USER  MOD reduce.3.24.130724 H: found=0, std=0, add=587, rem=0, adj=17
USER  MOD reduce.3.24.130724 removed 586 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Single : A   1 MET CE  :methyl  170:sc=  -0.789   (180deg=-0.935)
USER  MOD Single : A   1 MET N   :NH3+    157:sc=   0.826   (180deg=0.502)
USER  MOD Single : A   2 GLN     :      amide:sc=       0  X(o=0,f=-0.064)
USER  MOD Single : A   6 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A   7 THR OG1 :   rot  170:sc=   0.488
USER  MOD Single : A   9 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  11 LYS NZ  :NH3+    148:sc=   0.634   (180deg=0.0581)
USER  MOD Single : A  12 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  14 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  20 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  22 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  25 ASN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  27 LYS NZ  :NH3+   -107:sc=    3.17   (180deg=0.158)
USER  MOD Single : A  29 LYS NZ  :NH3+    163:sc=   0.947   (180deg=0.83)
USER  MOD Single : A  31 GLN     :      amide:sc=  -0.885  K(o=-0.88,f=-1.6)
USER  MOD Single : A  33 LYS NZ  :NH3+   -139:sc=       0   (180deg=-0.0308)
USER  MOD Single : A  40 GLN     :      amide:sc=  -0.279  X(o=-0.28,f=-0.28)
USER  MOD Single : A  41 GLN     :      amide:sc=  -0.882  K(o=-0.88,f=-7!)
USER  MOD Single : A  48 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  49 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A  55 THR OG1 :   rot  -76:sc=    1.31
USER  MOD Single : A  57 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  59 TYR OH  :   rot   60:sc=   0.567
USER  MOD Single : A  60 ASN     :      amide:sc= -0.0347  X(o=-0.035,f=-0.058)
USER  MOD Single : A  62 GLN     :      amide:sc=       0  X(o=0,f=-0.076)
USER  MOD Single : A  63 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  65 SER OG  :   rot  108:sc=   0.564
USER  MOD Single : A  66 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  68 HIS     :     no HD1:sc=       0  X(o=0,f=0)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1     -13.495   3.740  -2.521  1.00  9.67           N
ATOM      2  CA  MET A   1     -13.011   4.412  -1.295  1.00 10.38           C
ATOM      3  C   MET A   1     -11.565   4.770  -1.315  1.00  9.62           C
ATOM      4  O   MET A   1     -10.755   4.240  -2.075  1.00  9.62           O
ATOM      5  CB  MET A   1     -13.440   3.616  -0.050  1.00 13.77           C
ATOM      6  CG  MET A   1     -12.905   2.194   0.133  1.00 16.29           C
ATOM      7  SD  MET A   1     -11.197   2.119   0.750  1.00 17.17           S
ATOM      8  CE  MET A   1     -11.072   0.336   0.424  1.00 16.11           C
ATOM      0  H1  MET A   1     -14.350   3.191  -2.301  1.00  9.67           H   new
ATOM      0  H2  MET A   1     -13.718   4.454  -3.243  1.00  9.67           H   new
ATOM      0  H3  MET A   1     -12.757   3.102  -2.882  1.00  9.67           H   new
ATOM      0  HA  MET A   1     -13.497   5.387  -1.251  1.00 10.38           H   new
ATOM      0  HB2 MET A   1     -13.150   4.194   0.828  1.00 13.77           H   new
ATOM      0  HB3 MET A   1     -14.529   3.562  -0.051  1.00 13.77           H   new
ATOM      0  HG2 MET A   1     -13.554   1.659   0.826  1.00 16.29           H   new
ATOM      0  HG3 MET A   1     -12.959   1.671  -0.822  1.00 16.29           H   new
ATOM      0  HE1 MET A   1     -10.037   0.015   0.546  1.00 16.11           H   new
ATOM      0  HE2 MET A   1     -11.706  -0.207   1.125  1.00 16.11           H   new
ATOM      0  HE3 MET A   1     -11.398   0.129  -0.595  1.00 16.11           H   new
ATOM     20  N   GLN A   2     -11.126   5.715  -0.465  1.00  9.27           N
ATOM     21  CA  GLN A   2      -9.737   6.011  -0.303  1.00  9.07           C
ATOM     22  C   GLN A   2      -9.027   5.602   0.943  1.00  8.72           C
ATOM     23  O   GLN A   2      -9.647   5.315   1.966  1.00  8.22           O
ATOM     24  CB  GLN A   2      -9.533   7.530  -0.422  1.00 14.46           C
ATOM     25  CG  GLN A   2     -10.255   8.241  -1.569  1.00 17.01           C
ATOM     26  CD  GLN A   2      -9.978   9.731  -1.713  1.00 20.10           C
ATOM     27  OE1 GLN A   2      -9.434  10.024  -2.776  1.00 21.89           O
ATOM     28  NE2 GLN A   2     -10.430  10.560  -0.734  1.00 19.49           N
ATOM      0  H   GLN A   2     -11.743   6.281   0.117  1.00  9.27           H   new
ATOM      0  HA  GLN A   2      -9.296   5.395  -1.087  1.00  9.07           H   new
ATOM      0  HB2 GLN A   2      -9.851   7.989   0.514  1.00 14.46           H   new
ATOM      0  HB3 GLN A   2      -8.465   7.721  -0.524  1.00 14.46           H   new
ATOM      0  HG2 GLN A   2      -9.983   7.750  -2.503  1.00 17.01           H   new
ATOM      0  HG3 GLN A   2     -11.328   8.103  -1.437  1.00 17.01           H   new
ATOM      0 HE21 GLN A   2     -10.865  10.171   0.103  1.00 19.49           H   new
ATOM      0 HE22 GLN A   2     -10.334  11.570  -0.837  1.00 19.49           H   new
ATOM     37  N   ILE A   3      -7.698   5.459   0.800  1.00  5.87           N
ATOM     38  CA  ILE A   3      -6.786   5.101   1.842  1.00  5.07           C
ATOM     39  C   ILE A   3      -5.576   5.954   1.668  1.00  4.01           C
ATOM     40  O   ILE A   3      -5.291   6.346   0.538  1.00  4.61           O
ATOM     41  CB  ILE A   3      -6.354   3.675   2.019  1.00  6.55           C
ATOM     42  CG1 ILE A   3      -5.914   3.061   0.679  1.00  4.72           C
ATOM     43  CG2 ILE A   3      -7.558   2.815   2.439  1.00  5.58           C
ATOM     44  CD1 ILE A   3      -4.689   2.154   0.778  1.00 10.83           C
ATOM      0  H   ILE A   3      -7.233   5.602  -0.096  1.00  5.87           H   new
ATOM      0  HA  ILE A   3      -7.364   5.261   2.752  1.00  5.07           H   new
ATOM      0  HB  ILE A   3      -5.549   3.683   2.754  1.00  6.55           H   new
ATOM      0 HG12 ILE A   3      -6.744   2.488   0.265  1.00  4.72           H   new
ATOM      0 HG13 ILE A   3      -5.700   3.866  -0.024  1.00  4.72           H   new
ATOM      0 HG21 ILE A   3      -7.239   1.780   2.566  1.00  5.58           H   new
ATOM      0 HG22 ILE A   3      -7.962   3.189   3.380  1.00  5.58           H   new
ATOM      0 HG23 ILE A   3      -8.328   2.865   1.669  1.00  5.58           H   new
ATOM      0 HD11 ILE A   3      -4.445   1.763  -0.210  1.00 10.83           H   new
ATOM      0 HD12 ILE A   3      -3.843   2.725   1.161  1.00 10.83           H   new
ATOM      0 HD13 ILE A   3      -4.903   1.326   1.454  1.00 10.83           H   new
ATOM     56  N   PHE A   4      -4.804   6.218   2.737  1.00  4.55           N
ATOM     57  CA  PHE A   4      -3.610   7.003   2.712  1.00  4.68           C
ATOM     58  C   PHE A   4      -2.492   6.028   2.860  1.00  5.30           C
ATOM     59  O   PHE A   4      -2.501   5.354   3.888  1.00  5.58           O
ATOM     60  CB  PHE A   4      -3.558   7.999   3.883  1.00  4.83           C
ATOM     61  CG  PHE A   4      -4.848   8.698   4.140  1.00  7.97           C
ATOM     62  CD1 PHE A   4      -5.368   9.427   3.097  1.00  8.34           C
ATOM     63  CD2 PHE A   4      -5.392   8.833   5.396  1.00  6.69           C
ATOM     64  CE1 PHE A   4      -6.527  10.136   3.307  1.00 10.61           C
ATOM     65  CE2 PHE A   4      -6.585   9.499   5.542  1.00  9.10           C
ATOM     66  CZ  PHE A   4      -7.191  10.176   4.510  1.00  8.90           C
ATOM      0  H   PHE A   4      -5.025   5.865   3.668  1.00  4.55           H   new
ATOM      0  HA  PHE A   4      -3.556   7.585   1.792  1.00  4.68           H   new
ATOM      0  HB2 PHE A   4      -3.258   7.467   4.786  1.00  4.83           H   new
ATOM      0  HB3 PHE A   4      -2.787   8.743   3.680  1.00  4.83           H   new
ATOM      0  HD1 PHE A   4      -4.877   9.442   2.135  1.00  8.34           H   new
ATOM      0  HD2 PHE A   4      -4.888   8.420   6.257  1.00  6.69           H   new
ATOM      0  HE1 PHE A   4      -6.940  10.694   2.479  1.00 10.61           H   new
ATOM      0  HE2 PHE A   4      -7.067   9.490   6.508  1.00  9.10           H   new
ATOM      0  HZ  PHE A   4      -8.125  10.703   4.636  1.00  8.90           H   new
ATOM     76  N   VAL A   5      -1.485   6.016   1.968  1.00  4.44           N
ATOM     77  CA  VAL A   5      -0.342   5.167   2.095  1.00  3.87           C
ATOM     78  C   VAL A   5       0.866   5.994   2.372  1.00  4.93           C
ATOM     79  O   VAL A   5       1.213   6.879   1.591  1.00  6.84           O
ATOM     80  CB  VAL A   5       0.004   4.336   0.894  1.00  2.99           C
ATOM     81  CG1 VAL A   5       1.109   3.312   1.203  1.00  5.28           C
ATOM     82  CG2 VAL A   5      -1.221   3.546   0.404  1.00  9.13           C
ATOM      0  H   VAL A   5      -1.465   6.610   1.139  1.00  4.44           H   new
ATOM      0  HA  VAL A   5      -0.619   4.486   2.900  1.00  3.87           H   new
ATOM      0  HB  VAL A   5       0.349   5.035   0.132  1.00  2.99           H   new
ATOM      0 HG11 VAL A   5       1.328   2.732   0.307  1.00  5.28           H   new
ATOM      0 HG12 VAL A   5       2.009   3.835   1.527  1.00  5.28           H   new
ATOM      0 HG13 VAL A   5       0.774   2.643   1.995  1.00  5.28           H   new
ATOM      0 HG21 VAL A   5      -0.946   2.951  -0.467  1.00  9.13           H   new
ATOM      0 HG22 VAL A   5      -1.570   2.886   1.198  1.00  9.13           H   new
ATOM      0 HG23 VAL A   5      -2.017   4.240   0.133  1.00  9.13           H   new
ATOM     92  N   LYS A   6       1.347   5.886   3.623  1.00  6.04           N
ATOM     93  CA  LYS A   6       2.328   6.808   4.104  1.00  6.12           C
ATOM     94  C   LYS A   6       3.686   6.212   3.960  1.00  6.57           C
ATOM     95  O   LYS A   6       3.853   5.035   4.275  1.00  5.76           O
ATOM     96  CB  LYS A   6       2.107   7.194   5.577  1.00  7.45           C
ATOM     97  CG  LYS A   6       0.784   7.961   5.632  1.00 11.12           C
ATOM     98  CD  LYS A   6       0.662   8.682   6.976  1.00 14.54           C
ATOM     99  CE  LYS A   6      -0.613   9.508   7.159  1.00 18.84           C
ATOM    100  NZ  LYS A   6      -0.563  10.355   8.371  1.00 20.55           N
ATOM      0  H   LYS A   6       1.062   5.172   4.293  1.00  6.04           H   new
ATOM      0  HA  LYS A   6       2.235   7.714   3.506  1.00  6.12           H   new
ATOM      0  HB2 LYS A   6       2.067   6.307   6.209  1.00  7.45           H   new
ATOM      0  HB3 LYS A   6       2.928   7.810   5.944  1.00  7.45           H   new
ATOM      0  HG2 LYS A   6       0.736   8.682   4.816  1.00 11.12           H   new
ATOM      0  HG3 LYS A   6      -0.052   7.274   5.500  1.00 11.12           H   new
ATOM      0  HD2 LYS A   6       0.713   7.941   7.774  1.00 14.54           H   new
ATOM      0  HD3 LYS A   6       1.523   9.340   7.097  1.00 14.54           H   new
ATOM      0  HE2 LYS A   6      -0.763  10.139   6.283  1.00 18.84           H   new
ATOM      0  HE3 LYS A   6      -1.471   8.839   7.221  1.00 18.84           H   new
ATOM      0  HZ1 LYS A   6      -1.448  10.896   8.453  1.00 20.55           H   new
ATOM      0  HZ2 LYS A   6      -0.446   9.753   9.211  1.00 20.55           H   new
ATOM      0  HZ3 LYS A   6       0.240  11.013   8.302  1.00 20.55           H   new
ATOM    114  N   THR A   7       4.634   7.029   3.468  1.00  7.41           N
ATOM    115  CA  THR A   7       5.998   6.648   3.270  1.00  7.48           C
ATOM    116  C   THR A   7       6.766   6.638   4.547  1.00  8.75           C
ATOM    117  O   THR A   7       6.271   7.015   5.608  1.00  8.58           O
ATOM    118  CB  THR A   7       6.656   7.411   2.160  1.00  9.61           C
ATOM    119  OG1 THR A   7       7.092   8.701   2.563  1.00 11.78           O
ATOM    120  CG2 THR A   7       5.653   7.535   1.000  1.00  9.17           C
ATOM      0  H   THR A   7       4.443   7.994   3.197  1.00  7.41           H   new
