 -13.958  1.00 26.29           O
ATOM    514  OD2 ASP A  32       0.291   5.082 -12.807  1.00 25.17           O
ATOM      0  H   ASP A  32       3.118   2.575  -9.934  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       3.921   4.004 -12.155  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       1.890   2.550 -11.907  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       1.181   3.749 -10.843  1.00 18.01           H   new
ATOM    519  N   LYS A  33       2.826   5.876  -9.699  1.00 14.22           N
ATOM    520  CA  LYS A  33       2.778   7.210  -9.185  1.00 14.00           C
ATOM    521  C   LYS A  33       4.055   7.773  -8.664  1.00 12.37           C
ATOM    522  O   LYS A  33       4.519   8.817  -9.119  1.00 12.17           O
ATOM    523  CB  LYS A  33       1.743   7.124  -8.051  1.00 18.62           C
ATOM    524  CG  LYS A  33       1.323   8.390  -7.302  1.00 24.00           C
ATOM    525  CD  LYS A  33       0.064   8.199  -6.455  1.00 27.61           C
ATOM    526  CE  LYS A  33      -0.443   9.357  -5.591  1.00 27.64           C
ATOM    527  NZ  LYS A  33      -0.845  10.559  -6.355  1.00 30.06           N
ATOM      0  H   LYS A  33       2.472   5.184  -9.039  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       2.535   7.893  -9.999  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       0.840   6.680  -8.469  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       2.130   6.423  -7.311  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33       2.141   8.712  -6.658  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       1.151   9.190  -8.022  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33      -0.744   7.916  -7.129  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33       0.240   7.350  -5.794  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -1.295   9.012  -5.006  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33       0.338   9.635  -4.883  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -1.175  11.294  -5.697  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33      -0.030  10.917  -6.893  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33      -1.613  10.312  -7.012  1.00 30.06           H   new
ATOM    541  N   GLU A  34       4.756   7.177  -7.682  1.00 10.11           N
ATOM    542  CA  GLU A  34       5.984   7.624  -7.102  1.00 10.07           C
ATOM    543  C   GLU A  34       7.228   7.219  -7.814  1.00  9.32           C
ATOM    544  O   GLU A  34       8.089   8.050  -8.102  1.00 11.61           O
ATOM    545  CB  GLU A  34       6.009   7.254  -5.609  1.00 14.77           C
ATOM    546  CG  GLU A  34       5.181   8.117  -4.655  1.00 18.75           C
ATOM    547  CD  GLU A  34       5.802   9.474  -4.358  1.00 22.28           C
ATOM    548  OE1 GLU A  34       7.045   9.659  -4.259  1.00 21.95           O
ATOM    549  OE2 GLU A  34       5.037  10.444  -4.111  1.00 25.19           O
ATOM      0  H   GLU A  34       4.433   6.307  -7.259  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       5.994   8.708  -7.216  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       5.668   6.223  -5.512  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       7.046   7.280  -5.273  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       4.190   8.267  -5.083  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       5.044   7.577  -3.718  1.00 18.75           H   new
ATOM    556  N   GLY A  35       7.389   5.902  -8.037  1.00  7.22           N
ATOM    557  CA  GLY A  35       8.551   5.317  -8.630  1.00  6.29           C
ATOM    558  C   GLY A  35       9.502   4.687  -7.672  1.00  6.93           C
ATOM    559  O   GLY A  35      10.678   5.040  -7.588  1.00  7.41           O
ATOM      0  H   GLY A  35       6.676   5.214  -7.793  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       8.232   4.563  -9.349  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35       9.081   6.088  -9.190  1.00  6.29           H   new
ATOM    563  N   ILE A  36       8.944   3.769  -6.863  1.00  5.86           N
ATOM    564  CA  ILE A  36       9.626   2.806  -6.055  1.00  6.07           C
ATOM    565  C   ILE A  36       9.151   1.488  -6.561  1.00  6.36           C
ATOM    566  O   ILE A  36       7.936   1.309  -6.492  1.00  6.18           O
ATOM    567  CB  ILE A  36       9.337   3.004  -4.596  1.00  7.47           C
ATOM    568  CG1 ILE A  36       9.630   4.437  -4.122  1.00  8.52           C
ATOM    569  CG2 ILE A  36      10.044   1.928  -3.754  1.00  7.36           C
ATOM    570  CD1 ILE A  36       9.187   4.822  -2.711  1.00  9.49           C
ATOM      0  H   ILE A  36       7.931   3.696  -6.767  1.00  5.86           H   new
ATOM      0  HA  ILE A  36      10.710   2.893  -6.129  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       8.265   2.876  -4.447  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36      10.705   4.600  -4.192  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       9.156   5.125  -4.822  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       9.823   2.088  -2.699  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       9.691   0.941  -4.053  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36      11.121   1.991  -3.912  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36       9.459   5.859  -2.515  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36       8.106   4.707  -2.625  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36       9.679   4.174  -1.986  1.00  9.49           H   new
ATOM    582  N   PRO A  37       9.946   0.540  -6.962  1.00  8.65           N
ATOM    583  CA  PRO A  37       9.489  -0.702  -7.513  1.00  9.18           C
ATOM    584  C   PRO A  37       8.952  -1.639  -6.487  1.00  9.85           C
ATOM    585  O   PRO A  37       9.318  -1.460  -5.326  1.00  8.51           O
ATOM    586  CB  PRO A  37      10.746  -1.265  -8.174  1.00 11.42           C
ATOM    587  CG  PRO A  37      11.865  -0.826  -7.216  1.00  9.27           C
ATOM    588  CD  PRO A  37      11.397   0.599  -6.881  1.00  8.33           C
