USER  MOD reduce.3.24.130724 H: found=0, std=0, add=650, rem=0, adj=19
USER  MOD reduce.3.24.130724 removed 648 hydrogens (0 hets)
USER  MOD -----------------------------------------------------------------
USER  MOD scores for adjustable sidechains, with "set" totals for H,N and Q
USER  MOD "o" means original, "f" means flipped, "180deg" is methyl default
USER  MOD "!" flags a clash with an overlap of 0.40A or greater
USER  MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip
USER  MOD Set 1.1: A   9 SER OG  :   rot  172:sc=    1.39
USER  MOD Set 1.2: A  14 SER OG  :   rot  -53:sc=   0.452
USER  MOD Single : A   1 MET CE  :methyl -177:sc=  -0.234   (180deg=-0.355)
USER  MOD Single : A   1 MET N   :NH3+   -174:sc=   0.367   (180deg=0.308)
USER  MOD Single : A   2 GLN     :      amide:sc=   -1.15  K(o=-1.1,f=-3.5!)
USER  MOD Single : A   3 THR OG1 :   rot  118:sc=    1.27
USER  MOD Single : A  11 CYS SG  :   rot  180:sc= 0.00551
USER  MOD Single : A  13 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  18 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  23 LYS NZ  :NH3+    167:sc=   0.923   (180deg=0.483)
USER  MOD Single : A  25 SER OG  :   rot   67:sc=   0.848
USER  MOD Single : A  26 ASN     :      amide:sc=   0.517  K(o=0.52,f=-0.0095)
USER  MOD Single : A  32 GLN     :      amide:sc=       0  K(o=0,f=-1.2)
USER  MOD Single : A  33 TYR OH  :   rot   -2:sc=    1.28
USER  MOD Single : A  34 GLN     :      amide:sc=   0.192  X(o=0.19,f=-0.054)
USER  MOD Single : A  35 TYR OH  :   rot  118:sc=    1.67
USER  MOD Single : A  44 THR OG1 :   rot  180:sc=   0.884
USER  MOD Single : A  45 LYS NZ  :NH3+    132:sc=    1.71   (180deg=-1.16)
USER  MOD Single : A  49 GLN     :      amide:sc=  -0.739  X(o=-0.74,f=-0.39)
USER  MOD Single : A  50 GLN     :      amide:sc=  -0.305  X(o=-0.3,f=-0.28)
USER  MOD Single : A  51 LYS NZ  :NH3+   -159:sc=  -0.693   (180deg=-1.49!)
USER  MOD Single : A  54 LYS NZ  :NH3+    180:sc=       0   (180deg=0)
USER  MOD Single : A  58 THR OG1 :   rot  180:sc=  0.0475
USER  MOD Single : A  61 GLN     :      amide:sc=   -0.51  K(o=-0.51,f=-3.4!)
USER  MOD Single : A  66 GLN     :FLIP  amide:sc=       0  F(o=-0.8,f=0)
USER  MOD Single : A  67 GLN     :      amide:sc=       0  K(o=0,f=-0.74)
USER  MOD Single : A  68 HIS     :     no HD1:sc=    -1.2  X(o=-1.2,f=-1.5)
USER  MOD Single : A  72 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  73 THR OG1 :   rot  180:sc=    0.14
USER  MOD Single : A  80 LYS NZ  :NH3+   -170:sc=       0   (180deg=-0.131)
USER  MOD Single : A  82 ASN     :      amide:sc=   0.399  K(o=0.4,f=-0.1)
USER  MOD -----------------------------------------------------------------
ATOM      1  N   MET A   1       9.469   2.142  10.947  1.00  1.72           N
ATOM      2  CA  MET A   1       8.974   1.627   9.651  1.00  1.21           C
ATOM      3  C   MET A   1       8.517   2.803   8.782  1.00  1.07           C
ATOM      4  O   MET A   1       8.441   3.917   9.297  1.00  1.68           O
ATOM      5  CB  MET A   1       7.841   0.603   9.798  1.00  1.34           C
ATOM      6  CG  MET A   1       8.097  -0.489  10.839  1.00  1.63           C
ATOM      7  SD  MET A   1       6.995  -1.917  10.702  1.00  2.23           S
ATOM      8  CE  MET A   1       5.398  -1.122  10.434  1.00  2.61           C