ATOM      0  HA  THR A   7       5.997   5.613   2.927  1.00  7.48           H   new
ATOM      0  HB  THR A   7       7.548   6.865   1.853  1.00  9.61           H   new
ATOM      0  HG1 THR A   7       7.652   9.092   1.860  1.00 11.78           H   new
ATOM      0 HG21 THR A   7       6.112   8.088   0.180  1.00  9.17           H   new
ATOM      0 HG22 THR A   7       5.372   6.540   0.654  1.00  9.17           H   new
ATOM      0 HG23 THR A   7       4.764   8.065   1.343  1.00  9.17           H   new
ATOM    128  N   LEU A   8       8.006   6.119   4.507  1.00  9.84           N
ATOM    129  CA  LEU A   8       8.891   6.060   5.628  1.00 14.15           C
ATOM    130  C   LEU A   8       9.120   7.326   6.379  1.00 17.37           C
ATOM    131  O   LEU A   8       8.862   7.468   7.574  1.00 17.01           O
ATOM    132  CB  LEU A   8      10.222   5.494   5.105  1.00 16.63           C
ATOM    133  CG  LEU A   8      11.246   4.993   6.137  1.00 18.88           C
ATOM    134  CD1 LEU A   8      10.672   3.931   7.090  1.00 18.59           C
ATOM    135  CD2 LEU A   8      12.519   4.479   5.443  1.00 19.31           C
ATOM      0  H   LEU A   8       8.409   5.724   3.657  1.00  9.84           H   new
ATOM      0  HA  LEU A   8       8.409   5.430   6.375  1.00 14.15           H   new
ATOM      0  HB2 LEU A   8       9.993   4.667   4.433  1.00 16.63           H   new
ATOM      0  HB3 LEU A   8      10.702   6.268   4.506  1.00 16.63           H   new
ATOM      0  HG  LEU A   8      11.506   5.852   6.755  1.00 18.88           H   new
ATOM      0 HD11 LEU A   8      11.444   3.618   7.794  1.00 18.59           H   new
ATOM      0 HD12 LEU A   8       9.830   4.352   7.639  1.00 18.59           H   new
ATOM      0 HD13 LEU A   8      10.336   3.069   6.514  1.00 18.59           H   new
ATOM      0 HD21 LEU A   8      13.228   4.130   6.194  1.00 19.31           H   new
ATOM      0 HD22 LEU A   8      12.263   3.656   4.776  1.00 19.31           H   new
ATOM      0 HD23 LEU A   8      12.970   5.286   4.866  1.00 19.31           H   new
ATOM    147  N   THR A   9       9.575   8.375   5.672  1.00 18.33           N
ATOM    148  CA  THR A   9       9.842   9.644   6.275  1.00 19.24           C
ATOM    149  C   THR A   9       8.586  10.445   6.315  1.00 19.48           C
ATOM    150  O   THR A   9       8.041  10.616   7.404  1.00 23.14           O
ATOM    151  CB  THR A   9      10.919  10.421   5.578  1.00 18.97           C
ATOM    152  OG1 THR A   9      10.798  10.522   4.167  1.00 20.24           O
ATOM    153  CG2 THR A   9      12.278   9.787   5.919  1.00 19.70           C
ATOM      0  H   THR A   9       9.760   8.343   4.669  1.00 18.33           H   new
ATOM      0  HA  THR A   9      10.207   9.447   7.283  1.00 19.24           H   new
ATOM      0  HB  THR A   9      10.823  11.443   5.944  1.00 18.97           H   new
ATOM      0  HG1 THR A   9      11.545  11.047   3.811  1.00 20.24           H   new
ATOM      0 HG21 THR A   9      13.073  10.340   5.420  1.00 19.70           H   new
ATOM      0 HG22 THR A   9      12.435   9.820   6.997  1.00 19.70           H   new
ATOM      0 HG23 THR A   9      12.291   8.750   5.582  1.00 19.70           H   new
ATOM    161  N   GLY A  10       8.067  10.987   5.198  1.00 19.43           N
ATOM    162  CA  GLY A  10       7.100  12.038   5.133  1.00 18.74           C
ATOM    163  C   GLY A  10       6.516  12.391   3.808  1.00 17.62           C
ATOM    164  O   GLY A  10       6.461  13.563   3.438  1.00 19.74           O
ATOM      0  H   GLY A  10       8.346  10.665   4.271  1.00 19.43           H   new
ATOM      0  HA2 GLY A  10       6.277  11.772   5.797  1.00 18.74           H   new
ATOM      0  HA3 GLY A  10       7.561  12.937   5.541  1.00 18.74           H   new
ATOM    168  N   LYS A  11       6.035  11.472   2.951  1.00 13.56           N
ATOM    169  CA  LYS A  11       5.080  11.677   1.907  1.00 11.91           C
ATOM    170  C   LYS A  11       3.796  11.000   2.241  1.00 10.18           C
ATOM    171  O   LYS A  11       3.756   9.980   2.928  1.00  9.10           O
ATOM    172  CB  LYS A  11       5.709  11.275   0.563  1.00 13.43           C
ATOM    173  CG  LYS A  11       4.731  10.984  -0.578  1.00 16.69           C
ATOM    174  CD  LYS A  11       5.511  10.833  -1.886  1.00 17.92           C
ATOM    175  CE  LYS A  11       6.334  12.072  -2.243  1.00 20.81           C
ATOM    176  NZ  LYS A  11       6.490  11.969  -3.711  1.00 21.93           N
ATOM      0  H   LYS A  11       6.343  10.501   2.995  1.00 13.56           H   new
ATOM      0  HA  LYS A  11       4.816  12.730   1.809  1.00 11.91           H   new
ATOM      0  HB2 LYS A  11       6.379  12.074   0.245  1.00 13.43           H   new
ATOM      0  HB3 LYS A  11       6.323  10.389   0.723  1.00 13.43           H   new
ATOM      0  HG2 LYS A  11       4.170  10.073  -0.368  1.00 16.69           H   new
ATOM      0  HG3 LYS A  11       4.005  11.792  -0.665  1.00 16.69           H   new
ATOM      0  HD2 LYS A  11       6.176   9.973  -1.808  1.00 17.92           H   new
ATOM      0  HD3 LYS A  11       4.812  10.623  -2.696  1.00 17.92           H   new
ATOM      0  HE2 LYS A  11       5.822  12.991  -1.957  1.00 20.81           H   new
ATOM      0  HE3 LYS A  11       7.299  12.074  -1.736  1.00 20.81           H   new
ATOM      0  HZ1 LYS A  11       6.528  12.923  -4.124  1.00 21.93           H   new
ATOM      0  HZ2 LYS A  11       7.370  11.461  -3.932  1.00 21.93           H   new
ATOM      0  HZ3 LYS A  11       5.682  11.451  -4.110  1.00 21.93           H   new
ATOM    190  N   THR A  12       2.662  11.447   1.672  1.00  9.63           N
ATOM    191  CA  THR A  12       1.428  10.752   1.874  1.00  9.85           C
ATOM    192  C   THR A  12       0.911  10.570   0.489  1.00 11.66           C
ATOM    193  O   THR A  12       0.885  11.488  -0.329  1.00 12.33           O
ATOM    194  CB  THR A  12       0.420  11.490   2.704  1.00 10.85           C
ATOM    195  OG1 THR A  12       0.946  11.658   4.012  1.00 10.91           O
ATOM    196  CG2 THR A  12      -0.976  10.848   2.762  1.00  9.63           C
ATOM      0  H   THR A  12       2.598  12.276   1.081  1.00  9.63           H   new
ATOM      0  HA  THR A  12       1.597   9.831   2.431  1.00  9.85           H   new
ATOM      0  HB  THR A  12       0.257  12.449   2.212  1.00 10.85           H   new
ATOM      0  HG1 THR A  12       0.298  12.141   4.566  1.00 10.91           H   new
ATOM      0 HG21 THR A  12      -1.631  11.457   3.386  1.00  9.63           H   new
ATOM      0 HG22 THR A  12      -1.390  10.785   1.755  1.00  9.63           H   new
ATOM      0 HG23 THR A  12      -0.899   9.847   3.186  1.00  9.63           H   new
ATOM    204  N   ILE A  13       0.422   9.344   0.233  1.00 10.42           N
ATOM    205  CA  ILE A  13      -0.106   9.010  -1.054  1.00 11.84           C
ATOM    206  C   ILE A  13      -1.523   8.576  -0.899  1.00 10.55           C
ATOM    207  O   ILE A  13      -1.790   7.472  -0.428  1.00 11.92           O
ATOM    208  CB  ILE A  13       0.721   7.986  -1.774  1.00 14.86           C
ATOM    209  CG1 ILE A  13       2.238   8.209  -1.647  1.00 14.87           C
ATOM    210  CG2 ILE A  13       0.178   7.863  -3.207  1.00 17.08           C
ATOM    211  CD1 ILE A  13       3.047   7.140  -2.380  1.00 16.46           C
ATOM      0  H   ILE A  13       0.392   8.586   0.914  1.00 10.42           H   new
ATOM      0  HA  ILE A  13      -0.069   9.899  -1.683  1.00 11.84           H   new
ATOM      0  HB  ILE A  13       0.615   7.014  -1.293  1.00 14.86           H   new
ATOM      0 HG12 ILE A  13       2.493   9.191  -2.046  1.00 14.87           H   new
ATOM      0 HG13 ILE A  13       2.515   8.211  -0.593  1.00 14.87           H   new
ATOM      0 HG21 ILE A  13       0.762   7.124  -3.755  1.00 17.08           H   new
ATOM      0 HG22 ILE A  13      -0.866   7.550  -3.175  1.00 17.08           H   new
ATOM      0 HG23 ILE A  13       0.252   8.828  -3.708  1.00 17.08           H   new
ATOM      0 HD11 ILE A  13       4.111   7.343  -2.260  1.00 16.46           H   new
ATOM      0 HD12 ILE A  13       2.815   6.159  -1.964  1.00 16.46           H   new
ATOM      0 HD13 ILE A  13       2.793   7.154  -3.440  1.00 16.46           H   new
ATOM    223  N   THR A  14      -2.473   9.367  -1.428  1.00  9.39           N
ATOM    224  CA  THR A  14      -3.872   9.091  -1.318  1.00  9.63           C
ATOM    225  C   THR A  14      -4.346   8.222  -2.432  1.00 11.20           C
ATOM    226  O   THR A  14      -4.350   8.605  -3.601  1.00 11.63           O
ATOM    227  CB  THR A  14      -4.685  10.351  -1.357  1.00 10.38           C
ATOM    228  OG1 THR A  14      -4.264  11.230  -0.324  1.00 16.30           O
ATOM    229  CG2 THR A  14      -6.171  10.051  -1.097  1.00 11.66           C
ATOM      0  H   THR A  14      -2.263  10.221  -1.946  1.00  9.39           H   new
ATOM      0  HA  THR A  14      -4.005   8.585  -0.362  1.00  9.63           H   new
ATOM      0  HB  THR A  14      -4.549  10.796  -2.343  1.00 10.38           H   new
ATOM      0  HG1 THR A  14      -4.797  12.051  -0.356  1.00 16.30           H   new
ATOM      0 HG21 THR A  14      -6.741  10.980  -1.130  1.00 11.66           H   new
ATOM      0 HG22 THR A  14      -6.544   9.369  -1.861  1.00 11.66           H   new
ATOM      0 HG23 THR A  14      -6.283   9.591  -0.115  1.00 11.66           H   new
ATOM    237  N   LEU A  15      -4.629   6.949  -2.106  1.00  8.29           N
ATOM    238  CA  LEU A  15      -4.956   5.955  -3.081  1.00  9.03           C
ATOM    239  C   LEU A  15      -6.339   5.406  -3.158  1.00  8.59           C
ATOM    240  O   LEU A  15      -6.938   4.882  -2.220  1.00  7.79           O
ATOM    241  CB  LEU A  15      -3.984   4.763  -3.070  1.00 11.08           C
ATOM    242  CG  LEU A  15      -2.521   5.140  -3.360  1.00 15.79           C
ATOM    243  CD1 LEU A  15      -1.653   3.876  -3.236  1.00 15.27           C
ATOM    244  CD2 LEU A  15      -2.483   5.770  -4.762  1.00 15.88           C
ATOM      0  H   LEU A  15      -4.631   6.603  -1.147  1.00  8.29           H   new
ATOM      0  HA  LEU A  15      -4.862   6.580  -3.969  1.00  9.03           H   new
ATOM      0  HB2 LEU A  15      -4.036   4.275  -2.097  1.00 11.08           H   new
ATOM      0  HB3 LEU A  15      -4.313   4.033  -3.810  1.00 11.08           H   new
ATOM      0  HG  LEU A  15      -2.122   5.865  -2.651  1.00 15.79           H   new
ATOM      0 HD11 LEU A  15      -0.612   4.128  -3.439  1.00 15.27           H   new
ATOM      0 HD12 LEU A  15      -1.739   3.473  -2.227  1.00 15.27           H   new
ATOM      0 HD13 LEU A  15      -1.992   3.130  -3.954  1.00 15.27           H   new
ATOM      0 HD21 LEU A  15      -1.459   6.052  -5.006  1.00 15.88           H   new
ATOM      0 HD22 LEU A  15      -2.845   5.049  -5.495  1.00 15.88           H   new
ATOM      0 HD23 LEU A  15      -3.118   6.656  -4.780  1.00 15.88           H   new
ATOM    256  N   GLU A  16      -7.066   5.702  -4.250  1.00 11.04           N
ATOM    257  CA  GLU A  16      -8.435   5.315  -4.396  1.00 11.50           C
ATOM    258  C   GLU A  16      -8.567   3.918  -4.897  1.00 10.13           C
ATOM    259  O   GLU A  16      -7.993   3.484  -5.895  1.00  9.83           O
ATOM    260  CB  GLU A  16      -9.231   6.195  -5.374  1.00 17.22           C
ATOM    261  CG  GLU A  16     -10.738   5.939  -5.424  1.00 23.33           C
ATOM    262  CD  GLU A  16     -11.486   6.954  -6.275  1.00 26.99           C
ATOM    263  OE1 GLU A  16     -10.870   7.345  -7.302  1.00 28.86           O
ATOM    264  OE2 GLU A  16     -12.546   7.509  -5.878  1.00 28.90           O
ATOM      0  H   GLU A  16      -6.696   6.220  -5.047  1.00 11.04           H   new
ATOM      0  HA  GLU A  16      -8.841   5.424  -3.390  1.00 11.50           H   new
ATOM      0  HB2 GLU A  16      -9.068   7.240  -5.109  1.00 17.22           H   new
ATOM      0  HB3 GLU A  16      -8.824   6.053  -6.375  1.00 17.22           H   new