ATOM      0  HA  PRO A  37       8.653  -0.562  -8.198  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37      10.700  -2.350  -8.271  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37      10.891  -0.861  -9.176  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      11.928  -1.461  -6.332  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      12.847  -0.840  -7.690  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      11.726   0.900  -5.887  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      11.804   1.325  -7.585  1.00  8.33           H   new
ATOM    596  N   PRO A  38       8.148  -2.613  -6.794  1.00  8.71           N
ATOM    597  CA  PRO A  38       7.592  -3.546  -5.857  1.00  9.08           C
ATOM    598  C   PRO A  38       8.578  -4.387  -5.122  1.00  9.28           C
ATOM    599  O   PRO A  38       8.107  -5.078  -4.220  1.00  6.50           O
ATOM    600  CB  PRO A  38       6.617  -4.375  -6.690  1.00 10.31           C
ATOM    601  CG  PRO A  38       6.084  -3.354  -7.707  1.00 10.81           C
ATOM    602  CD  PRO A  38       7.361  -2.557  -8.016  1.00 12.00           C
ATOM      0  HA  PRO A  38       7.113  -3.014  -5.035  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       7.114  -5.212  -7.180  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       5.817  -4.793  -6.079  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       5.671  -3.833  -8.595  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       5.297  -2.727  -7.288  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       7.904  -2.992  -8.855  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       7.127  -1.528  -8.287  1.00 12.00           H   new
ATOM    610  N   ASP A  39       9.871  -4.434  -5.487  1.00 11.20           N
ATOM    611  CA  ASP A  39      10.797  -5.333  -4.870  1.00 14.96           C
ATOM    612  C   ASP A  39      11.303  -4.644  -3.649  1.00 13.99           C
ATOM    613  O   ASP A  39      11.804  -5.245  -2.701  1.00 13.75           O
ATOM    614  CB  ASP A  39      11.972  -5.564  -5.834  1.00 24.16           C
ATOM    615  CG  ASP A  39      11.523  -6.175  -7.153  1.00 31.06           C
ATOM    616  OD1 ASP A  39      10.624  -7.051  -7.050  1.00 35.55           O
ATOM    617  OD2 ASP A  39      12.128  -5.780  -8.186  1.00 34.22           O
ATOM      0  H   ASP A  39      10.278  -3.846  -6.214  1.00 11.20           H   new
ATOM      0  HA  ASP A  39      10.333  -6.289  -4.627  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      12.473  -4.615  -6.027  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      12.703  -6.220  -5.362  1.00 24.16           H   new
ATOM    622  N   GLN A  40      11.372  -3.302  -3.582  1.00 11.60           N
ATOM    623  CA  GLN A  40      11.862  -2.497  -2.507  1.00 10.76           C
ATOM    624  C   GLN A  40      10.783  -2.261  -1.507  1.00  8.01           C
ATOM    625  O   GLN A  40      11.113  -2.014  -0.349  1.00  8.96           O
ATOM    626  CB  GLN A  40      12.419  -1.149  -2.993  1.00 11.14           C
ATOM    627  CG  GLN A  40      13.346  -0.414  -2.023  1.00 14.85           C
ATOM    628  CD  GLN A  40      13.842   0.924  -2.552  1.00 16.11           C
ATOM    629  OE1 GLN A  40      13.715   1.198  -3.744  1.00 20.52           O
ATOM    630  NE2 GLN A  40      14.565   1.753  -1.752  1.00 18.16           N
ATOM      0  H   GLN A  40      11.052  -2.726  -4.361  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      12.682  -3.047  -2.045  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      12.961  -1.317  -3.924  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      11.579  -0.495  -3.227  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      12.819  -0.251  -1.083  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      14.204  -1.049  -1.802  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      14.677   1.536  -0.762  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      14.995   2.592  -2.142  1.00 18.16           H   new
ATOM    639  N   GLN A  41       9.485  -2.240  -1.859  1.00  6.52           N
ATOM    640  CA  GLN A  41       8.382  -1.980  -0.986  1.00  3.87           C
ATOM    641  C   GLN A  41       8.047  -3.102  -0.065  1.00  4.79           C
ATOM    642  O   GLN A  41       7.986  -4.287  -0.390  1.00  6.34           O
ATOM    643  CB  GLN A  41       7.163  -1.637  -1.858  1.00  4.20           C
ATOM    644  CG  GLN A  41       7.216  -0.435  -2.804  1.00  3.20           C
ATOM    645  CD  GLN A  41       5.906  -0.194  -3.540  1.00  4.89           C
ATOM    646  OE1 GLN A  41       4.798  -0.434  -3.064  1.00  5.21           O
ATOM    647  NE2 GLN A  41       6.026   0.250  -4.820  1.00  7.13           N
ATOM      0  H   GLN A  41       9.187  -2.417  -2.818  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       8.669  -1.153  -0.336  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.938  -2.516  -2.462  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       6.317  -1.486  -1.188  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       7.474   0.457  -2.234  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       8.012  -0.589  -3.533  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       6.949   0.447  -5.207  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       5.193   0.386  -5.393  1.00  7.13           H   new
ATOM    656  N   ARG A  42       7.924  -2.707   1.215  1.00  5.73           N
ATOM    657  CA  ARG A  42       7.318  -3.457   2.272  1.00  6.97           C
ATOM    658  C   ARG A  42       6.374  -2.614   3.057  1.00  7.15           C
ATOM    659  O   ARG A  42       6.672  -1.490   3.457  1.00  7.33           O
ATOM    660  CB  ARG A  42       8.382  -3.917   3.283  1.00 13.23           C
ATOM    661  CG  ARG A  42       7.910  -4.837   4.411  1.00 21.27           C
ATOM    662  CD  ARG A  42       9.071  -5.419   5.220  1.00 26.14           C
ATOM    663  NE  ARG A  42       8.561  -6.489   6.122  1.00 32.26           N
ATOM    664  CZ  ARG A  42       9.265  -7.518   6.677  1.00 34.32           C
ATOM    665  NH1 ARG A  42      10.572  -7.846   6.461  1.00 35.30           N
ATOM    666  NH2 ARG A  42       8.550  -8.403   7.432  1.00 36.39           N