ATOM      0  H1  MET A   1       9.874   1.360  11.500  1.00  1.72           H   new
ATOM      0  H2  MET A   1      10.201   2.861  10.778  1.00  1.72           H   new
ATOM      0  H3  MET A   1       8.681   2.567  11.475  1.00  1.72           H   new
ATOM      0  HA  MET A   1       9.801   1.099   9.175  1.00  1.21           H   new
ATOM      0  HB2 MET A   1       6.925   1.131  10.063  1.00  1.34           H   new
ATOM      0  HB3 MET A   1       7.669   0.131   8.831  1.00  1.34           H   new
ATOM      0  HG2 MET A   1       9.128  -0.830  10.746  1.00  1.63           H   new
ATOM      0  HG3 MET A   1       7.993  -0.058  11.835  1.00  1.63           H   new
ATOM      0  HE1 MET A   1       4.617  -1.881  10.385  1.00  2.61           H   new
ATOM      0  HE2 MET A   1       5.189  -0.439  11.257  1.00  2.61           H   new
ATOM      0  HE3 MET A   1       5.421  -0.565   9.497  1.00  2.61           H   new
ATOM     20  N   GLN A   2       8.150   2.581   7.518  1.00  0.67           N
ATOM     21  CA  GLN A   2       7.579   3.621   6.664  1.00  0.57           C
ATOM     22  C   GLN A   2       6.732   2.988   5.567  1.00  0.56           C
ATOM     23  O   GLN A   2       7.217   2.140   4.823  1.00  0.86           O
ATOM     24  CB  GLN A   2       8.711   4.460   6.057  1.00  0.67           C
ATOM     25  CG  GLN A   2       8.183   5.791   5.510  1.00  0.85           C
ATOM     26  CD  GLN A   2       7.934   6.829   6.594  1.00  1.85           C
ATOM     27  OE1 GLN A   2       7.922   6.522   7.784  1.00  3.59           O
ATOM     28  NE2 GLN A   2       7.767   8.082   6.198  1.00  1.94           N
ATOM      0  H   GLN A   2       8.241   1.675   7.059  1.00  0.67           H   new
ATOM      0  HA  GLN A   2       6.938   4.271   7.259  1.00  0.57           H   new
ATOM      0  HB2 GLN A   2       9.472   4.651   6.814  1.00  0.67           H   new
ATOM      0  HB3 GLN A   2       9.193   3.900   5.255  1.00  0.67           H   new
ATOM      0  HG2 GLN A   2       8.899   6.190   4.791  1.00  0.85           H   new
ATOM      0  HG3 GLN A   2       7.254   5.611   4.969  1.00  0.85           H   new
ATOM      0 HE21 GLN A   2       7.781   8.309   5.204  1.00  1.94           H   new
ATOM      0 HE22 GLN A   2       7.624   8.820   6.887  1.00  1.94           H   new
ATOM     37  N   THR A   3       5.475   3.405   5.454  1.00  0.66           N
ATOM     38  CA  THR A   3       4.543   2.893   4.461  1.00  0.67           C
ATOM     39  C   THR A   3       4.436   3.871   3.282  1.00  0.67           C
ATOM     40  O   THR A   3       4.573   5.077   3.469  1.00  1.18           O
ATOM     41  CB  THR A   3       3.218   2.619   5.180  1.00  0.75           C
ATOM     42  OG1 THR A   3       3.462   1.768   6.282  1.00  0.94           O
ATOM     43  CG2 THR A   3       2.164   1.960   4.295  1.00  0.91           C
ATOM      0  H   THR A   3       5.071   4.119   6.060  1.00  0.66           H   new
ATOM      0  HA  THR A   3       4.883   1.957   4.017  1.00  0.67           H   new
ATOM      0  HB  THR A   3       2.825   3.589   5.486  1.00  0.75           H   new
ATOM      0  HG1 THR A   3       3.226   2.232   7.112  1.00  0.94           H   new
ATOM      0 HG21 THR A   3       1.254   1.797   4.873  1.00  0.91           H   new