ATOM      0  HG2 GLU A  16     -10.918   4.939  -5.819  1.00 23.33           H   new
ATOM      0  HG3 GLU A  16     -11.138   5.958  -4.410  1.00 23.33           H   new
ATOM    271  N   VAL A  17      -9.187   3.063  -4.064  1.00  8.99           N
ATOM    272  CA  VAL A  17      -9.203   1.639  -4.194  1.00  8.85           C
ATOM    273  C   VAL A  17     -10.580   1.134  -3.931  1.00  8.04           C
ATOM    274  O   VAL A  17     -11.484   1.919  -3.651  1.00  8.99           O
ATOM    275  CB  VAL A  17      -8.203   0.931  -3.329  1.00  9.78           C
ATOM    276  CG1 VAL A  17      -6.788   1.465  -3.610  1.00 12.05           C
ATOM    277  CG2 VAL A  17      -8.423   1.165  -1.825  1.00 10.54           C
ATOM      0  H   VAL A  17      -9.709   3.387  -3.250  1.00  8.99           H   new
ATOM      0  HA  VAL A  17      -8.904   1.415  -5.218  1.00  8.85           H   new
ATOM      0  HB  VAL A  17      -8.323  -0.126  -3.567  1.00  9.78           H   new
ATOM      0 HG11 VAL A  17      -6.070   0.944  -2.977  1.00 12.05           H   new
ATOM      0 HG12 VAL A  17      -6.537   1.297  -4.657  1.00 12.05           H   new
ATOM      0 HG13 VAL A  17      -6.753   2.533  -3.396  1.00 12.05           H   new
ATOM      0 HG21 VAL A  17      -7.665   0.624  -1.258  1.00 10.54           H   new
ATOM      0 HG22 VAL A  17      -8.347   2.230  -1.608  1.00 10.54           H   new
ATOM      0 HG23 VAL A  17      -9.413   0.806  -1.542  1.00 10.54           H   new
ATOM    287  N   GLU A  18     -10.875  -0.175  -4.032  1.00  7.29           N
ATOM    288  CA  GLU A  18     -12.063  -0.820  -3.565  1.00  7.08           C
ATOM    289  C   GLU A  18     -11.719  -1.823  -2.518  1.00  6.45           C
ATOM    290  O   GLU A  18     -10.583  -2.290  -2.578  1.00  5.28           O
ATOM    291  CB  GLU A  18     -12.811  -1.551  -4.692  1.00 10.28           C
ATOM    292  CG  GLU A  18     -12.267  -2.870  -5.243  1.00 12.65           C
ATOM    293  CD  GLU A  18     -13.084  -3.206  -6.482  1.00 14.15           C
ATOM    294  OE1 GLU A  18     -13.384  -2.331  -7.339  1.00 18.17           O
ATOM    295  OE2 GLU A  18     -13.537  -4.380  -6.549  1.00 14.33           O
ATOM      0  H   GLU A  18     -10.232  -0.832  -4.475  1.00  7.29           H   new
ATOM      0  HA  GLU A  18     -12.708  -0.038  -3.165  1.00  7.08           H   new
ATOM      0  HB2 GLU A  18     -13.824  -1.741  -4.338  1.00 10.28           H   new
ATOM      0  HB3 GLU A  18     -12.891  -0.858  -5.530  1.00 10.28           H   new
ATOM      0  HG2 GLU A  18     -11.210  -2.777  -5.492  1.00 12.65           H   new
ATOM      0  HG3 GLU A  18     -12.351  -3.662  -4.499  1.00 12.65           H   new
ATOM    302  N   PRO A  19     -12.554  -2.306  -1.647  1.00  7.24           N
ATOM    303  CA  PRO A  19     -12.190  -3.043  -0.471  1.00  7.07           C
ATOM    304  C   PRO A  19     -11.880  -4.456  -0.828  1.00  6.65           C
ATOM    305  O   PRO A  19     -11.413  -5.233   0.004  1.00  6.37           O
ATOM    306  CB  PRO A  19     -13.428  -2.946   0.417  1.00  7.61           C
ATOM    307  CG  PRO A  19     -14.583  -2.674  -0.559  1.00  8.16           C
ATOM    308  CD  PRO A  19     -13.859  -1.684  -1.484  1.00  7.49           C
ATOM      0  HA  PRO A  19     -11.300  -2.657   0.025  1.00  7.07           H   new
ATOM      0  HB2 PRO A  19     -13.589  -3.868   0.975  1.00  7.61           H   new
ATOM      0  HB3 PRO A  19     -13.330  -2.144   1.149  1.00  7.61           H   new
ATOM      0  HG2 PRO A  19     -14.920  -3.571  -1.078  1.00  8.16           H   new
ATOM      0  HG3 PRO A  19     -15.456  -2.240  -0.073  1.00  8.16           H   new
ATOM      0  HD2 PRO A  19     -14.375  -1.567  -2.437  1.00  7.49           H   new
ATOM      0  HD3 PRO A  19     -13.784  -0.692  -1.038  1.00  7.49           H   new
ATOM    316  N   SER A  20     -12.094  -4.902  -2.078  1.00  6.80           N
ATOM    317  CA  SER A  20     -11.747  -6.167  -2.648  1.00  6.28           C
ATOM    318  C   SER A  20     -10.387  -6.235  -3.253  1.00  8.45           C
ATOM    319  O   SER A  20      -9.971  -7.321  -3.653  1.00  7.26           O
ATOM    320  CB  SER A  20     -12.744  -6.606  -3.733  1.00  8.57           C
ATOM    321  OG  SER A  20     -14.101  -6.637  -3.315  1.00 11.13           O
ATOM      0  H   SER A  20     -12.562  -4.308  -2.763  1.00  6.80           H   new
ATOM      0  HA  SER A  20     -11.773  -6.835  -1.787  1.00  6.28           H   new
ATOM      0  HB2 SER A  20     -12.655  -5.930  -4.583  1.00  8.57           H   new
ATOM      0  HB3 SER A  20     -12.464  -7.599  -4.085  1.00  8.57           H   new
ATOM      0  HG  SER A  20     -14.667  -6.924  -4.062  1.00 11.13           H   new
ATOM    327  N   ASP A  21      -9.667  -5.103  -3.353  1.00  7.50           N
ATOM    328  CA  ASP A  21      -8.402  -5.106  -4.020  1.00  7.70           C
ATOM    329  C   ASP A  21      -7.354  -5.852  -3.267  1.00  7.08           C
ATOM    330  O   ASP A  21      -7.589  -6.214  -2.116  1.00  8.11           O
ATOM    331  CB  ASP A  21      -7.939  -3.685  -4.383  1.00 11.00           C
ATOM    332  CG  ASP A  21      -8.749  -3.069  -5.514  1.00 15.32           C
ATOM    333  OD1 ASP A  21      -8.992  -3.804  -6.509  1.00 18.03           O
ATOM    334  OD2 ASP A  21      -9.129  -1.869  -5.463  1.00 14.36           O
ATOM      0  H   ASP A  21      -9.955  -4.199  -2.978  1.00  7.50           H   new
ATOM      0  HA  ASP A  21      -8.554  -5.647  -4.954  1.00  7.70           H   new
ATOM      0  HB2 ASP A  21      -8.013  -3.048  -3.501  1.00 11.00           H   new
ATOM      0  HB3 ASP A  21      -6.888  -3.713  -4.669  1.00 11.00           H   new
ATOM    339  N   THR A  22      -6.173  -6.124  -3.851  1.00  5.37           N
ATOM    340  CA  THR A  22      -5.067  -6.833  -3.286  1.00  6.01           C
ATOM    341  C   THR A  22      -3.971  -5.868  -2.991  1.00  8.01           C
ATOM    342  O   THR A  22      -3.937  -4.799  -3.599  1.00  8.11           O
ATOM    343  CB  THR A  22      -4.562  -7.951  -4.149  1.00  8.92           C
ATOM    344  OG1 THR A  22      -4.479  -7.545  -5.507  1.00 10.22           O
ATOM    345  CG2 THR A  22      -5.687  -8.999  -4.175  1.00  9.65           C
ATOM      0  H   THR A  22      -5.977  -5.819  -4.804  1.00  5.37           H   new
ATOM      0  HA  THR A  22      -5.422  -7.305  -2.370  1.00  6.01           H   new
ATOM      0  HB  THR A  22      -3.597  -8.285  -3.769  1.00  8.92           H   new
ATOM      0  HG1 THR A  22      -4.146  -8.289  -6.051  1.00 10.22           H   new
ATOM      0 HG21 THR A  22      -5.382  -9.845  -4.791  1.00  9.65           H   new
ATOM      0 HG22 THR A  22      -5.888  -9.342  -3.160  1.00  9.65           H   new
ATOM      0 HG23 THR A  22      -6.590  -8.553  -4.593  1.00  9.65           H   new
ATOM    353  N   ILE A  23      -2.960  -6.239  -2.186  1.00  8.32           N
ATOM    354  CA  ILE A  23      -1.778  -5.486  -1.903  1.00  9.92           C
ATOM    355  C   ILE A  23      -1.035  -5.111  -3.139  1.00 10.01           C
ATOM    356  O   ILE A  23      -0.697  -3.943  -3.324  1.00  8.71           O
ATOM    357  CB  ILE A  23      -0.892  -6.185  -0.914  1.00 10.78           C
ATOM    358  CG1 ILE A  23      -1.626  -6.660   0.352  1.00 11.38           C
ATOM    359  CG2 ILE A  23       0.265  -5.282  -0.455  1.00 10.90           C
ATOM    360  CD1 ILE A  23      -2.543  -5.660   1.056  1.00 12.30           C
ATOM      0  H   ILE A  23      -2.971  -7.134  -1.696  1.00  8.32           H   new
ATOM      0  HA  ILE A  23      -2.107  -4.556  -1.440  1.00  9.92           H   new
ATOM      0  HB  ILE A  23      -0.523  -7.056  -1.455  1.00 10.78           H   new
ATOM      0 HG12 ILE A  23      -2.222  -7.533   0.087  1.00 11.38           H   new
ATOM      0 HG13 ILE A  23      -0.876  -6.992   1.070  1.00 11.38           H   new
ATOM      0 HG21 ILE A  23       0.886  -5.821   0.261  1.00 10.90           H   new
ATOM      0 HG22 ILE A  23       0.869  -4.998  -1.317  1.00 10.90           H   new
ATOM      0 HG23 ILE A  23      -0.138  -4.386   0.017  1.00 10.90           H   new
ATOM      0 HD11 ILE A  23      -2.992  -6.131   1.930  1.00 12.30           H   new
ATOM      0 HD12 ILE A  23      -1.963  -4.792   1.370  1.00 12.30           H   new
ATOM      0 HD13 ILE A  23      -3.329  -5.342   0.371  1.00 12.30           H   new
ATOM    372  N   GLU A  24      -0.839  -6.091  -4.039  1.00  9.54           N
ATOM    373  CA  GLU A  24      -0.208  -6.003  -5.319  1.00 11.81           C
ATOM    374  C   GLU A  24      -0.855  -5.081  -6.295  1.00 11.14           C
ATOM    375  O   GLU A  24      -0.126  -4.369  -6.984  1.00 10.62           O
ATOM    376  CB  GLU A  24      -0.069  -7.367  -6.016  1.00 19.24           C
ATOM    377  CG  GLU A  24       0.595  -7.536  -7.383  1.00 27.76           C
ATOM    378  CD  GLU A  24       0.495  -8.991  -7.820  1.00 32.92           C
ATOM    379  OE1 GLU A  24      -0.643  -9.454  -8.099  1.00 34.80           O
ATOM    380  OE2 GLU A  24       1.527  -9.713  -7.853  1.00 36.51           O
ATOM      0  H   GLU A  24      -1.156  -7.041  -3.848  1.00  9.54           H   new
ATOM      0  HA  GLU A  24       0.767  -5.593  -5.055  1.00 11.81           H   new
ATOM      0  HB2 GLU A  24       0.473  -8.014  -5.326  1.00 19.24           H   new
ATOM      0  HB3 GLU A  24      -1.077  -7.772  -6.108  1.00 19.24           H   new
ATOM      0  HG2 GLU A  24       0.111  -6.891  -8.116  1.00 27.76           H   new
ATOM      0  HG3 GLU A  24       1.640  -7.232  -7.331  1.00 27.76           H   new
ATOM    387  N   ASN A  25      -2.184  -4.873  -6.328  1.00  9.43           N
ATOM    388  CA  ASN A  25      -2.836  -3.769  -6.963  1.00 10.96           C
ATOM    389  C   ASN A  25      -2.585  -2.437  -6.344  1.00  9.68           C
ATOM    390  O   ASN A  25      -2.295  -1.450  -7.018  1.00  9.33           O
ATOM    391  CB  ASN A  25      -4.340  -4.081  -7.045  1.00 16.78           C
ATOM    392  CG  ASN A  25      -5.085  -3.271  -8.096  1.00 22.31           C
ATOM    393  OD1 ASN A  25      -5.501  -2.137  -7.865  1.00 25.66           O
ATOM    394  ND2 ASN A  25      -5.315  -3.881  -9.290  1.00 24.70           N
ATOM      0  H   ASN A  25      -2.842  -5.514  -5.885  1.00  9.43           H   new
ATOM      0  HA  ASN A  25      -2.400  -3.670  -7.957  1.00 10.96           H   new
ATOM      0  HB2 ASN A  25      -4.469  -5.142  -7.260  1.00 16.78           H   new
ATOM      0  HB3 ASN A  25      -4.792  -3.896  -6.071  1.00 16.78           H   new
ATOM      0 HD21 ASN A  25      -5.843  -3.397 -10.017  1.00 24.70           H   new
ATOM      0 HD22 ASN A  25      -4.960  -4.822  -9.459  1.00 24.70           H   new
ATOM    401  N   VAL A  26      -2.611  -2.313  -5.005  1.00  6.52           N
ATOM    402  CA  VAL A  26      -2.255  -1.079  -4.377  1.00  5.53           C
ATOM    403  C   VAL A  26      -0.821  -0.722  -4.566  1.00  4.42           C
ATOM    404  O   VAL A  26      -0.555   0.477  -4.636  1.00  3.40           O
ATOM    405  CB  VAL A  26      -2.688  -1.148  -2.942  1.00  3.86           C
ATOM    406  CG1 VAL A  26      -2.452   0.173  -2.191  1.00  7.25           C
ATOM    407  CG2 VAL A  26      -4.203  -1.401  -3.011  1.00  8.12           C
ATOM      0  H   VAL A  26      -2.876  -3.060  -4.362  1.00  6.52           H   new
ATOM      0  HA  VAL A  26      -2.779  -0.253  -4.858  1.00  5.53           H   new
ATOM      0  HB  VAL A  26      -2.125  -1.915  -2.411  1.00  3.86           H   new
ATOM      0 HG11 VAL A  26      -2.783   0.068  -1.158  1.00  7.25           H   new
ATOM      0 HG12 VAL A  26      -1.390   0.417  -2.209  1.00  7.25           H   new
ATOM      0 HG13 VAL A  26      -3.016   0.971  -2.673  1.00  7.25           H   new
ATOM      0 HG21 VAL A  26      -4.607  -1.466  -2.001  1.00  8.12           H   new
ATOM      0 HG22 VAL A  26      -4.685  -0.581  -3.543  1.00  8.12           H   new