ATOM      0  H   ARG A  42       8.272  -1.802   1.532  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       6.807  -4.296   1.799  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       9.172  -4.430   2.735  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       8.829  -3.030   3.732  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       7.251  -4.280   5.077  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       7.322  -5.652   3.988  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       9.828  -5.825   4.549  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       9.551  -4.634   5.805  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       7.568  -6.448   6.352  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42      11.138  -7.291   5.819  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42      10.983  -8.646   6.942  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42       7.546  -8.274   7.555  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42       9.020  -9.193   7.873  1.00 36.39           H   new
ATOM    680  N   LEU A  43       5.176  -3.225   3.116  1.00  4.65           N
ATOM    681  CA  LEU A  43       3.994  -2.517   3.496  1.00  3.51           C
ATOM    682  C   LEU A  43       3.482  -2.879   4.848  1.00  5.56           C
ATOM    683  O   LEU A  43       3.104  -4.026   5.081  1.00  4.19           O
ATOM    684  CB  LEU A  43       2.869  -2.602   2.450  1.00  3.74           C
ATOM    685  CG  LEU A  43       3.231  -1.975   1.093  1.00  6.32           C
ATOM    686  CD1 LEU A  43       2.159  -2.240   0.023  1.00  6.41           C
ATOM    687  CD2 LEU A  43       3.405  -0.446   1.103  1.00  9.55           C
ATOM      0  H   LEU A  43       5.027  -4.211   2.900  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       4.319  -1.478   3.547  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       2.607  -3.649   2.297  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       1.982  -2.105   2.844  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       4.183  -2.456   0.869  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       2.461  -1.777  -0.917  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43       2.047  -3.315  -0.121  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43       1.209  -1.816   0.347  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       3.659  -0.102   0.100  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       2.475   0.024   1.423  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       4.205  -0.175   1.793  1.00  9.55           H   new
ATOM    699  N   ILE A  44       3.467  -1.979   5.847  1.00  4.58           N
ATOM    700  CA  ILE A  44       3.130  -2.385   7.177  1.00  5.55           C
ATOM    701  C   ILE A  44       2.082  -1.435   7.647  1.00  5.46           C
ATOM    702  O   ILE A  44       2.104  -0.267   7.261  1.00  6.04           O
ATOM    703  CB  ILE A  44       4.425  -2.331   7.931  1.00  6.80           C
ATOM    704  CG1 ILE A  44       5.529  -3.223   7.338  1.00 10.31           C
ATOM    705  CG2 ILE A  44       4.151  -2.569   9.425  1.00  7.39           C
ATOM    706  CD1 ILE A  44       6.756  -3.372   8.236  1.00 13.90           C
ATOM      0  H   ILE A  44       3.684  -0.988   5.739  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       2.716  -3.386   7.294  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       4.845  -1.331   7.823  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       5.115  -4.211   7.138  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       5.841  -2.809   6.379  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       5.090  -2.531   9.978  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44       3.478  -1.797   9.799  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       3.691  -3.548   9.559  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       7.488  -4.015   7.748  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       7.197  -2.391   8.416  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       6.460  -3.816   9.186  1.00 13.90           H   new
ATOM    718  N   PHE A  45       1.015  -1.957   8.278  1.00  6.75           N
ATOM    719  CA  PHE A  45       0.007  -1.157   8.901  1.00  4.70           C
ATOM    720  C   PHE A  45       0.279  -1.008  10.359  1.00  6.34           C
ATOM    721  O   PHE A  45       0.237   0.062  10.964  1.00  5.45           O
ATOM    722  CB  PHE A  45      -1.410  -1.647   8.560  1.00  5.51           C
ATOM    723  CG  PHE A  45      -2.427  -0.798   9.241  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -2.646   0.503   8.853  1.00  6.86           C
ATOM    725  CD2 PHE A  45      -3.197  -1.277  10.275  1.00  5.87           C
ATOM    726  CE1 PHE A  45      -3.561   1.288   9.513  1.00  6.68           C
ATOM    727  CE2 PHE A  45      -4.053  -0.485  11.004  1.00  6.64           C
ATOM    728  CZ  PHE A  45      -4.306   0.790  10.557  1.00  6.84           C
ATOM      0  H   PHE A  45       0.849  -2.960   8.357  1.00  6.75           H   new
ATOM      0  HA  PHE A  45       0.051  -0.150   8.486  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -1.563  -1.616   7.481  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -1.527  -2.686   8.869  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -2.093   0.912   8.021  1.00  6.86           H   new
ATOM      0  HD2 PHE A  45      -3.126  -2.325  10.526  1.00  5.87           H   new
ATOM      0  HE1 PHE A  45      -3.698   2.315   9.207  1.00  6.68           H   new
ATOM      0  HE2 PHE A  45      -4.516  -0.856  11.907  1.00  6.64           H   new
ATOM      0  HZ  PHE A  45      -5.076   1.391  11.017  1.00  6.84           H   new
ATOM    738  N   ALA A  46       0.400  -2.231  10.907  1.00  6.53           N
ATOM    739  CA  ALA A  46       0.586  -2.622  12.270  1.00  7.15           C
ATOM    740  C   ALA A  46       1.852  -3.403  12.357  1.00  9.00           C
ATOM    741  O   ALA A  46       2.935  -2.912  12.042  1.00 11.15           O
ATOM    742  CB  ALA A  46      -0.675  -3.296  12.837  1.00  8.99           C
ATOM      0  H   ALA A  46       0.361  -3.055  10.307  1.00  6.53           H   new
ATOM      0  HA  ALA A  46       0.711  -1.761  12.927  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -0.500  -3.581  13.874  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -1.513  -2.600  12.788  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -0.907  -4.185  12.251  1.00  8.99           H   new
ATOM    748  N   GLY A  47       1.810  -4.624  12.920  1.00  9.35           N