ATOM      0 HG22 THR A   3       1.944   2.608   3.447  1.00  0.91           H   new
ATOM      0 HG23 THR A   3       2.540   1.003   3.933  1.00  0.91           H   new
ATOM     51  N   VAL A   4       4.193   3.375   2.070  1.00  0.70           N
ATOM     52  CA  VAL A   4       3.972   4.188   0.882  1.00  0.64           C
ATOM     53  C   VAL A   4       2.681   3.685   0.231  1.00  0.73           C
ATOM     54  O   VAL A   4       2.495   2.472   0.189  1.00  0.85           O
ATOM     55  CB  VAL A   4       5.166   4.096  -0.081  1.00  0.72           C
ATOM     56  CG1 VAL A   4       5.046   5.181  -1.157  1.00  0.76           C
ATOM     57  CG2 VAL A   4       6.502   4.273   0.653  1.00  0.80           C
ATOM      0  H   VAL A   4       4.144   2.373   1.886  1.00  0.70           H   new
ATOM      0  HA  VAL A   4       3.877   5.242   1.145  1.00  0.64           H   new
ATOM      0  HB  VAL A   4       5.149   3.104  -0.533  1.00  0.72           H   new
ATOM      0 HG11 VAL A   4       5.894   5.113  -1.838  1.00  0.76           H   new
ATOM      0 HG12 VAL A   4       4.120   5.039  -1.715  1.00  0.76           H   new
ATOM      0 HG13 VAL A   4       5.038   6.163  -0.684  1.00  0.76           H   new
ATOM      0 HG21 VAL A   4       7.322   4.202  -0.062  1.00  0.80           H   new
ATOM      0 HG22 VAL A   4       6.525   5.250   1.136  1.00  0.80           H   new
ATOM      0 HG23 VAL A   4       6.609   3.493   1.407  1.00  0.80           H   new
ATOM     67  N   ILE A   5       1.795   4.556  -0.263  1.00  0.71           N
ATOM     68  CA  ILE A   5       0.562   4.159  -0.945  1.00  0.73           C
ATOM     69  C   ILE A   5       0.779   4.537  -2.403  1.00  0.52           C
ATOM     70  O   ILE A   5       1.028   5.708  -2.673  1.00  0.64           O
ATOM     71  CB  ILE A   5      -0.687   4.903  -0.414  1.00  0.99           C
ATOM     72  CG1 ILE A   5      -0.677   5.285   1.072  1.00  1.63           C
ATOM     73  CG2 ILE A   5      -1.985   4.174  -0.786  1.00  0.87           C
ATOM     74  CD1 ILE A   5      -0.589   4.130   2.065  1.00  1.28           C
ATOM      0  H   ILE A   5       1.916   5.567  -0.199  1.00  0.71           H   new
ATOM      0  HA  ILE A   5       0.373   3.097  -0.787  1.00  0.73           H   new
ATOM      0  HB  ILE A   5      -0.643   5.861  -0.933  1.00  0.99           H   new
ATOM      0 HG12 ILE A   5       0.166   5.953   1.248  1.00  1.63           H   new
ATOM      0 HG13 ILE A   5      -1.583   5.852   1.286  1.00  1.63           H   new
ATOM      0 HG21 ILE A   5      -2.838   4.728  -0.395  1.00  0.87           H   new
ATOM      0 HG22 ILE A   5      -2.064   4.103  -1.871  1.00  0.87           H   new
ATOM      0 HG23 ILE A   5      -1.975   3.172  -0.357  1.00  0.87           H   new
ATOM      0 HD11 ILE A   5      -0.590   4.523   3.082  1.00  1.28           H   new
ATOM      0 HD12 ILE A   5      -1.445   3.469   1.931  1.00  1.28           H   new
ATOM      0 HD13 ILE A   5       0.331   3.571   1.893  1.00  1.28           H   new
ATOM     86  N   PHE A   6       0.709   3.592  -3.332  1.00  0.56           N
ATOM     87  CA  PHE A   6       0.907   3.853  -4.736  1.00  0.53           C
ATOM     88  C   PHE A   6      -0.458   3.906  -5.414  1.00  0.83           C