ATOM      0 HG23 VAL A  26      -4.392  -2.336  -3.539  1.00  8.12           H   new
ATOM    417  N   LYS A  27       0.140  -1.651  -4.719  1.00  2.64           N
ATOM    418  CA  LYS A  27       1.528  -1.444  -4.995  1.00  4.14           C
ATOM    419  C   LYS A  27       1.719  -1.004  -6.406  1.00  5.58           C
ATOM    420  O   LYS A  27       2.534  -0.099  -6.574  1.00  4.11           O
ATOM    421  CB  LYS A  27       2.378  -2.671  -4.626  1.00  3.97           C
ATOM    422  CG  LYS A  27       2.479  -2.918  -3.119  1.00  7.45           C
ATOM    423  CD  LYS A  27       3.497  -3.940  -2.607  1.00  9.02           C
ATOM    424  CE  LYS A  27       3.432  -5.344  -3.211  1.00 12.90           C
ATOM    425  NZ  LYS A  27       4.728  -5.985  -2.892  1.00 15.47           N
ATOM      0  H   LYS A  27      -0.079  -2.644  -4.641  1.00  2.64           H   new
ATOM      0  HA  LYS A  27       1.888  -0.638  -4.356  1.00  4.14           H   new
ATOM      0  HB2 LYS A  27       1.952  -3.554  -5.102  1.00  3.97           H   new
ATOM      0  HB3 LYS A  27       3.381  -2.543  -5.032  1.00  3.97           H   new
ATOM      0  HG2 LYS A  27       2.701  -1.963  -2.642  1.00  7.45           H   new
ATOM      0  HG3 LYS A  27       1.495  -3.228  -2.768  1.00  7.45           H   new
ATOM      0  HD2 LYS A  27       4.496  -3.541  -2.783  1.00  9.02           H   new
ATOM      0  HD3 LYS A  27       3.375  -4.029  -1.528  1.00  9.02           H   new
ATOM      0  HE2 LYS A  27       2.602  -5.912  -2.791  1.00 12.90           H   new
ATOM      0  HE3 LYS A  27       3.274  -5.298  -4.288  1.00 12.90           H   new
ATOM      0  HZ1 LYS A  27       5.307  -6.045  -3.754  1.00 15.47           H   new
ATOM      0  HZ2 LYS A  27       5.229  -5.419  -2.177  1.00 15.47           H   new
ATOM      0  HZ3 LYS A  27       4.560  -6.942  -2.520  1.00 15.47           H   new
ATOM    439  N   ALA A  28       0.912  -1.484  -7.369  1.00  6.61           N
ATOM    440  CA  ALA A  28       0.777  -1.048  -8.725  1.00  7.74           C
ATOM    441  C   ALA A  28       0.358   0.370  -8.911  1.00  9.17           C
ATOM    442  O   ALA A  28       0.854   1.007  -9.839  1.00 11.45           O
ATOM    443  CB  ALA A  28      -0.217  -1.935  -9.493  1.00  7.68           C
ATOM      0  H   ALA A  28       0.286  -2.265  -7.172  1.00  6.61           H   new
ATOM      0  HA  ALA A  28       1.790  -1.133  -9.118  1.00  7.74           H   new
ATOM      0  HB1 ALA A  28      -0.301  -1.582 -10.521  1.00  7.68           H   new
ATOM      0  HB2 ALA A  28       0.138  -2.965  -9.491  1.00  7.68           H   new
ATOM      0  HB3 ALA A  28      -1.194  -1.887  -9.012  1.00  7.68           H   new
ATOM    449  N   LYS A  29      -0.498   0.970  -8.065  1.00  8.96           N
ATOM    450  CA  LYS A  29      -0.749   2.366  -7.880  1.00  7.90           C
ATOM    451  C   LYS A  29       0.413   3.220  -7.505  1.00  6.92           C
ATOM    452  O   LYS A  29       0.709   4.261  -8.089  1.00  6.87           O
ATOM    453  CB  LYS A  29      -2.002   2.552  -7.007  1.00 10.28           C
ATOM    454  CG  LYS A  29      -3.207   2.518  -7.949  1.00 14.94           C
ATOM    455  CD  LYS A  29      -4.546   2.443  -7.212  1.00 19.69           C
ATOM    456  CE  LYS A  29      -5.704   2.186  -8.179  1.00 22.63           C
ATOM    457  NZ  LYS A  29      -7.009   1.881  -7.550  1.00 24.98           N
ATOM      0  H   LYS A  29      -1.079   0.410  -7.441  1.00  8.96           H   new
ATOM      0  HA  LYS A  29      -0.951   2.771  -8.871  1.00  7.90           H   new
ATOM      0  HB2 LYS A  29      -2.073   1.762  -6.260  1.00 10.28           H   new
ATOM      0  HB3 LYS A  29      -1.960   3.498  -6.467  1.00 10.28           H   new
ATOM      0  HG2 LYS A  29      -3.195   3.409  -8.577  1.00 14.94           H   new
ATOM      0  HG3 LYS A  29      -3.117   1.659  -8.613  1.00 14.94           H   new
ATOM      0  HD2 LYS A  29      -4.509   1.648  -6.467  1.00 19.69           H   new
ATOM      0  HD3 LYS A  29      -4.719   3.375  -6.674  1.00 19.69           H   new
ATOM      0  HE2 LYS A  29      -5.824   3.063  -8.815  1.00 22.63           H   new
ATOM      0  HE3 LYS A  29      -5.432   1.355  -8.830  1.00 22.63           H   new
ATOM      0  HZ1 LYS A  29      -7.769   2.007  -8.249  1.00 24.98           H   new
ATOM      0  HZ2 LYS A  29      -7.010   0.898  -7.211  1.00 24.98           H   new
ATOM      0  HZ3 LYS A  29      -7.166   2.524  -6.748  1.00 24.98           H   new
ATOM    471  N   ILE A  30       1.167   2.855  -6.453  1.00  4.57           N
ATOM    472  CA  ILE A  30       2.377   3.500  -6.046  1.00  5.58           C
ATOM    473  C   ILE A  30       3.442   3.471  -7.087  1.00  7.26           C
ATOM    474  O   ILE A  30       4.217   4.417  -7.220  1.00  9.46           O
ATOM    475  CB  ILE A  30       3.013   2.826  -4.866  1.00  5.36           C
ATOM    476  CG1 ILE A  30       2.066   2.829  -3.655  1.00  2.94           C
ATOM    477  CG2 ILE A  30       4.286   3.571  -4.429  1.00  2.78           C
ATOM    478  CD1 ILE A  30       2.426   1.798  -2.586  1.00  2.00           C
ATOM      0  H   ILE A  30       0.919   2.067  -5.854  1.00  4.57           H   new
ATOM      0  HA  ILE A  30       2.053   4.518  -5.828  1.00  5.58           H   new
ATOM      0  HB  ILE A  30       3.244   1.807  -5.177  1.00  5.36           H   new
ATOM      0 HG12 ILE A  30       2.071   3.822  -3.205  1.00  2.94           H   new
ATOM      0 HG13 ILE A  30       1.050   2.640  -4.000  1.00  2.94           H   new
ATOM      0 HG21 ILE A  30       4.729   3.063  -3.572  1.00  2.78           H   new
ATOM      0 HG22 ILE A  30       5.001   3.584  -5.252  1.00  2.78           H   new
ATOM      0 HG23 ILE A  30       4.032   4.594  -4.153  1.00  2.78           H   new
ATOM      0 HD11 ILE A  30       1.713   1.861  -1.764  1.00  2.00           H   new
ATOM      0 HD12 ILE A  30       2.393   0.798  -3.019  1.00  2.00           H   new
ATOM      0 HD13 ILE A  30       3.430   1.998  -2.211  1.00  2.00           H   new
ATOM    490  N   GLN A  31       3.540   2.310  -7.759  1.00  7.06           N
ATOM    491  CA  GLN A  31       4.338   2.127  -8.932  1.00  8.67           C
ATOM    492  C   GLN A  31       4.076   3.178  -9.955  1.00 10.90           C
ATOM    493  O   GLN A  31       4.934   3.766 -10.611  1.00  9.63           O
ATOM    494  CB  GLN A  31       4.279   0.679  -9.446  1.00  9.12           C
ATOM    495  CG  GLN A  31       5.192   0.470 -10.656  1.00 10.76           C
ATOM    496  CD  GLN A  31       5.327  -0.944 -11.203  1.00 13.78           C
ATOM    497  OE1 GLN A  31       6.444  -1.429 -11.376  1.00 14.48           O
ATOM    498  NE2 GLN A  31       4.177  -1.650 -11.374  1.00 14.76           N
ATOM      0  H   GLN A  31       3.044   1.465  -7.474  1.00  7.06           H   new
ATOM      0  HA  GLN A  31       5.383   2.274  -8.660  1.00  8.67           H   new
ATOM      0  HB2 GLN A  31       4.572  -0.003  -8.647  1.00  9.12           H   new
ATOM      0  HB3 GLN A  31       3.253   0.431  -9.717  1.00  9.12           H   new
ATOM      0  HG2 GLN A  31       4.832   1.109 -11.462  1.00 10.76           H   new
ATOM      0  HG3 GLN A  31       6.188   0.823 -10.390  1.00 10.76           H   new
ATOM      0 HE21 GLN A  31       3.275  -1.201 -11.218  1.00 14.76           H   new
ATOM      0 HE22 GLN A  31       4.217  -2.629 -11.659  1.00 14.76           H   new
ATOM    507  N   ASP A  32       2.796   3.442 -10.273  1.00 10.93           N
ATOM    508  CA  ASP A  32       2.518   4.425 -11.273  1.00 14.01           C
ATOM    509  C   ASP A  32       2.900   5.831 -10.962  1.00 14.04           C
ATOM    510  O   ASP A  32       3.562   6.570 -11.690  1.00 13.39           O
ATOM    511  CB  ASP A  32       1.006   4.380 -11.551  1.00 18.01           C
ATOM    512  CG  ASP A  32       0.656   4.526 -13.025  1.00 24.33           C
ATOM    513  OD1 ASP A  32       0.775   3.568 -13.835  1.00 26.29           O
ATOM    514  OD2 ASP A  32       0.313   5.688 -13.373  1.00 25.17           O
ATOM      0  H   ASP A  32       1.980   2.994  -9.856  1.00 10.93           H   new
ATOM      0  HA  ASP A  32       3.142   4.159 -12.126  1.00 14.01           H   new
ATOM      0  HB2 ASP A  32       0.605   3.436 -11.182  1.00 18.01           H   new
ATOM      0  HB3 ASP A  32       0.517   5.176 -10.989  1.00 18.01           H   new
ATOM    519  N   LYS A  33       2.514   6.198  -9.727  1.00 14.22           N
ATOM    520  CA  LYS A  33       2.749   7.473  -9.124  1.00 14.00           C
ATOM    521  C   LYS A  33       4.184   7.815  -8.916  1.00 12.37           C
ATOM    522  O   LYS A  33       4.745   8.611  -9.667  1.00 12.17           O
ATOM    523  CB  LYS A  33       1.914   7.729  -7.858  1.00 18.62           C
ATOM    524  CG  LYS A  33       0.504   8.165  -8.260  1.00 24.00           C
ATOM    525  CD  LYS A  33      -0.348   8.499  -7.034  1.00 27.61           C
ATOM    526  CE  LYS A  33      -1.859   8.572  -7.261  1.00 27.64           C
ATOM    527  NZ  LYS A  33      -2.046   9.792  -8.078  1.00 30.06           N
ATOM      0  H   LYS A  33       2.006   5.563  -9.111  1.00 14.22           H   new
ATOM      0  HA  LYS A  33       2.390   8.168  -9.883  1.00 14.00           H   new
ATOM      0  HB2 LYS A  33       1.868   6.825  -7.250  1.00 18.62           H   new
ATOM      0  HB3 LYS A  33       2.385   8.500  -7.248  1.00 18.62           H   new
ATOM      0  HG2 LYS A  33       0.563   9.036  -8.912  1.00 24.00           H   new
ATOM      0  HG3 LYS A  33       0.025   7.370  -8.832  1.00 24.00           H   new
ATOM      0  HD2 LYS A  33      -0.153   7.750  -6.267  1.00 27.61           H   new
ATOM      0  HD3 LYS A  33      -0.015   9.457  -6.636  1.00 27.61           H   new
ATOM      0  HE2 LYS A  33      -2.227   7.686  -7.779  1.00 27.64           H   new
ATOM      0  HE3 LYS A  33      -2.401   8.638  -6.317  1.00 27.64           H   new
ATOM      0  HZ1 LYS A  33      -2.884  10.309  -7.743  1.00 30.06           H   new
ATOM      0  HZ2 LYS A  33      -1.206  10.400  -7.992  1.00 30.06           H   new
ATOM      0  HZ3 LYS A  33      -2.179   9.525  -9.074  1.00 30.06           H   new
ATOM    541  N   GLU A  34       4.789   7.322  -7.820  1.00 10.11           N
ATOM    542  CA  GLU A  34       6.162   7.472  -7.450  1.00 10.07           C
ATOM    543  C   GLU A  34       7.116   6.937  -8.462  1.00  9.32           C
ATOM    544  O   GLU A  34       7.895   7.685  -9.051  1.00 11.61           O
ATOM    545  CB  GLU A  34       6.396   6.899  -6.042  1.00 14.77           C
ATOM    546  CG  GLU A  34       5.734   7.594  -4.852  1.00 18.75           C
ATOM    547  CD  GLU A  34       6.089   9.073  -4.795  1.00 22.28           C
ATOM    548  OE1 GLU A  34       7.300   9.347  -4.583  1.00 21.95           O
ATOM    549  OE2 GLU A  34       5.183   9.908  -5.058  1.00 25.19           O
ATOM      0  H   GLU A  34       4.271   6.771  -7.135  1.00 10.11           H   new
ATOM      0  HA  GLU A  34       6.376   8.540  -7.421  1.00 10.07           H   new
ATOM      0  HB2 GLU A  34       6.063   5.861  -6.047  1.00 14.77           H   new
ATOM      0  HB3 GLU A  34       7.471   6.888  -5.863  1.00 14.77           H   new
ATOM      0  HG2 GLU A  34       4.652   7.482  -4.921  1.00 18.75           H   new
ATOM      0  HG3 GLU A  34       6.046   7.109  -3.927  1.00 18.75           H   new
ATOM    556  N   GLY A  35       7.103   5.613  -8.702  1.00  7.22           N
ATOM    557  CA  GLY A  35       8.050   4.893  -9.495  1.00  6.29           C
ATOM    558  C   GLY A  35       8.764   3.925  -8.615  1.00  6.93           C
ATOM    559  O   GLY A  35       9.985   3.953  -8.469  1.00  7.41           O
ATOM      0  H   GLY A  35       6.381   5.006  -8.315  1.00  7.22           H   new
ATOM      0  HA2 GLY A  35       7.544   4.367 -10.305  1.00  6.29           H   new