ATOM    749  CA  GLY A  47       2.912  -5.464  13.272  1.00 11.68           C
ATOM    750  C   GLY A  47       2.778  -6.729  12.497  1.00 11.14           C
ATOM    751  O   GLY A  47       3.591  -7.634  12.677  1.00 13.93           O
ATOM      0  H   GLY A  47       0.918  -5.062  13.150  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47       3.857  -4.972  13.042  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47       2.911  -5.669  14.343  1.00 11.68           H   new
ATOM    755  N   LYS A  48       1.803  -6.789  11.573  1.00 10.47           N
ATOM    756  CA  LYS A  48       1.474  -7.950  10.805  1.00  8.82           C
ATOM    757  C   LYS A  48       1.814  -7.874   9.356  1.00  7.68           C
ATOM    758  O   LYS A  48       1.657  -6.860   8.678  1.00  6.47           O
ATOM    759  CB  LYS A  48       0.015  -8.362  11.064  1.00  9.74           C
ATOM    760  CG  LYS A  48      -0.203  -8.984  12.444  1.00 14.14           C
ATOM    761  CD  LYS A  48      -1.610  -9.538  12.676  1.00 16.32           C
ATOM    762  CE  LYS A  48      -1.708 -10.908  12.003  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -3.079 -11.426  12.215  1.00 23.92           N
ATOM      0  H   LYS A  48       1.214  -5.987  11.350  1.00 10.47           H   new
ATOM      0  HA  LYS A  48       2.129  -8.745  11.162  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -0.626  -7.486  10.963  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -0.295  -9.074  10.299  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48       0.518  -9.789  12.583  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48       0.008  -8.232  13.205  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -1.812  -9.625  13.744  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48      -2.357  -8.859  12.265  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48      -1.493 -10.825  10.938  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48      -0.973 -11.593  12.425  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -3.171 -12.359  11.765  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -3.263 -11.513  13.235  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -3.767 -10.770  11.794  1.00 23.92           H   new
ATOM    777  N   GLN A  49       2.210  -9.039   8.813  1.00  8.89           N
ATOM    778  CA  GLN A  49       2.697  -9.229   7.482  1.00  7.18           C
ATOM    779  C   GLN A  49       1.599  -9.182   6.476  1.00  8.23           C
ATOM    780  O   GLN A  49       0.682  -9.994   6.594  1.00  9.70           O
ATOM    781  CB  GLN A  49       3.547 -10.499   7.311  1.00 11.67           C
ATOM    782  CG  GLN A  49       4.838 -10.467   8.132  1.00 15.82           C
ATOM    783  CD  GLN A  49       5.763 -11.675   8.130  1.00 20.21           C
ATOM    784  OE1 GLN A  49       6.859 -11.497   8.658  1.00 23.23           O
ATOM    785  NE2 GLN A  49       5.355 -12.832   7.543  1.00 20.67           N
ATOM      0  H   GLN A  49       2.188  -9.910   9.343  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       3.365  -8.387   7.298  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       2.957 -11.367   7.605  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       3.796 -10.624   6.257  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       5.420  -9.611   7.791  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       4.560 -10.271   9.168  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       4.425 -12.893   7.127  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       5.979 -13.639   7.518  1.00 20.67           H   new
ATOM    794  N   LEU A  50       1.659  -8.267   5.492  1.00  6.51           N
ATOM    795  CA  LEU A  50       0.763  -8.085   4.393  1.00  7.41           C
ATOM    796  C   LEU A  50       1.262  -8.806   3.188  1.00  8.27           C
ATOM    797  O   LEU A  50       2.390  -8.657   2.721  1.00  8.34           O
ATOM    798  CB  LEU A  50       0.418  -6.629   4.037  1.00  7.13           C
ATOM    799  CG  LEU A  50      -0.122  -5.714   5.149  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -0.492  -4.295   4.688  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -1.228  -6.347   6.009  1.00  8.14           C
ATOM      0  H   LEU A  50       2.416  -7.584   5.467  1.00  6.51           H   new
ATOM      0  HA  LEU A  50      -0.178  -8.513   4.739  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50       1.317  -6.164   3.631  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -0.320  -6.649   3.235  1.00  7.13           H   new
ATOM      0  HG  LEU A  50       0.740  -5.596   5.805  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -0.863  -3.722   5.537  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50       0.390  -3.804   4.277  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -1.266  -4.351   3.922  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -1.551  -5.635   6.768  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -2.075  -6.612   5.376  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -0.843  -7.244   6.494  1.00  8.14           H   new
ATOM    813  N   GLU A  51       0.478  -9.753   2.644  1.00  9.43           N
ATOM    814  CA  GLU A  51       0.748 -10.608   1.529  1.00 11.90           C
ATOM    815  C   GLU A  51       0.107 -10.001   0.329  1.00 11.49           C
ATOM    816  O   GLU A  51      -0.947  -9.369   0.391  1.00  9.88           O
ATOM    817  CB  GLU A  51       0.210 -12.027   1.779  1.00 16.56           C
ATOM    818  CG  GLU A  51       1.099 -13.102   1.148  1.00 26.06           C
ATOM    819  CD  GLU A  51       0.380 -14.437   1.020  1.00 29.86           C
ATOM    820  OE1 GLU A  51      -0.486 -14.536   0.110  1.00 33.44           O
ATOM    821  OE2 GLU A  51       0.599 -15.362   1.848  1.00 32.13           O
ATOM      0  H   GLU A  51      -0.448  -9.938   3.031  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       1.824 -10.699   1.378  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51       0.137 -12.202   2.852  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51      -0.799 -12.108   1.374  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       1.424 -12.770   0.162  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51       1.996 -13.231   1.753  1.00 26.06           H   new
ATOM    828  N   ASP A  52       0.817 -10.147  -0.804  1.00 12.71           N