ATOM      0  HA3 GLY A  35       8.759   5.581  -9.956  1.00  6.29           H   new
ATOM    563  N   ILE A  36       8.021   2.969  -8.029  1.00  5.86           N
ATOM    564  CA  ILE A  36       8.541   1.923  -7.204  1.00  6.07           C
ATOM    565  C   ILE A  36       8.107   0.558  -7.615  1.00  6.36           C
ATOM    566  O   ILE A  36       6.893   0.372  -7.552  1.00  6.18           O
ATOM    567  CB  ILE A  36       8.153   2.157  -5.774  1.00  7.47           C
ATOM    568  CG1 ILE A  36       8.425   3.566  -5.221  1.00  8.52           C
ATOM    569  CG2 ILE A  36       8.957   1.198  -4.879  1.00  7.36           C
ATOM    570  CD1 ILE A  36       7.825   3.775  -3.832  1.00  9.49           C
ATOM      0  H   ILE A  36       7.008   2.924  -8.136  1.00  5.86           H   new
ATOM      0  HA  ILE A  36       9.624   1.957  -7.323  1.00  6.07           H   new
ATOM      0  HB  ILE A  36       7.074   2.003  -5.761  1.00  7.47           H   new
ATOM      0 HG12 ILE A  36       9.501   3.734  -5.178  1.00  8.52           H   new
ATOM      0 HG13 ILE A  36       8.014   4.307  -5.906  1.00  8.52           H   new
ATOM      0 HG21 ILE A  36       8.684   1.358  -3.836  1.00  7.36           H   new
ATOM      0 HG22 ILE A  36       8.735   0.168  -5.158  1.00  7.36           H   new
ATOM      0 HG23 ILE A  36      10.023   1.387  -5.008  1.00  7.36           H   new
ATOM      0 HD11 ILE A  36       8.046   4.786  -3.488  1.00  9.49           H   new
ATOM      0 HD12 ILE A  36       6.745   3.635  -3.877  1.00  9.49           H   new
ATOM      0 HD13 ILE A  36       8.255   3.053  -3.137  1.00  9.49           H   new
ATOM    582  N   PRO A  37       8.898  -0.365  -8.074  1.00  8.65           N
ATOM    583  CA  PRO A  37       8.358  -1.592  -8.583  1.00  9.18           C
ATOM    584  C   PRO A  37       7.856  -2.511  -7.524  1.00  9.85           C
ATOM    585  O   PRO A  37       8.380  -2.494  -6.411  1.00  8.51           O
ATOM    586  CB  PRO A  37       9.558  -2.236  -9.275  1.00 11.42           C
ATOM    587  CG  PRO A  37      10.645  -1.164  -9.453  1.00  9.27           C
ATOM    588  CD  PRO A  37      10.230  -0.004  -8.535  1.00  8.33           C
ATOM      0  HA  PRO A  37       7.497  -1.401  -9.223  1.00  9.18           H   new
ATOM      0  HB2 PRO A  37       9.938  -3.067  -8.681  1.00 11.42           H   new
ATOM      0  HB3 PRO A  37       9.265  -2.644 -10.242  1.00 11.42           H   new
ATOM      0  HG2 PRO A  37      11.626  -1.551  -9.178  1.00  9.27           H   new
ATOM      0  HG3 PRO A  37      10.710  -0.839 -10.491  1.00  9.27           H   new
ATOM      0  HD2 PRO A  37      10.922   0.109  -7.700  1.00  8.33           H   new
ATOM      0  HD3 PRO A  37      10.221   0.944  -9.072  1.00  8.33           H   new
ATOM    596  N   PRO A  38       6.898  -3.385  -7.618  1.00  8.71           N
ATOM    597  CA  PRO A  38       6.204  -4.093  -6.582  1.00  9.08           C
ATOM    598  C   PRO A  38       7.019  -4.931  -5.658  1.00  9.28           C
ATOM    599  O   PRO A  38       6.739  -5.057  -4.467  1.00  6.50           O
ATOM    600  CB  PRO A  38       5.118  -4.978  -7.190  1.00 10.31           C
ATOM    601  CG  PRO A  38       4.761  -4.147  -8.433  1.00 10.81           C
ATOM    602  CD  PRO A  38       6.014  -3.323  -8.771  1.00 12.00           C
ATOM      0  HA  PRO A  38       5.807  -3.289  -5.961  1.00  9.08           H   new
ATOM      0  HB2 PRO A  38       5.485  -5.972  -7.445  1.00 10.31           H   new
ATOM      0  HB3 PRO A  38       4.268  -5.114  -6.521  1.00 10.31           H   new
ATOM      0  HG2 PRO A  38       4.483  -4.792  -9.266  1.00 10.81           H   new
ATOM      0  HG3 PRO A  38       3.909  -3.497  -8.235  1.00 10.81           H   new
ATOM      0  HD2 PRO A  38       6.509  -3.722  -9.656  1.00 12.00           H   new
ATOM      0  HD3 PRO A  38       5.746  -2.290  -8.994  1.00 12.00           H   new
ATOM    610  N   ASP A  39       8.087  -5.551  -6.191  1.00 11.20           N
ATOM    611  CA  ASP A  39       8.939  -6.455  -5.482  1.00 14.96           C
ATOM    612  C   ASP A  39       9.828  -5.725  -4.535  1.00 13.99           C
ATOM    613  O   ASP A  39      10.176  -6.286  -3.498  1.00 13.75           O
ATOM    614  CB  ASP A  39       9.611  -7.513  -6.372  1.00 24.16           C
ATOM    615  CG  ASP A  39       8.546  -8.224  -7.194  1.00 31.06           C
ATOM    616  OD1 ASP A  39       7.584  -8.790  -6.610  1.00 34.22           O
ATOM    617  OD2 ASP A  39       8.563  -8.107  -8.449  1.00 35.55           O
ATOM      0  H   ASP A  39       8.370  -5.416  -7.162  1.00 11.20           H   new
ATOM      0  HA  ASP A  39       8.308  -7.080  -4.850  1.00 14.96           H   new
ATOM      0  HB2 ASP A  39      10.341  -7.042  -7.030  1.00 24.16           H   new
ATOM      0  HB3 ASP A  39      10.153  -8.232  -5.757  1.00 24.16           H   new
ATOM    622  N   GLN A  40      10.027  -4.422  -4.805  1.00 11.60           N
ATOM    623  CA  GLN A  40      10.798  -3.525  -4.002  1.00 10.76           C
ATOM    624  C   GLN A  40      10.091  -3.038  -2.784  1.00  8.01           C
ATOM    625  O   GLN A  40      10.588  -2.759  -1.694  1.00  8.96           O
ATOM    626  CB  GLN A  40      11.303  -2.379  -4.895  1.00 11.14           C
ATOM    627  CG  GLN A  40      12.467  -1.573  -4.316  1.00 14.85           C
ATOM    628  CD  GLN A  40      13.653  -2.485  -4.040  1.00 16.11           C
ATOM    629  OE1 GLN A  40      13.966  -2.765  -2.883  1.00 20.52           O
ATOM    630  NE2 GLN A  40      14.433  -2.908  -5.071  1.00 18.16           N
ATOM      0  H   GLN A  40       9.628  -3.971  -5.628  1.00 11.60           H   new
ATOM      0  HA  GLN A  40      11.648  -4.076  -3.599  1.00 10.76           H   new
ATOM      0  HB2 GLN A  40      11.610  -2.795  -5.855  1.00 11.14           H   new
ATOM      0  HB3 GLN A  40      10.474  -1.700  -5.093  1.00 11.14           H   new
ATOM      0  HG2 GLN A  40      12.758  -0.788  -5.014  1.00 14.85           H   new
ATOM      0  HG3 GLN A  40      12.155  -1.081  -3.395  1.00 14.85           H   new
ATOM      0 HE21 GLN A  40      14.177  -2.678  -6.031  1.00 18.16           H   new
ATOM      0 HE22 GLN A  40      15.273  -3.455  -4.884  1.00 18.16           H   new
ATOM    639  N   GLN A  41       8.756  -2.882  -2.815  1.00  6.52           N
ATOM    640  CA  GLN A  41       7.891  -2.354  -1.805  1.00  3.87           C
ATOM    641  C   GLN A  41       7.045  -3.425  -1.206  1.00  4.79           C
ATOM    642  O   GLN A  41       6.493  -4.287  -1.887  1.00  6.34           O
ATOM    643  CB  GLN A  41       7.057  -1.163  -2.306  1.00  4.20           C
ATOM    644  CG  GLN A  41       6.426  -1.422  -3.676  1.00  3.20           C
ATOM    645  CD  GLN A  41       5.471  -0.291  -4.032  1.00  4.89           C
ATOM    646  OE1 GLN A  41       4.835   0.166  -3.084  1.00  5.21           O
ATOM    647  NE2 GLN A  41       5.483   0.123  -5.327  1.00  7.13           N
ATOM      0  H   GLN A  41       8.226  -3.158  -3.642  1.00  6.52           H   new
ATOM      0  HA  GLN A  41       8.527  -1.960  -1.012  1.00  3.87           H   new
ATOM      0  HB2 GLN A  41       6.271  -0.945  -1.583  1.00  4.20           H   new
ATOM      0  HB3 GLN A  41       7.691  -0.278  -2.363  1.00  4.20           H   new
ATOM      0  HG2 GLN A  41       7.205  -1.504  -4.434  1.00  3.20           H   new
ATOM      0  HG3 GLN A  41       5.890  -2.371  -3.665  1.00  3.20           H   new
ATOM      0 HE21 GLN A  41       6.067  -0.358  -6.011  1.00  7.13           H   new
ATOM      0 HE22 GLN A  41       4.908   0.915  -5.615  1.00  7.13           H   new
ATOM    656  N   ARG A  42       6.843  -3.372   0.122  1.00  5.73           N
ATOM    657  CA  ARG A  42       5.803  -4.105   0.774  1.00  6.97           C
ATOM    658  C   ARG A  42       4.987  -3.091   1.499  1.00  7.15           C
ATOM    659  O   ARG A  42       5.473  -1.980   1.707  1.00  7.33           O
ATOM    660  CB  ARG A  42       6.422  -5.178   1.686  1.00 13.23           C
ATOM    661  CG  ARG A  42       7.049  -6.251   0.794  1.00 21.27           C
ATOM    662  CD  ARG A  42       7.648  -7.463   1.511  1.00 26.14           C
ATOM    663  NE  ARG A  42       7.879  -8.509   0.475  1.00 32.26           N
ATOM    664  CZ  ARG A  42       8.108  -9.844   0.651  1.00 34.32           C
ATOM    665  NH1 ARG A  42       8.478 -10.401   1.841  1.00 35.30           N
ATOM    666  NH2 ARG A  42       8.148 -10.644  -0.454  1.00 36.39           N
ATOM      0  H   ARG A  42       7.412  -2.810   0.755  1.00  5.73           H   new
ATOM      0  HA  ARG A  42       5.160  -4.653   0.085  1.00  6.97           H   new
ATOM      0  HB2 ARG A  42       7.176  -4.736   2.338  1.00 13.23           H   new
ATOM      0  HB3 ARG A  42       5.660  -5.616   2.331  1.00 13.23           H   new
ATOM      0  HG2 ARG A  42       6.288  -6.606   0.099  1.00 21.27           H   new
ATOM      0  HG3 ARG A  42       7.833  -5.785   0.197  1.00 21.27           H   new
ATOM      0  HD2 ARG A  42       8.582  -7.196   2.005  1.00 26.14           H   new
ATOM      0  HD3 ARG A  42       6.971  -7.828   2.284  1.00 26.14           H   new
ATOM      0  HE  ARG A  42       7.864  -8.186  -0.492  1.00 32.26           H   new
ATOM      0 HH11 ARG A  42       8.598  -9.811   2.665  1.00 35.30           H   new
ATOM      0 HH12 ARG A  42       8.634 -11.407   1.907  1.00 35.30           H   new
ATOM      0 HH21 ARG A  42       8.009 -10.241  -1.381  1.00 36.39           H   new
ATOM      0 HH22 ARG A  42       8.317 -11.645  -0.353  1.00 36.39           H   new
ATOM    680  N   LEU A  43       3.850  -3.565   2.038  1.00  4.65           N
ATOM    681  CA  LEU A  43       2.878  -2.779   2.732  1.00  3.51           C
ATOM    682  C   LEU A  43       2.708  -3.371   4.088  1.00  5.56           C
ATOM    683  O   LEU A  43       2.640  -4.587   4.265  1.00  4.19           O
ATOM    684  CB  LEU A  43       1.476  -2.561   2.137  1.00  3.74           C
ATOM    685  CG  LEU A  43       1.449  -1.964   0.720  1.00  6.32           C
ATOM    686  CD1 LEU A  43       0.084  -1.539   0.153  1.00  6.41           C
ATOM    687  CD2 LEU A  43       2.401  -0.762   0.611  1.00  9.55           C
ATOM      0  H   LEU A  43       3.595  -4.551   1.986  1.00  4.65           H   new
ATOM      0  HA  LEU A  43       3.307  -1.778   2.684  1.00  3.51           H   new
ATOM      0  HB2 LEU A  43       0.954  -3.518   2.120  1.00  3.74           H   new
ATOM      0  HB3 LEU A  43       0.916  -1.903   2.801  1.00  3.74           H   new
ATOM      0  HG  LEU A  43       1.766  -2.811   0.111  1.00  6.32           H   new
ATOM      0 HD11 LEU A  43       0.217  -1.137  -0.851  1.00  6.41           H   new
ATOM      0 HD12 LEU A  43      -0.579  -2.404   0.113  1.00  6.41           H   new
ATOM      0 HD13 LEU A  43      -0.355  -0.775   0.795  1.00  6.41           H   new
ATOM      0 HD21 LEU A  43       2.363  -0.358  -0.401  1.00  9.55           H   new
ATOM      0 HD22 LEU A  43       2.098   0.008   1.320  1.00  9.55           H   new
ATOM      0 HD23 LEU A  43       3.418  -1.082   0.836  1.00  9.55           H   new
ATOM    699  N   ILE A  44       2.508  -2.520   5.110  1.00  4.58           N
ATOM    700  CA  ILE A  44       2.332  -2.882   6.482  1.00  5.55           C
ATOM    701  C   ILE A  44       1.110  -2.170   6.951  1.00  5.46           C
ATOM    702  O   ILE A  44       0.820  -1.014   6.649  1.00  6.04           O
ATOM    703  CB  ILE A  44       3.509  -2.373   7.259  1.00  6.80           C
ATOM    704  CG1 ILE A  44       4.760  -3.227   6.995  1.00 10.31           C
ATOM    705  CG2 ILE A  44       3.142  -2.400   8.753  1.00  7.39           C
ATOM    706  CD1 ILE A  44       6.029  -2.915   7.788  1.00 13.90           C
ATOM      0  H   ILE A  44       2.467  -1.511   4.967  1.00  4.58           H   new
ATOM      0  HA  ILE A  44       2.243  -3.961   6.610  1.00  5.55           H   new
ATOM      0  HB  ILE A  44       3.743  -1.356   6.946  1.00  6.80           H   new
ATOM      0 HG12 ILE A  44       4.498  -4.268   7.183  1.00 10.31           H   new
ATOM      0 HG13 ILE A  44       5.001  -3.145   5.935  1.00 10.31           H   new
ATOM      0 HG21 ILE A  44       3.983  -2.034   9.341  1.00  7.39           H   new
ATOM      0 HG22 ILE A  44       2.274  -1.764   8.926  1.00  7.39           H   new
ATOM      0 HG23 ILE A  44       2.908  -3.422   9.052  1.00  7.39           H   new
ATOM      0 HD11 ILE A  44       6.822  -3.601   7.490  1.00 13.90           H   new
ATOM      0 HD12 ILE A  44       6.341  -1.890   7.587  1.00 13.90           H   new
ATOM      0 HD13 ILE A  44       5.830  -3.031   8.853  1.00 13.90           H   new
ATOM    718  N   PHE A  45       0.263  -2.855   7.741  1.00  6.75           N
ATOM    719  CA  PHE A  45      -0.851  -2.264   8.416  1.00  4.70           C
ATOM    720  C   PHE A  45      -0.591  -2.340   9.881  1.00  6.34           C
ATOM    721  O   PHE A  45      -0.753  -3.399  10.485  1.00  5.45           O
ATOM    722  CB  PHE A  45      -2.148  -2.883   7.868  1.00  5.51           C
ATOM    723  CG  PHE A  45      -3.353  -2.179   8.389  1.00  5.98           C
ATOM    724  CD1 PHE A  45      -3.704  -0.884   8.087  1.00  5.87           C
ATOM    725  CD2 PHE A  45      -4.374  -2.939   8.909  1.00  6.86           C
ATOM    726  CE1 PHE A  45      -4.893  -0.289   8.436  1.00  6.64           C
ATOM    727  CE2 PHE A  45      -5.612  -2.403   9.178  1.00  6.68           C
ATOM    728  CZ  PHE A  45      -5.915  -1.096   8.877  1.00  6.84           C
ATOM      0  H   PHE A  45       0.357  -3.855   7.916  1.00  6.75           H   new
ATOM      0  HA  PHE A  45      -0.986  -1.199   8.225  1.00  4.70           H   new
ATOM      0  HB2 PHE A  45      -2.142  -2.838   6.779  1.00  5.51           H   new
ATOM      0  HB3 PHE A  45      -2.194  -3.937   8.143  1.00  5.51           H   new
ATOM      0  HD1 PHE A  45      -2.992  -0.290   7.534  1.00  5.87           H   new
ATOM      0  HD2 PHE A  45      -4.199  -3.985   9.112  1.00  6.86           H   new
ATOM      0  HE1 PHE A  45      -5.021   0.781   8.366  1.00  6.64           H   new
ATOM      0  HE2 PHE A  45      -6.366  -3.025   9.638  1.00  6.68           H   new
ATOM      0  HZ  PHE A  45      -6.921  -0.717   8.983  1.00  6.84           H   new
ATOM    738  N   ALA A  46      -0.177  -1.202  10.466  1.00  6.53           N
ATOM    739  CA  ALA A  46       0.395  -1.106  11.773  1.00  7.15           C
ATOM    740  C   ALA A  46       1.632  -1.905  11.998  1.00  9.00           C
ATOM    741  O   ALA A  46       2.705  -1.381  11.702  1.00 11.15           O
ATOM    742  CB  ALA A  46      -0.706  -1.221  12.842  1.00  8.99           C
ATOM      0  H   ALA A  46      -0.246  -0.297  10.000  1.00  6.53           H   new
ATOM      0  HA  ALA A  46       0.816  -0.105  11.874  1.00  7.15           H   new
ATOM      0  HB1 ALA A  46      -0.260  -1.147  13.834  1.00  8.99           H   new
ATOM      0  HB2 ALA A  46      -1.429  -0.416  12.708  1.00  8.99           H   new
ATOM      0  HB3 ALA A  46      -1.211  -2.182  12.743  1.00  8.99           H   new
ATOM    748  N   GLY A  47       1.574  -3.105  12.603  1.00  9.35           N
ATOM    749  CA  GLY A  47       2.723  -3.934  12.798  1.00 11.68           C
ATOM    750  C   GLY A  47       2.605  -5.145  11.938  1.00 11.14           C
ATOM    751  O   GLY A  47       3.534  -5.949  11.888  1.00 13.93           O
ATOM      0  H   GLY A  47       0.710  -3.508  12.965  1.00  9.35           H   new
ATOM      0  HA2 GLY A  47       3.630  -3.383  12.549  1.00 11.68           H   new
ATOM      0  HA3 GLY A  47       2.804  -4.224  13.846  1.00 11.68           H   new
ATOM    755  N   LYS A  48       1.445  -5.319  11.280  1.00 10.47           N
ATOM    756  CA  LYS A  48       1.150  -6.520  10.564  1.00  8.82           C
ATOM    757  C   LYS A  48       1.613  -6.493   9.147  1.00  7.68           C
ATOM    758  O   LYS A  48       1.271  -5.590   8.386  1.00  6.47           O
ATOM    759  CB  LYS A  48      -0.368  -6.762  10.617  1.00  9.74           C
ATOM    760  CG  LYS A  48      -0.895  -8.130  10.178  1.00 14.14           C
ATOM    761  CD  LYS A  48      -0.254  -9.446  10.623  1.00 16.32           C
ATOM    762  CE  LYS A  48      -0.214  -9.656  12.138  1.00 20.04           C
ATOM    763  NZ  LYS A  48      -1.579  -9.849  12.676  1.00 23.92           N
ATOM      0  H   LYS A  48       0.704  -4.619  11.245  1.00 10.47           H   new
ATOM      0  HA  LYS A  48       1.695  -7.333  11.045  1.00  8.82           H   new
ATOM      0  HB2 LYS A  48      -0.697  -6.591  11.642  1.00  9.74           H   new
ATOM      0  HB3 LYS A  48      -0.848  -6.005   9.997  1.00  9.74           H   new
ATOM      0  HG2 LYS A  48      -1.940  -8.174  10.486  1.00 14.14           H   new
ATOM      0  HG3 LYS A  48      -0.884  -8.132   9.088  1.00 14.14           H   new
ATOM      0  HD2 LYS A  48      -0.801 -10.273  10.169  1.00 16.32           H   new
ATOM      0  HD3 LYS A  48       0.764  -9.487  10.237  1.00 16.32           H   new
ATOM      0  HE2 LYS A  48       0.401 -10.524  12.374  1.00 20.04           H   new
ATOM      0  HE3 LYS A  48       0.253  -8.795  12.617  1.00 20.04           H   new
ATOM      0  HZ1 LYS A  48      -1.530  -9.990  13.705  1.00 23.92           H   new
ATOM      0  HZ2 LYS A  48      -2.156  -9.009  12.469  1.00 23.92           H   new
ATOM      0  HZ3 LYS A  48      -2.012 -10.684  12.233  1.00 23.92           H   new
ATOM    777  N   GLN A  49       2.494  -7.393   8.677  1.00  8.89           N
ATOM    778  CA  GLN A  49       3.082  -7.329   7.375  1.00  7.18           C
ATOM    779  C   GLN A  49       2.231  -8.013   6.360  1.00  8.23           C
ATOM    780  O   GLN A  49       1.890  -9.187   6.497  1.00  9.70           O
ATOM    781  CB  GLN A  49       4.497  -7.928   7.436  1.00 11.67           C
ATOM    782  CG  GLN A  49       5.369  -7.164   8.435  1.00 15.82           C
ATOM    783  CD  GLN A  49       6.864  -7.418   8.303  1.00 20.21           C
ATOM    784  OE1 GLN A  49       7.450  -6.912   7.347  1.00 23.23           O
ATOM    785  NE2 GLN A  49       7.539  -8.212   9.176  1.00 20.67           N
ATOM      0  H   GLN A  49       2.809  -8.195   9.223  1.00  8.89           H   new
ATOM      0  HA  GLN A  49       3.154  -6.288   7.061  1.00  7.18           H   new
ATOM      0  HB2 GLN A  49       4.440  -8.978   7.725  1.00 11.67           H   new
ATOM      0  HB3 GLN A  49       4.954  -7.894   6.447  1.00 11.67           H   new
ATOM      0  HG2 GLN A  49       5.184  -6.097   8.315  1.00 15.82           H   new
ATOM      0  HG3 GLN A  49       5.057  -7.430   9.445  1.00 15.82           H   new
ATOM      0 HE21 GLN A  49       7.050  -8.630   9.968  1.00 20.67           H   new
ATOM      0 HE22 GLN A  49       8.534  -8.390   9.039  1.00 20.67           H   new
ATOM    794  N   LEU A  50       1.720  -7.269   5.362  1.00  6.51           N
ATOM    795  CA  LEU A  50       0.723  -7.720   4.442  1.00  7.41           C
ATOM    796  C   LEU A  50       1.309  -8.469   3.295  1.00  8.27           C
ATOM    797  O   LEU A  50       2.286  -8.053   2.675  1.00  8.34           O
ATOM    798  CB  LEU A  50      -0.109  -6.579   3.833  1.00  7.13           C
ATOM    799  CG  LEU A  50      -0.667  -5.631   4.907  1.00  7.53           C
ATOM    800  CD1 LEU A  50      -1.574  -4.591   4.228  1.00  9.11           C
ATOM    801  CD2 LEU A  50      -1.519  -6.382   5.945  1.00  8.14           C
ATOM      0  H   LEU A  50       2.016  -6.308   5.189  1.00  6.51           H   new
ATOM      0  HA  LEU A  50       0.085  -8.364   5.048  1.00  7.41           H   new
ATOM      0  HB2 LEU A  50       0.509  -6.013   3.136  1.00  7.13           H   new
ATOM      0  HB3 LEU A  50      -0.934  -7.000   3.258  1.00  7.13           H   new
ATOM      0  HG  LEU A  50       0.180  -5.166   5.412  1.00  7.53           H   new
ATOM      0 HD11 LEU A  50      -1.976  -3.912   4.980  1.00  9.11           H   new
ATOM      0 HD12 LEU A  50      -0.995  -4.023   3.500  1.00  9.11           H   new
ATOM      0 HD13 LEU A  50      -2.395  -5.099   3.722  1.00  9.11           H   new
ATOM      0 HD21 LEU A  50      -1.895  -5.677   6.686  1.00  8.14           H   new
ATOM      0 HD22 LEU A  50      -2.359  -6.865   5.446  1.00  8.14           H   new
ATOM      0 HD23 LEU A  50      -0.908  -7.137   6.440  1.00  8.14           H   new
ATOM    813  N   GLU A  51       0.829  -9.695   3.018  1.00  9.43           N
ATOM    814  CA  GLU A  51       1.163 -10.552   1.924  1.00 11.90           C
ATOM    815  C   GLU A  51       0.512 -10.177   0.637  1.00 11.49           C
ATOM    816  O   GLU A  51      -0.684  -9.889   0.631  1.00  9.88           O
ATOM    817  CB  GLU A  51       0.787 -11.961   2.413  1.00 16.56           C
ATOM    818  CG  GLU A  51       1.695 -12.457   3.541  1.00 26.06           C
ATOM    819  CD  GLU A  51       1.449 -13.872   4.044  1.00 29.86           C
ATOM    820  OE1 GLU A  51       0.237 -14.215   4.016  1.00 33.44           O
ATOM    821  OE2 GLU A  51       2.404 -14.658   4.284  1.00 32.13           O
ATOM      0  H   GLU A  51       0.134 -10.128   3.627  1.00  9.43           H   new
ATOM      0  HA  GLU A  51       2.220 -10.477   1.670  1.00 11.90           H   new
ATOM      0  HB2 GLU A  51      -0.247 -11.957   2.759  1.00 16.56           H   new
ATOM      0  HB3 GLU A  51       0.840 -12.658   1.576  1.00 16.56           H   new
ATOM      0  HG2 GLU A  51       2.728 -12.392   3.200  1.00 26.06           H   new
ATOM      0  HG3 GLU A  51       1.594 -11.774   4.384  1.00 26.06           H   new
ATOM    828  N   ASP A  52       1.318 -10.187  -0.439  1.00 12.71           N
ATOM    829  CA  ASP A  52       1.129  -9.444  -1.646  1.00 16.56           C
ATOM    830  C   ASP A  52      -0.132  -9.807  -2.352  1.00 15.83           C
ATOM    831  O   ASP A  52      -0.834  -8.905  -2.806  1.00 17.21           O
ATOM    832  CB  ASP A  52       2.379  -9.575  -2.533  1.00 21.05           C
ATOM    833  CG  ASP A  52       3.646  -9.195  -1.781  1.00 25.12           C
ATOM    834  OD1 ASP A  52       3.843  -8.038  -1.321  1.00 28.37           O
ATOM    835  OD2 ASP A  52       4.519 -10.103  -1.743  1.00 25.82           O
ATOM      0  H   ASP A  52       2.164 -10.757  -0.466  1.00 12.71           H   new
ATOM      0  HA  ASP A  52       1.007  -8.392  -1.390  1.00 16.56           H   new
ATOM      0  HB2 ASP A  52       2.464 -10.600  -2.893  1.00 21.05           H   new
ATOM      0  HB3 ASP A  52       2.271  -8.937  -3.410  1.00 21.05           H   new
ATOM    840  N   GLY A  53      -0.447 -11.105  -2.512  1.00 15.00           N
ATOM    841  CA  GLY A  53      -1.593 -11.609  -3.203  1.00 11.77           C
ATOM    842  C   GLY A  53      -2.878 -11.653  -2.451  1.00 11.10           C
ATOM    843  O   GLY A  53      -3.940 -11.949  -2.996  1.00 11.25           O
ATOM      0  H   GLY A  53       0.138 -11.850  -2.134  1.00 15.00           H   new
ATOM      0  HA2 GLY A  53      -1.744 -11.000  -4.095  1.00 11.77           H   new
ATOM      0  HA3 GLY A  53      -1.365 -12.620  -3.542  1.00 11.77           H   new
ATOM    847  N   ARG A  54      -2.874 -11.380  -1.134  1.00  8.53           N
ATOM    848  CA  ARG A  54      -3.990 -11.386  -0.240  1.00  9.05           C
ATOM    849  C   ARG A  54      -4.842 -10.174  -0.398  1.00  8.96           C
ATOM    850  O   ARG A  54      -4.445  -9.082  -0.801  1.00 11.60           O
ATOM    851  CB  ARG A  54      -3.547 -11.586   1.219  1.00  7.97           C
ATOM    852  CG  ARG A  54      -2.830 -12.900   1.533  1.00  9.62           C
ATOM    853  CD  ARG A  54      -2.987 -13.369   2.981  1.00 12.20           C
ATOM    854  NE  ARG A  54      -2.214 -14.639   3.067  1.00 18.23           N
ATOM    855  CZ  ARG A  54      -2.766 -15.885   3.144  1.00 22.08           C
ATOM    856  NH1 ARG A  54      -4.103 -16.078   2.948  1.00 23.38           N