ATOM    829  CA  ASP A  52       0.537  -9.319  -1.936  1.00 16.56           C
ATOM    830  C   ASP A  52      -0.820  -9.575  -2.495  1.00 15.83           C
ATOM    831  O   ASP A  52      -1.510  -8.638  -2.896  1.00 17.21           O
ATOM    832  CB  ASP A  52       1.698  -9.637  -2.893  1.00 21.05           C
ATOM    833  CG  ASP A  52       3.065  -9.094  -2.503  1.00 25.12           C
ATOM    834  OD1 ASP A  52       3.138  -8.072  -1.769  1.00 25.82           O
ATOM    835  OD2 ASP A  52       4.110  -9.656  -2.927  1.00 28.37           O
ATOM      0  H   ASP A  52       1.569 -10.823  -0.936  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       0.493  -8.254  -1.707  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       1.775 -10.720  -2.988  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       1.444  -9.248  -3.879  1.00 21.05           H   new
ATOM    840  N   GLY A  53      -1.161 -10.876  -2.503  1.00 15.00           N
ATOM    841  CA  GLY A  53      -2.319 -11.305  -3.224  1.00 11.77           C
ATOM    842  C   GLY A  53      -3.672 -11.188  -2.611  1.00 11.10           C
ATOM    843  O   GLY A  53      -4.685 -11.345  -3.291  1.00 11.25           O
ATOM      0  H   GLY A  53      -0.649 -11.616  -2.022  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -2.340 -10.749  -4.161  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53      -2.170 -12.354  -3.479  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -3.787 -10.904  -1.301  1.00  8.53           N
ATOM    848  CA  ARG A  54      -5.017 -10.799  -0.579  1.00  9.05           C
ATOM    849  C   ARG A  54      -5.411  -9.364  -0.657  1.00  8.96           C
ATOM    850  O   ARG A  54      -4.790  -8.539  -1.325  1.00 11.60           O
ATOM    851  CB  ARG A  54      -4.780 -11.210   0.883  1.00  7.97           C
ATOM    852  CG  ARG A  54      -3.688 -12.262   1.095  1.00  9.62           C
ATOM    853  CD  ARG A  54      -4.036 -13.683   0.648  1.00 12.20           C
ATOM    854  NE  ARG A  54      -2.963 -14.603   1.120  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -2.994 -15.474   2.170  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -4.081 -15.670   2.972  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -1.901 -16.258   2.407  1.00 25.50           N
ATOM      0  H   ARG A  54      -2.972 -10.738  -0.711  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -5.795 -11.444  -0.988  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -4.521 -10.320   1.457  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -5.715 -11.592   1.292  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -2.793 -11.942   0.561  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -3.435 -12.287   2.155  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -5.000 -13.984   1.058  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -4.123 -13.728  -0.438  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -2.092 -14.579   0.589  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -4.941 -15.148   2.802  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -4.034 -16.339   3.741  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54      -1.081 -16.186   1.804  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -1.904 -16.915   3.187  1.00 25.50           H   new
ATOM    871  N   THR A  55      -6.618  -9.048  -0.156  1.00  9.05           N
ATOM    872  CA  THR A  55      -7.170  -7.762  -0.451  1.00  9.03           C
ATOM    873  C   THR A  55      -7.247  -6.988   0.819  1.00  8.15           C
ATOM    874  O   THR A  55      -6.935  -7.425   1.926  1.00  5.91           O
ATOM    875  CB  THR A  55      -8.483  -7.788  -1.176  1.00 11.15           C
ATOM    876  OG1 THR A  55      -9.505  -8.371  -0.381  1.00 11.95           O
ATOM    877  CG2 THR A  55      -8.371  -8.635  -2.455  1.00 11.71           C
ATOM      0  H   THR A  55      -7.193  -9.654   0.430  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -6.503  -7.273  -1.161  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -8.733  -6.753  -1.408  1.00 11.15           H   new
ATOM      0  HG1 THR A  55     -10.348  -8.372  -0.881  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -9.331  -8.645  -2.970  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -7.612  -8.207  -3.110  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -8.090  -9.655  -2.193  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -7.637  -5.706   0.700  1.00  6.91           N
ATOM    886  CA  LEU A  56      -7.898  -4.873   1.833  1.00  8.29           C
ATOM    887  C   LEU A  56      -9.044  -5.329   2.669  1.00  8.05           C
ATOM    888  O   LEU A  56      -9.077  -5.175   3.888  1.00 10.17           O
ATOM    889  CB  LEU A  56      -8.088  -3.427   1.347  1.00  6.60           C
ATOM    890  CG  LEU A  56      -6.817  -2.910   0.652  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -7.171  -1.460   0.279  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -5.504  -2.897   1.453  1.00  9.85           C
ATOM      0  H   LEU A  56      -7.773  -5.240  -0.197  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -7.036  -4.936   2.497  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -8.930  -3.379   0.657  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -8.332  -2.784   2.193  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -6.590  -3.597  -0.164  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -6.323  -0.997  -0.226  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -8.036  -1.456  -0.385  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -7.405  -0.898   1.183  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -4.701  -2.507   0.828  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -5.620  -2.263   2.332  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -5.259  -3.912   1.767  1.00  9.85           H   new
ATOM    904  N   SER A  57     -10.039  -5.965   2.024  1.00  8.92           N
ATOM    905  CA  SER A  57     -11.172  -6.548   2.673  1.00  9.00           C
ATOM    906  C   SER A  57     -10.915  -7.737   3.532  1.00  9.44           C
ATOM    907  O   SER A  57     -11.546  -7.965   4.563  1.00 10.91           O
ATOM    908  CB  SER A  57     -12.360  -6.786   1.725  1.00 10.32           C
ATOM    909  OG  SER A  57     -13.652  -6.992   2.277  1.00 13.59           O
ATOM      0  H   SER A  57     -10.054  -6.077   1.010  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -11.448  -5.766   3.380  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -12.422  -5.929   1.054  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -12.122  -7.655   1.111  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -14.299  -7.127   1.554  1.00 13.59           H   new
ATOM    915  N   ASP A  58      -9.917  -8.573   3.194  1.00  9.11           N
ATOM    916  CA  ASP A  58      -9.385  -9.742   3.823  1.00  7.91           C
ATOM    917  C   ASP A  58      -8.832  -9.399   5.163  1.00  9.12           C
ATOM    918  O   ASP A  58      -9.080 -10.057   6.172  1.00  8.61           O
ATOM    919  CB  ASP A  58      -8.289 -10.487   3.042  1.00  8.41           C
ATOM    920  CG  ASP A  58      -9.021 -11.391   2.061  1.00 11.50           C
ATOM    921  OD1 ASP A  58     -10.084 -11.985   2.384  1.00 10.05           O
ATOM    922  OD2 ASP A  58      -8.530 -11.406   0.900  1.00 11.70           O
ATOM      0  H   ASP A  58      -9.402  -8.390   2.333  1.00  9.11           H   new
ATOM      0  HA  ASP A  58     -10.238 -10.418   3.881  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -7.638  -9.787   2.518  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -7.657 -11.069   3.713  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -7.988  -8.352   5.173  1.00  7.97           N
ATOM    928  CA  TYR A  59      -7.394  -7.987   6.422  1.00  8.45           C
ATOM    929  C   TYR A  59      -8.165  -6.997   7.226  1.00 10.98           C
ATOM    930  O   TYR A  59      -7.973  -6.778   8.421  1.00 12.95           O
ATOM    931  CB  TYR A  59      -6.024  -7.331   6.180  1.00  7.94           C
ATOM    932  CG  TYR A  59      -5.013  -8.311   5.692  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -4.351  -9.127   6.578  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -4.542  -8.292   4.401  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -3.418 -10.044   6.155  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -3.626  -9.223   3.970  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -3.025 -10.104   4.838  1.00  6.76           C
ATOM    938  OH  TYR A  59      -1.849 -10.830   4.555  1.00  7.63           O
ATOM      0  H   TYR A  59      -7.727  -7.785   4.366  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -7.347  -8.926   6.974  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -6.131  -6.527   5.451  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -5.671  -6.877   7.106  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -4.569  -9.046   7.633  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -4.896  -7.536   3.716  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -2.986 -10.729   6.869  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -3.372  -9.263   2.921  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -1.148 -10.578   5.192  1.00  7.63           H   new
ATOM    948  N   ASN A  60      -9.045  -6.261   6.524  1.00 12.38           N
ATOM    949  CA  ASN A  60      -9.983  -5.309   7.035  1.00 13.94           C
ATOM    950  C   ASN A  60      -9.372  -3.960   7.198  1.00 14.16           C
ATOM    951  O   ASN A  60      -9.611  -3.245   8.169  1.00 14.26           O
ATOM    952  CB  ASN A  60     -10.854  -5.749   8.223  1.00 19.23           C
ATOM    953  CG  ASN A  60     -11.586  -7.083   8.238  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -11.253  -8.044   8.931  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -12.606  -7.194   7.346  1.00 24.09           N
ATOM      0  H   ASN A  60      -9.104  -6.340   5.509  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -10.733  -5.240   6.247  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -10.214  -5.732   9.105  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -11.609  -4.975   8.363  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -13.103  -8.079   7.247  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -12.875  -6.392   6.776  1.00 24.09           H   new
ATOM    962  N   ILE A  61      -8.556  -3.524   6.222  1.00 11.08           N
ATOM    963  CA  ILE A  61      -8.061  -2.188   6.098  1.00 11.78           C
ATOM    964  C   ILE A  61      -9.124  -1.330   5.502  1.00 13.74           C
ATOM    965  O   ILE A  61      -9.574  -1.472   4.367  1.00 14.60           O
ATOM    966  CB  ILE A  61      -6.801  -2.102   5.290  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -5.695  -3.053   5.780  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -6.283  -0.660   5.156  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -5.413  -3.136   7.279  1.00 11.42           C
ATOM      0  H   ILE A  61      -8.223  -4.138   5.478  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -7.804  -1.835   7.097  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -7.080  -2.442   4.292  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -5.944  -4.056   5.434  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -4.768  -2.766   5.284  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -5.369  -0.655   4.562  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -7.038  -0.046   4.665  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -6.074  -0.255   6.146  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -4.608  -3.849   7.459  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -5.118  -2.154   7.649  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -6.312  -3.465   7.801  1.00 11.42           H   new
ATOM    981  N   GLN A  62      -9.576  -0.359   6.316  1.00 13.97           N
ATOM    982  CA  GLN A  62     -10.630   0.533   5.943  1.00 15.52           C
ATOM    983  C   GLN A  62     -10.106   1.809   5.378  1.00 13.94           C
ATOM    984  O   GLN A  62      -8.905   1.992   5.186  1.00 12.15           O
ATOM    985  CB  GLN A  62     -11.415   0.784   7.241  1.00 19.53           C
ATOM    986  CG  GLN A  62     -12.072  -0.455   7.853  1.00 26.38           C
ATOM    987  CD  GLN A  62     -12.828  -0.108   9.128  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -13.999   0.236   8.974  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -12.242  -0.088  10.355  1.00 32.71           N