ATOM    857  NH2 ARG A  54      -1.989 -17.005   3.213  1.00 25.50           N
ATOM      0  H   ARG A  54      -2.009 -11.133  -0.653  1.00  8.53           H   new
ATOM      0  HA  ARG A  54      -4.608 -12.242  -0.511  1.00  9.05           H   new
ATOM      0  HB2 ARG A  54      -2.888 -10.762   1.493  1.00  7.97           H   new
ATOM      0  HB3 ARG A  54      -4.428 -11.515   1.857  1.00  7.97           H   new
ATOM      0  HG2 ARG A  54      -3.210 -13.676   0.868  1.00  9.62           H   new
ATOM      0  HG3 ARG A  54      -1.769 -12.783   1.314  1.00  9.62           H   new
ATOM      0  HD2 ARG A  54      -2.602 -12.626   3.679  1.00 12.20           H   new
ATOM      0  HD3 ARG A  54      -4.036 -13.529   3.232  1.00 12.20           H   new
ATOM      0  HE  ARG A  54      -1.196 -14.573   3.068  1.00 18.23           H   new
ATOM      0 HH11 ARG A  54      -4.708 -15.283   2.740  1.00 23.38           H   new
ATOM      0 HH12 ARG A  54      -4.497 -17.017   3.010  1.00 23.38           H   new
ATOM      0 HH21 ARG A  54      -0.972 -16.922   3.208  1.00 25.50           H   new
ATOM      0 HH22 ARG A  54      -2.425 -17.925   3.270  1.00 25.50           H   new
ATOM    871  N   THR A  55      -6.166 -10.269  -0.177  1.00  9.05           N
ATOM    872  CA  THR A  55      -6.998  -9.127  -0.397  1.00  9.03           C
ATOM    873  C   THR A  55      -6.941  -8.219   0.783  1.00  8.15           C
ATOM    874  O   THR A  55      -6.506  -8.667   1.843  1.00  5.91           O
ATOM    875  CB  THR A  55      -8.447  -9.451  -0.611  1.00 11.15           C
ATOM    876  OG1 THR A  55      -9.107 -10.063   0.488  1.00 11.95           O
ATOM    877  CG2 THR A  55      -8.542 -10.333  -1.866  1.00 11.71           C
ATOM      0  H   THR A  55      -6.649 -11.108   0.144  1.00  9.05           H   new
ATOM      0  HA  THR A  55      -6.607  -8.669  -1.305  1.00  9.03           H   new
ATOM      0  HB  THR A  55      -8.974  -8.505  -0.731  1.00 11.15           H   new
ATOM      0  HG1 THR A  55      -8.843 -11.005   0.544  1.00 11.95           H   new
ATOM      0 HG21 THR A  55      -9.585 -10.589  -2.053  1.00 11.71           H   new
ATOM      0 HG22 THR A  55      -8.142  -9.791  -2.723  1.00 11.71           H   new
ATOM      0 HG23 THR A  55      -7.966 -11.246  -1.714  1.00 11.71           H   new
ATOM    885  N   LEU A  56      -7.431  -6.974   0.650  1.00  6.91           N
ATOM    886  CA  LEU A  56      -7.519  -6.114   1.789  1.00  8.29           C
ATOM    887  C   LEU A  56      -8.538  -6.487   2.811  1.00  8.05           C
ATOM    888  O   LEU A  56      -8.496  -6.055   3.962  1.00 10.17           O
ATOM    889  CB  LEU A  56      -7.915  -4.744   1.212  1.00  6.60           C
ATOM    890  CG  LEU A  56      -6.884  -3.977   0.366  1.00  7.73           C
ATOM    891  CD1 LEU A  56      -7.535  -2.877  -0.490  1.00  8.64           C
ATOM    892  CD2 LEU A  56      -5.918  -3.260   1.323  1.00  9.85           C
ATOM      0  H   LEU A  56      -7.760  -6.569  -0.226  1.00  6.91           H   new
ATOM      0  HA  LEU A  56      -6.566  -6.156   2.316  1.00  8.29           H   new
ATOM      0  HB2 LEU A  56      -8.805  -4.887   0.600  1.00  6.60           H   new
ATOM      0  HB3 LEU A  56      -8.201  -4.103   2.046  1.00  6.60           H   new
ATOM      0  HG  LEU A  56      -6.392  -4.699  -0.286  1.00  7.73           H   new
ATOM      0 HD11 LEU A  56      -6.767  -2.364  -1.069  1.00  8.64           H   new
ATOM      0 HD12 LEU A  56      -8.261  -3.325  -1.168  1.00  8.64           H   new
ATOM      0 HD13 LEU A  56      -8.039  -2.161   0.159  1.00  8.64           H   new
ATOM      0 HD21 LEU A  56      -5.176  -2.708   0.745  1.00  9.85           H   new
ATOM      0 HD22 LEU A  56      -6.477  -2.567   1.952  1.00  9.85           H   new
ATOM      0 HD23 LEU A  56      -5.415  -3.996   1.951  1.00  9.85           H   new
ATOM    904  N   SER A  57      -9.532  -7.312   2.438  1.00  8.92           N
ATOM    905  CA  SER A  57     -10.696  -7.700   3.172  1.00  9.00           C
ATOM    906  C   SER A  57     -10.383  -8.940   3.937  1.00  9.44           C
ATOM    907  O   SER A  57     -11.066  -9.244   4.914  1.00 10.91           O
ATOM    908  CB  SER A  57     -11.826  -7.918   2.151  1.00 10.32           C
ATOM    909  OG  SER A  57     -13.042  -8.386   2.714  1.00 13.59           O
ATOM      0  H   SER A  57      -9.515  -7.755   1.519  1.00  8.92           H   new
ATOM      0  HA  SER A  57     -11.009  -6.941   3.889  1.00  9.00           H   new
ATOM      0  HB2 SER A  57     -12.017  -6.978   1.633  1.00 10.32           H   new
ATOM      0  HB3 SER A  57     -11.488  -8.633   1.400  1.00 10.32           H   new
ATOM      0  HG  SER A  57     -13.709  -8.498   2.005  1.00 13.59           H   new
ATOM    915  N   ASP A  58      -9.351  -9.762   3.675  1.00  9.11           N
ATOM    916  CA  ASP A  58      -8.760 -10.779   4.487  1.00  7.91           C
ATOM    917  C   ASP A  58      -8.068 -10.262   5.701  1.00  9.12           C
ATOM    918  O   ASP A  58      -7.874 -10.971   6.687  1.00  8.61           O
ATOM    919  CB  ASP A  58      -7.731 -11.570   3.660  1.00  8.41           C
ATOM    920  CG  ASP A  58      -8.280 -12.447   2.545  1.00 11.50           C
ATOM    921  OD1 ASP A  58      -9.104 -13.337   2.886  1.00 11.70           O
ATOM    922  OD2 ASP A  58      -7.931 -12.254   1.350  1.00 10.05           O
ATOM      0  H   ASP A  58      -8.873  -9.701   2.776  1.00  9.11           H   new
ATOM      0  HA  ASP A  58      -9.587 -11.405   4.821  1.00  7.91           H   new
ATOM      0  HB2 ASP A  58      -7.030 -10.861   3.221  1.00  8.41           H   new
ATOM      0  HB3 ASP A  58      -7.161 -12.202   4.341  1.00  8.41           H   new
ATOM    927  N   TYR A  59      -7.698  -8.971   5.629  1.00  7.97           N
ATOM    928  CA  TYR A  59      -7.118  -8.253   6.722  1.00  8.45           C
ATOM    929  C   TYR A  59      -8.100  -7.325   7.351  1.00 10.98           C
ATOM    930  O   TYR A  59      -7.946  -6.975   8.520  1.00 12.95           O
ATOM    931  CB  TYR A  59      -5.932  -7.386   6.267  1.00  7.94           C
ATOM    932  CG  TYR A  59      -4.804  -8.250   5.816  1.00  6.91           C
ATOM    933  CD1 TYR A  59      -4.052  -8.917   6.754  1.00  6.98           C
ATOM    934  CD2 TYR A  59      -4.517  -8.486   4.492  1.00  4.59           C
ATOM    935  CE1 TYR A  59      -2.978  -9.701   6.408  1.00  6.52           C
ATOM    936  CE2 TYR A  59      -3.390  -9.181   4.123  1.00  5.39           C
ATOM    937  CZ  TYR A  59      -2.589  -9.743   5.089  1.00  6.76           C
ATOM    938  OH  TYR A  59      -1.401 -10.450   4.806  1.00  7.63           O
ATOM      0  H   TYR A  59      -7.806  -8.409   4.785  1.00  7.97           H   new
ATOM      0  HA  TYR A  59      -6.792  -9.014   7.431  1.00  8.45           H   new
ATOM      0  HB2 TYR A  59      -6.243  -6.729   5.455  1.00  7.94           H   new
ATOM      0  HB3 TYR A  59      -5.604  -6.747   7.087  1.00  7.94           H   new
ATOM      0  HD1 TYR A  59      -4.314  -8.822   7.797  1.00  6.98           H   new
ATOM      0  HD2 TYR A  59      -5.188  -8.119   3.730  1.00  4.59           H   new
ATOM      0  HE1 TYR A  59      -2.450 -10.273   7.157  1.00  6.52           H   new
ATOM      0  HE2 TYR A  59      -3.135  -9.285   3.079  1.00  5.39           H   new
ATOM      0  HH  TYR A  59      -1.501 -11.384   5.086  1.00  7.63           H   new
ATOM    948  N   ASN A  60      -9.158  -6.975   6.599  1.00 12.38           N
ATOM    949  CA  ASN A  60     -10.215  -6.090   6.980  1.00 13.94           C
ATOM    950  C   ASN A  60      -9.737  -4.691   7.158  1.00 14.16           C
ATOM    951  O   ASN A  60      -9.785  -4.159   8.267  1.00 14.26           O
ATOM    952  CB  ASN A  60     -10.982  -6.561   8.227  1.00 19.23           C
ATOM    953  CG  ASN A  60     -11.518  -7.983   8.141  1.00 22.65           C
ATOM    954  OD1 ASN A  60     -12.357  -8.261   7.285  1.00 25.45           O
ATOM    955  ND2 ASN A  60     -10.992  -8.809   9.085  1.00 24.09           N
ATOM      0  H   ASN A  60      -9.283  -7.338   5.654  1.00 12.38           H   new
ATOM      0  HA  ASN A  60     -10.919  -6.108   6.148  1.00 13.94           H   new
ATOM      0  HB2 ASN A  60     -10.323  -6.487   9.092  1.00 19.23           H   new
ATOM      0  HB3 ASN A  60     -11.816  -5.882   8.402  1.00 19.23           H   new
ATOM      0 HD21 ASN A  60     -11.292  -9.783   9.135  1.00 24.09           H   new
ATOM      0 HD22 ASN A  60     -10.298  -8.455   9.743  1.00 24.09           H   new
ATOM    962  N   ILE A  61      -9.209  -4.123   6.059  1.00 11.08           N
ATOM    963  CA  ILE A  61      -8.618  -2.823   5.980  1.00 11.78           C
ATOM    964  C   ILE A  61      -9.603  -1.884   5.372  1.00 13.74           C
ATOM    965  O   ILE A  61      -9.888  -1.981   4.179  1.00 14.60           O
ATOM    966  CB  ILE A  61      -7.379  -2.852   5.134  1.00 11.80           C
ATOM    967  CG1 ILE A  61      -6.400  -3.794   5.855  1.00 11.56           C
ATOM    968  CG2 ILE A  61      -6.811  -1.440   4.914  1.00 13.29           C
ATOM    969  CD1 ILE A  61      -5.012  -3.973   5.241  1.00 11.42           C
ATOM      0  H   ILE A  61      -9.195  -4.608   5.162  1.00 11.08           H   new
ATOM      0  HA  ILE A  61      -8.346  -2.496   6.984  1.00 11.78           H   new
ATOM      0  HB  ILE A  61      -7.583  -3.220   4.128  1.00 11.80           H   new
ATOM      0 HG12 ILE A  61      -6.272  -3.430   6.875  1.00 11.56           H   new
ATOM      0 HG13 ILE A  61      -6.867  -4.777   5.923  1.00 11.56           H   new
ATOM      0 HG21 ILE A  61      -5.914  -1.501   4.297  1.00 13.29           H   new
ATOM      0 HG22 ILE A  61      -7.556  -0.822   4.412  1.00 13.29           H   new
ATOM      0 HG23 ILE A  61      -6.560  -0.995   5.877  1.00 13.29           H   new
ATOM      0 HD11 ILE A  61      -4.430  -4.662   5.853  1.00 11.42           H   new
ATOM      0 HD12 ILE A  61      -5.109  -4.376   4.233  1.00 11.42           H   new
ATOM      0 HD13 ILE A  61      -4.506  -3.009   5.199  1.00 11.42           H   new
ATOM    981  N   GLN A  62     -10.259  -1.021   6.168  1.00 13.97           N
ATOM    982  CA  GLN A  62     -11.371  -0.266   5.679  1.00 15.52           C
ATOM    983  C   GLN A  62     -11.021   0.984   4.947  1.00 13.94           C
ATOM    984  O   GLN A  62      -9.841   1.133   4.632  1.00 12.15           O
ATOM    985  CB  GLN A  62     -12.313   0.019   6.861  1.00 19.53           C
ATOM    986  CG  GLN A  62     -11.773   1.008   7.896  1.00 26.38           C
ATOM    987  CD  GLN A  62     -12.718   1.275   9.059  1.00 30.61           C
ATOM    988  OE1 GLN A  62     -13.941   1.350   8.951  1.00 33.23           O
ATOM    989  NE2 GLN A  62     -12.054   1.618  10.195  1.00 32.71           N
ATOM      0  H   GLN A  62     -10.022  -0.846   7.144  1.00 13.97           H   new
ATOM      0  HA  GLN A  62     -11.862  -0.875   4.919  1.00 15.52           H   new
ATOM      0  HB2 GLN A  62     -13.255   0.404   6.470  1.00 19.53           H   new
ATOM      0  HB3 GLN A  62     -12.537  -0.922   7.363  1.00 19.53           H   new
ATOM      0  HG2 GLN A  62     -10.831   0.626   8.289  1.00 26.38           H   new
ATOM      0  HG3 GLN A  62     -11.552   1.952   7.398  1.00 26.38           H   new
ATOM      0 HE21 GLN A  62     -11.038   1.538  10.236  1.00 32.71           H   new
ATOM      0 HE22 GLN A  62     -12.572   1.955  11.006  1.00 32.71           H   new
ATOM    998  N   LYS A  63     -11.950   1.933   4.734  1.00 11.73           N
ATOM    999  CA  LYS A  63     -11.719   3.247   4.219  1.00 11.97           C
ATOM   1000  C   LYS A  63     -11.029   4.136   5.196  1.00 10.41           C
ATOM   1001  O   LYS A  63     -11.083   3.975   6.414  1.00  9.59           O
ATOM   1002  CB  LYS A  63     -13.053   3.850   3.749  1.00 13.73           C
ATOM   1003  CG  LYS A  63     -14.011   4.281   4.861  1.00 16.98           C