ATOM      0  H   GLN A  62      -9.203  -0.190   7.250  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -11.254   0.106   5.159  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -10.739   1.219   7.977  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -12.189   1.525   7.042  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -12.757  -0.900   7.131  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -11.310  -1.203   8.072  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -11.270  -0.377  10.461  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -12.775   0.216  11.170  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -11.021   2.758   5.112  1.00 11.73           N
ATOM    999  CA  LYS A  63     -10.740   4.081   4.648  1.00 11.97           C
ATOM   1000  C   LYS A  63     -10.026   4.904   5.664  1.00 10.41           C
ATOM   1001  O   LYS A  63     -10.185   4.713   6.868  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -12.028   4.766   4.162  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -12.994   5.036   5.317  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -14.482   5.008   4.964  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -14.945   5.880   3.795  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -16.407   6.075   3.677  1.00 25.97           N
ATOM      0  H   LYS A  63     -12.020   2.590   5.229  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -10.059   3.992   3.801  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -11.777   5.706   3.670  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -12.517   4.137   3.418  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -12.812   4.298   6.098  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -12.759   6.012   5.741  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -14.757   3.976   4.744  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -15.044   5.306   5.849  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -14.473   6.858   3.887  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -14.581   5.436   2.869  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -16.611   6.679   2.855  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -16.871   5.153   3.553  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -16.767   6.531   4.540  1.00 25.97           H   new
ATOM   1020  N   GLU A  64      -9.137   5.801   5.201  1.00 10.04           N
ATOM   1021  CA  GLU A  64      -8.330   6.687   5.980  1.00 10.94           C
ATOM   1022  C   GLU A  64      -7.144   6.097   6.663  1.00  9.74           C
ATOM   1023  O   GLU A  64      -6.646   6.728   7.594  1.00  9.42           O
ATOM   1024  CB  GLU A  64      -9.218   7.701   6.720  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -10.096   8.575   5.822  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -10.970   9.594   6.538  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -10.648  10.033   7.674  1.00 32.61           O
ATOM   1028  OE2 GLU A  64     -12.093   9.841   6.022  1.00 31.72           O
ATOM      0  H   GLU A  64      -8.971   5.914   4.201  1.00 10.04           H   new
ATOM      0  HA  GLU A  64      -7.735   7.299   5.302  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64      -9.861   7.159   7.413  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64      -8.579   8.350   7.319  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64      -9.451   9.106   5.122  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -10.740   7.924   5.231  1.00 24.16           H   new
ATOM   1035  N   SER A  65      -6.762   4.852   6.327  1.00  6.85           N
ATOM   1036  CA  SER A  65      -5.779   4.152   7.094  1.00  6.90           C
ATOM   1037  C   SER A  65      -4.355   4.433   6.757  1.00  4.72           C
ATOM   1038  O   SER A  65      -3.956   4.540   5.598  1.00  3.91           O
ATOM   1039  CB  SER A  65      -5.830   2.642   6.806  1.00  7.28           C
ATOM   1040  OG  SER A  65      -7.045   1.966   7.094  1.00 10.56           O
ATOM      0  H   SER A  65      -7.131   4.333   5.530  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -6.029   4.475   8.105  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -5.602   2.492   5.751  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -5.034   2.163   7.376  1.00  7.28           H   new
ATOM      0  HG  SER A  65      -7.717   2.199   6.419  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -3.469   4.505   7.766  1.00  4.48           N
ATOM   1047  CA  THR A  66      -2.162   5.042   7.550  1.00  3.80           C
ATOM   1048  C   THR A  66      -1.154   3.945   7.575  1.00  4.60           C
ATOM   1049  O   THR A  66      -0.760   3.403   8.606  1.00  5.33           O
ATOM   1050  CB  THR A  66      -1.739   6.133   8.490  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -2.665   7.207   8.421  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -0.370   6.699   8.076  1.00  3.40           C
ATOM      0  H   THR A  66      -3.654   4.196   8.720  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -2.216   5.517   6.570  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -1.692   5.710   9.494  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -2.388   7.918   9.037  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -0.078   7.489   8.768  1.00  3.40           H   new
ATOM      0 HG22 THR A  66       0.375   5.903   8.099  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -0.435   7.106   7.067  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -0.801   3.510   6.352  1.00  4.17           N
ATOM   1061  CA  LEU A  67       0.094   2.435   6.057  1.00  3.85           C
ATOM   1062  C   LEU A  67       1.469   3.002   5.981  1.00  3.80           C
ATOM   1063  O   LEU A  67       1.653   4.177   5.667  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -0.221   1.595   4.807  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -1.361   0.568   4.913  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -2.795   1.092   5.093  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -1.247  -0.435   3.752  1.00  8.12           C
ATOM      0  H   LEU A  67      -1.170   3.944   5.506  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -0.020   1.713   6.866  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -0.459   2.279   3.993  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67       0.686   1.063   4.521  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -1.201   0.082   5.875  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -3.485   0.250   5.152  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -2.856   1.676   6.011  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -3.062   1.722   4.244  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -2.053  -1.166   3.822  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -1.321   0.097   2.803  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -0.287  -0.948   3.807  1.00  8.12           H   new
ATOM   1079  N   HIS A  68       2.528   2.230   6.285  1.00  2.94           N
ATOM   1080  CA  HIS A  68       3.884   2.663   6.418  1.00  4.17           C
ATOM   1081  C   HIS A  68       4.727   1.843   5.503  1.00  5.32           C
ATOM   1082  O   HIS A  68       4.779   0.615   5.485  1.00  7.70           O
ATOM   1083  CB  HIS A  68       4.287   2.510   7.895  1.00  5.57           C
ATOM   1084  CG  HIS A  68       5.473   3.303   8.358  1.00  9.95           C
ATOM   1085  ND1 HIS A  68       5.969   4.395   7.675  1.00 13.74           N
ATOM   1086  CD2 HIS A  68       6.171   3.156   9.515  1.00 12.79           C
ATOM   1087  CE1 HIS A  68       6.974   4.878   8.455  1.00 14.75           C
ATOM   1088  NE2 HIS A  68       7.135   4.144   9.540  1.00 16.30           N
ATOM      0  H   HIS A  68       2.427   1.228   6.450  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       4.017   3.709   6.140  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68       3.432   2.787   8.511  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       4.488   1.456   8.085  1.00  5.57           H   new
ATOM      0  HD1 HIS A  68       5.651   4.761   6.778  1.00 13.74           H   new
ATOM      0  HD2 HIS A  68       6.003   2.406  10.274  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68       7.564   5.750   8.217  1.00 14.75           H   new
ATOM   1096  N   LEU A  69       5.419   2.609   4.640  1.00  5.29           N
ATOM   1097  CA  LEU A  69       6.238   2.025   3.624  1.00  3.97           C
ATOM   1098  C   LEU A  69       7.649   1.912   4.089  1.00  5.07           C
ATOM   1099  O   LEU A  69       8.272   2.943   4.342  1.00  4.34           O
ATOM   1100  CB  LEU A  69       6.245   3.008   2.442  1.00  6.08           C
ATOM   1101  CG  LEU A  69       7.054   2.443   1.263  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       6.296   1.275   0.610  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       7.285   3.521   0.190  1.00  6.87           C
ATOM      0  H   LEU A  69       5.411   3.629   4.646  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       5.854   1.038   3.366  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       5.222   3.207   2.124  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       6.672   3.960   2.758  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       8.012   2.102   1.655  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       6.879   0.884  -0.224  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       6.140   0.486   1.346  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       5.331   1.626   0.244  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       7.859   3.097  -0.634  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       6.324   3.875  -0.182  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       7.836   4.355   0.625  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       8.187   0.699   4.306  1.00  4.29           N
ATOM   1116  CA  VAL A  70       9.466   0.479   4.906  1.00  6.26           C
ATOM   1117  C   VAL A  70      10.378   0.117   3.784  1.00  9.22           C
ATOM   1118  O   VAL A  70      10.107  -0.804   3.015  1.00  9.36           O
ATOM   1119  CB  VAL A  70       9.419  -0.421   6.105  1.00  8.69           C
ATOM   1120  CG1 VAL A  70      10.813  -0.484   6.753  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       8.408   0.053   7.163  1.00  8.54           C
ATOM      0  H   VAL A  70       7.710  -0.166   4.052  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       9.871   1.369   5.388  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       9.102  -1.403   5.754  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70      10.780  -1.138   7.625  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70      11.532  -0.875   6.033  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70      11.116   0.516   7.061  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       8.416  -0.635   8.008  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       8.681   1.051   7.505  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       7.410   0.079   6.726  1.00  8.54           H   new
ATOM   1131  N   LEU A  71      11.576   0.714   3.650  1.00 12.71           N
ATOM   1132  CA  LEU A  71      12.329   0.469   2.460  1.00 16.06           C
ATOM   1133  C   LEU A  71      13.394  -0.555   2.654  1.00 18.09           C
ATOM   1134  O   LEU A  71      14.302  -0.454   3.478  1.00 19.26           O
ATOM   1135  CB  LEU A  71      13.061   1.719   1.943  1.00 17.10           C
ATOM   1136  CG  LEU A  71      12.129   2.726   1.249  1.00 19.37           C
ATOM   1137  CD1 LEU A  71      11.012   2.188   0.338  1.00 19.57           C
ATOM   1138  CD2 LEU A  71      11.281   3.613   2.176  1.00 17.51           C
ATOM      0  H   LEU A  71      12.008   1.338   4.331  1.00 12.71           H   new
ATOM      0  HA  LEU A  71      11.575   0.132   1.749  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      13.559   2.211   2.778  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      13.839   1.413   1.244  1.00 17.10           H   new
ATOM      0  HG  LEU A  71      12.924   3.233   0.702  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71      10.445   3.023  -0.074  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71      11.452   1.611  -0.476  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71      10.346   1.548   0.917  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71      10.664   4.282   1.576  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71      10.639   2.985   2.794  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71      11.937   4.202   2.817  1.00 17.51           H   new