ATOM   1004  CD  LYS A  63     -15.288   4.886   4.274  1.00 20.19           C
ATOM   1005  CE  LYS A  63     -16.436   3.889   4.101  1.00 23.42           C
ATOM   1006  NZ  LYS A  63     -17.653   4.485   3.506  1.00 25.97           N
ATOM      0  H   LYS A  63     -12.936   1.768   4.937  1.00 11.73           H   new
ATOM      0  HA  LYS A  63     -11.041   3.163   3.369  1.00 11.97           H   new
ATOM      0  HB2 LYS A  63     -12.839   4.716   3.122  1.00 13.73           H   new
ATOM      0  HB3 LYS A  63     -13.560   3.119   3.120  1.00 13.73           H   new
ATOM      0  HG2 LYS A  63     -14.263   3.422   5.483  1.00 16.98           H   new
ATOM      0  HG3 LYS A  63     -13.521   5.010   5.507  1.00 16.98           H   new
ATOM      0  HD2 LYS A  63     -15.622   5.698   4.920  1.00 20.19           H   new
ATOM      0  HD3 LYS A  63     -15.055   5.326   3.304  1.00 20.19           H   new
ATOM      0  HE2 LYS A  63     -16.099   3.066   3.471  1.00 23.42           H   new
ATOM      0  HE3 LYS A  63     -16.687   3.465   5.073  1.00 23.42           H   new
ATOM      0  HZ1 LYS A  63     -18.389   3.756   3.418  1.00 25.97           H   new
ATOM      0  HZ2 LYS A  63     -17.998   5.253   4.117  1.00 25.97           H   new
ATOM      0  HZ3 LYS A  63     -17.428   4.866   2.565  1.00 25.97           H   new
ATOM   1020  N   GLU A  64     -10.414   5.182   4.616  1.00 10.04           N
ATOM   1021  CA  GLU A  64      -9.713   6.264   5.235  1.00 10.94           C
ATOM   1022  C   GLU A  64      -8.657   5.739   6.146  1.00  9.74           C
ATOM   1023  O   GLU A  64      -8.193   6.455   7.032  1.00  9.42           O
ATOM   1024  CB  GLU A  64     -10.641   7.286   5.912  1.00 18.31           C
ATOM   1025  CG  GLU A  64     -11.698   7.763   4.914  1.00 24.16           C
ATOM   1026  CD  GLU A  64     -12.546   8.875   5.514  1.00 29.00           C
ATOM   1027  OE1 GLU A  64     -12.839   8.813   6.738  1.00 31.72           O
ATOM   1028  OE2 GLU A  64     -12.869   9.822   4.747  1.00 32.61           O
ATOM      0  H   GLU A  64     -10.409   5.277   3.600  1.00 10.04           H   new
ATOM      0  HA  GLU A  64      -9.221   6.831   4.445  1.00 10.94           H   new
ATOM      0  HB2 GLU A  64     -11.123   6.835   6.779  1.00 18.31           H   new
ATOM      0  HB3 GLU A  64     -10.061   8.134   6.275  1.00 18.31           H   new
ATOM      0  HG2 GLU A  64     -11.212   8.120   4.006  1.00 24.16           H   new
ATOM      0  HG3 GLU A  64     -12.336   6.928   4.627  1.00 24.16           H   new
ATOM   1035  N   SER A  65      -8.174   4.496   5.972  1.00  6.85           N
ATOM   1036  CA  SER A  65      -7.048   3.918   6.638  1.00  6.90           C
ATOM   1037  C   SER A  65      -5.722   4.523   6.328  1.00  4.72           C
ATOM   1038  O   SER A  65      -5.497   4.924   5.187  1.00  3.91           O
ATOM   1039  CB  SER A  65      -7.065   2.400   6.392  1.00  7.28           C
ATOM   1040  OG  SER A  65      -8.170   1.735   6.987  1.00 10.56           O
ATOM      0  H   SER A  65      -8.605   3.846   5.315  1.00  6.85           H   new
ATOM      0  HA  SER A  65      -7.164   4.143   7.698  1.00  6.90           H   new
ATOM      0  HB2 SER A  65      -7.077   2.216   5.318  1.00  7.28           H   new
ATOM      0  HB3 SER A  65      -6.142   1.968   6.779  1.00  7.28           H   new
ATOM      0  HG  SER A  65      -8.796   1.452   6.288  1.00 10.56           H   new
ATOM   1046  N   THR A  66      -4.807   4.691   7.299  1.00  4.48           N
ATOM   1047  CA  THR A  66      -3.433   5.085   7.253  1.00  3.80           C
ATOM   1048  C   THR A  66      -2.637   3.831   7.129  1.00  4.60           C
ATOM   1049  O   THR A  66      -2.679   3.106   8.122  1.00  5.33           O
ATOM   1050  CB  THR A  66      -3.037   5.881   8.462  1.00  2.85           C
ATOM   1051  OG1 THR A  66      -3.584   7.182   8.309  1.00  2.15           O
ATOM   1052  CG2 THR A  66      -1.504   5.989   8.516  1.00  3.40           C
ATOM      0  H   THR A  66      -5.082   4.522   8.267  1.00  4.48           H   new
ATOM      0  HA  THR A  66      -3.250   5.744   6.405  1.00  3.80           H   new
ATOM      0  HB  THR A  66      -3.398   5.407   9.375  1.00  2.85           H   new
ATOM      0  HG1 THR A  66      -3.345   7.731   9.085  1.00  2.15           H   new
ATOM      0 HG21 THR A  66      -1.211   6.567   9.393  1.00  3.40           H   new
ATOM      0 HG22 THR A  66      -1.071   4.991   8.578  1.00  3.40           H   new
ATOM      0 HG23 THR A  66      -1.142   6.487   7.616  1.00  3.40           H   new
ATOM   1060  N   LEU A  67      -1.896   3.646   6.022  1.00  4.17           N
ATOM   1061  CA  LEU A  67      -1.035   2.519   5.838  1.00  3.85           C
ATOM   1062  C   LEU A  67       0.392   2.947   5.839  1.00  3.80           C
ATOM   1063  O   LEU A  67       0.699   4.074   5.455  1.00  5.54           O
ATOM   1064  CB  LEU A  67      -1.383   1.720   4.571  1.00  7.18           C
ATOM   1065  CG  LEU A  67      -2.506   0.676   4.690  1.00  9.67           C
ATOM   1066  CD1 LEU A  67      -3.879   1.361   4.792  1.00 11.66           C
ATOM   1067  CD2 LEU A  67      -2.493  -0.344   3.539  1.00  8.12           C
ATOM      0  H   LEU A  67      -1.895   4.296   5.236  1.00  4.17           H   new
ATOM      0  HA  LEU A  67      -1.192   1.845   6.680  1.00  3.85           H   new
ATOM      0  HB2 LEU A  67      -1.660   2.428   3.790  1.00  7.18           H   new
ATOM      0  HB3 LEU A  67      -0.481   1.210   4.234  1.00  7.18           H   new
ATOM      0  HG  LEU A  67      -2.320   0.119   5.608  1.00  9.67           H   new
ATOM      0 HD11 LEU A  67      -4.658   0.603   4.875  1.00 11.66           H   new
ATOM      0 HD12 LEU A  67      -3.901   2.003   5.673  1.00 11.66           H   new
ATOM      0 HD13 LEU A  67      -4.052   1.963   3.900  1.00 11.66           H   new
ATOM      0 HD21 LEU A  67      -3.307  -1.056   3.675  1.00  8.12           H   new
ATOM      0 HD22 LEU A  67      -2.621   0.177   2.590  1.00  8.12           H   new
ATOM      0 HD23 LEU A  67      -1.542  -0.876   3.535  1.00  8.12           H   new
ATOM   1079  N   HIS A  68       1.293   1.956   5.957  1.00  2.94           N
ATOM   1080  CA  HIS A  68       2.687   2.274   5.912  1.00  4.17           C
ATOM   1081  C   HIS A  68       3.378   1.523   4.826  1.00  5.32           C
ATOM   1082  O   HIS A  68       3.124   0.325   4.705  1.00  7.70           O
ATOM   1083  CB  HIS A  68       3.334   1.869   7.247  1.00  5.57           C
ATOM   1084  CG  HIS A  68       2.832   2.590   8.463  1.00  9.95           C
ATOM   1085  ND1 HIS A  68       2.881   2.009   9.714  1.00 13.74           N
ATOM   1086  CD2 HIS A  68       2.212   3.789   8.623  1.00 12.79           C
ATOM   1087  CE1 HIS A  68       2.212   2.835  10.562  1.00 14.75           C
ATOM   1088  NE2 HIS A  68       1.797   3.918   9.933  1.00 16.30           N
ATOM      0  H   HIS A  68       1.070   0.968   6.079  1.00  2.94           H   new
ATOM      0  HA  HIS A  68       2.784   3.344   5.727  1.00  4.17           H   new
ATOM      0  HB2 HIS A  68       3.181   0.800   7.393  1.00  5.57           H   new
ATOM      0  HB3 HIS A  68       4.409   2.030   7.171  1.00  5.57           H   new
ATOM      0  HD2 HIS A  68       2.067   4.525   7.847  1.00 12.79           H   new
ATOM      0  HE1 HIS A  68       2.043   2.632  11.609  1.00 14.75           H   new
ATOM      0  HE2 HIS A  68       1.274   4.696  10.335  1.00 16.30           H   new
ATOM   1096  N   LEU A  69       4.248   2.182   4.040  1.00  5.29           N
ATOM   1097  CA  LEU A  69       5.007   1.587   2.985  1.00  3.97           C
ATOM   1098  C   LEU A  69       6.332   1.204   3.550  1.00  5.07           C
ATOM   1099  O   LEU A  69       7.015   1.967   4.232  1.00  4.34           O
ATOM   1100  CB  LEU A  69       5.212   2.662   1.905  1.00  6.08           C
ATOM   1101  CG  LEU A  69       6.184   2.356   0.753  1.00  7.37           C
ATOM   1102  CD1 LEU A  69       5.641   1.221  -0.132  1.00  9.96           C
ATOM   1103  CD2 LEU A  69       6.313   3.561  -0.194  1.00  6.87           C
ATOM      0  H   LEU A  69       4.431   3.180   4.146  1.00  5.29           H   new
ATOM      0  HA  LEU A  69       4.508   0.715   2.564  1.00  3.97           H   new
ATOM      0  HB2 LEU A  69       4.239   2.886   1.469  1.00  6.08           H   new
ATOM      0  HB3 LEU A  69       5.557   3.570   2.400  1.00  6.08           H   new
ATOM      0  HG  LEU A  69       7.135   2.098   1.219  1.00  7.37           H   new
ATOM      0 HD11 LEU A  69       6.345   1.021  -0.940  1.00  9.96           H   new
ATOM      0 HD12 LEU A  69       5.514   0.320   0.469  1.00  9.96           H   new
ATOM      0 HD13 LEU A  69       4.680   1.516  -0.552  1.00  9.96           H   new
ATOM      0 HD21 LEU A  69       7.006   3.318  -1.000  1.00  6.87           H   new
ATOM      0 HD22 LEU A  69       5.336   3.799  -0.615  1.00  6.87           H   new
ATOM      0 HD23 LEU A  69       6.688   4.421   0.361  1.00  6.87           H   new
ATOM   1115  N   VAL A  70       6.889   0.000   3.329  1.00  4.29           N
ATOM   1116  CA  VAL A  70       8.290  -0.196   3.540  1.00  6.26           C
ATOM   1117  C   VAL A  70       8.870  -0.593   2.227  1.00  9.22           C
ATOM   1118  O   VAL A  70       8.185  -1.120   1.351  1.00  9.36           O
ATOM   1119  CB  VAL A  70       8.633  -1.152   4.644  1.00  8.69           C
ATOM   1120  CG1 VAL A  70       8.182  -0.684   6.037  1.00  9.76           C
ATOM   1121  CG2 VAL A  70       7.992  -2.528   4.396  1.00  8.54           C
ATOM      0  H   VAL A  70       6.381  -0.825   3.010  1.00  4.29           H   new
ATOM      0  HA  VAL A  70       8.729   0.736   3.896  1.00  6.26           H   new
ATOM      0  HB  VAL A  70       9.722  -1.207   4.634  1.00  8.69           H   new
ATOM      0 HG11 VAL A  70       8.466  -1.429   6.781  1.00  9.76           H   new
ATOM      0 HG12 VAL A  70       8.660   0.266   6.274  1.00  9.76           H   new
ATOM      0 HG13 VAL A  70       7.099  -0.558   6.046  1.00  9.76           H   new
ATOM      0 HG21 VAL A  70       8.255  -3.204   5.210  1.00  8.54           H   new
ATOM      0 HG22 VAL A  70       6.908  -2.421   4.349  1.00  8.54           H   new
ATOM      0 HG23 VAL A  70       8.358  -2.935   3.453  1.00  8.54           H   new
ATOM   1131  N   LEU A  71      10.165  -0.289   2.032  1.00 12.71           N
ATOM   1132  CA  LEU A  71      10.891  -0.760   0.894  1.00 16.06           C
ATOM   1133  C   LEU A  71      11.898  -1.780   1.303  1.00 18.09           C
ATOM   1134  O   LEU A  71      12.361  -1.631   2.432  1.00 19.26           O
ATOM   1135  CB  LEU A  71      11.647   0.319   0.099  1.00 17.10           C
ATOM   1136  CG  LEU A  71      10.955   1.049  -1.064  1.00 19.37           C
ATOM   1137  CD1 LEU A  71       9.560   1.659  -0.847  1.00 19.57           C
ATOM   1138  CD2 LEU A  71      11.779   2.064  -1.875  1.00 17.51           C
ATOM      0  H   LEU A  71      10.714   0.289   2.669  1.00 12.71           H   new
ATOM      0  HA  LEU A  71      10.117  -1.167   0.244  1.00 16.06           H   new
ATOM      0  HB2 LEU A  71      11.970   1.078   0.811  1.00 17.10           H   new
ATOM      0  HB3 LEU A  71      12.548  -0.146  -0.301  1.00 17.10           H   new
ATOM      0  HG  LEU A  71      10.832   0.135  -1.646  1.00 19.37           H   new
ATOM      0 HD11 LEU A  71       9.223   2.134  -1.768  1.00 19.57           H   new
ATOM      0 HD12 LEU A  71       8.859   0.873  -0.567  1.00 19.57           H   new
ATOM      0 HD13 LEU A  71       9.608   2.403  -0.052  1.00 19.57           H   new
ATOM      0 HD21 LEU A  71      11.156   2.495  -2.659  1.00 17.51           H   new
ATOM      0 HD22 LEU A  71      12.132   2.856  -1.215  1.00 17.51           H   new
ATOM      0 HD23 LEU A  71      12.634   1.561  -2.327  1.00 17.51           H   new