ATOM     89  O   PHE A   6      -1.138   2.879  -5.503  1.00  1.14           O
ATOM     90  CB  PHE A   6       1.733   2.710  -5.325  1.00  0.61           C
ATOM     91  CG  PHE A   6       3.240   2.878  -5.267  1.00  0.68           C
ATOM     92  CD1 PHE A   6       3.897   2.908  -4.024  1.00  1.48           C
ATOM     93  CD2 PHE A   6       3.994   2.953  -6.455  1.00  1.24           C
ATOM     94  CE1 PHE A   6       5.298   2.992  -3.972  1.00  1.75           C
ATOM     95  CE2 PHE A   6       5.395   3.048  -6.402  1.00  1.47           C
ATOM     96  CZ  PHE A   6       6.046   3.071  -5.158  1.00  1.40           C
ATOM      0  H   PHE A   6       0.510   2.614  -3.120  1.00  0.56           H   new
ATOM      0  HA  PHE A   6       1.427   4.799  -4.888  1.00  0.53           H   new
ATOM      0  HB2 PHE A   6       1.470   1.791  -4.802  1.00  0.61           H   new
ATOM      0  HB3 PHE A   6       1.442   2.578  -6.367  1.00  0.61           H   new
ATOM      0  HD1 PHE A   6       3.324   2.866  -3.109  1.00  1.48           H   new
ATOM      0  HD2 PHE A   6       3.492   2.937  -7.411  1.00  1.24           H   new
ATOM      0  HE1 PHE A   6       5.802   2.996  -3.017  1.00  1.75           H   new
ATOM      0  HE2 PHE A   6       5.969   3.103  -7.315  1.00  1.47           H   new
ATOM      0  HZ  PHE A   6       7.122   3.149  -5.113  1.00  1.40           H   new
ATOM    106  N   GLY A   7      -0.835   5.063  -5.953  1.00  1.07           N
ATOM    107  CA  GLY A   7      -1.990   5.171  -6.830  1.00  1.57           C
ATOM    108  C   GLY A   7      -3.300   4.945  -6.080  1.00  1.02           C
ATOM    109  O   GLY A   7      -3.367   5.114  -4.862  1.00  2.31           O
ATOM      0  H   GLY A   7      -0.349   5.946  -5.793  1.00  1.07           H   new
ATOM      0  HA2 GLY A   7      -2.003   6.158  -7.293  1.00  1.57           H   new
ATOM      0  HA3 GLY A   7      -1.903   4.442  -7.636  1.00  1.57           H   new
ATOM    113  N   ARG A   8      -4.381   4.626  -6.796  1.00  1.21           N
ATOM    114  CA  ARG A   8      -5.723   4.626  -6.229  1.00  1.59           C
ATOM    115  C   ARG A   8      -6.598   3.596  -6.921  1.00  1.91           C
ATOM    116  O   ARG A   8      -6.511   3.407  -8.132  1.00  3.03           O
ATOM    117  CB  ARG A   8      -6.352   6.012  -6.423  1.00  3.10           C
ATOM    118  CG  ARG A   8      -7.651   6.269  -5.645  1.00  4.45           C
ATOM    119  CD  ARG A   8      -7.521   6.017  -4.136  1.00  5.61           C
ATOM    120  NE  ARG A   8      -8.328   6.970  -3.352  1.00  6.93           N
ATOM    121  CZ  ARG A   8      -7.862   8.027  -2.663  1.00  7.92           C
ATOM    122  NH1 ARG A   8      -6.617   8.470  -2.824  1.00  7.92           N
ATOM    123  NH2 ARG A   8      -8.645   8.613  -1.766  1.00  9.30           N
ATOM      0  H   ARG A   8      -4.347   4.362  -7.781  1.00  1.21           H   new
ATOM      0  HA  ARG A   8      -5.652   4.381  -5.169  1.00  1.59           H   new
ATOM      0  HB2 ARG A   8      -5.621   6.766  -6.132  1.00  3.10           H   new
ATOM      0  HB3 ARG A   8      -6.552   6.154  -7.485  1.00  3.10           H   new
ATOM      0  HG2 ARG A   8      -7.965   7.300  -5.807  1.00  4.45           H   new
ATOM      0  HG3 ARG A   8      -8.438   5.630  -6.046  1.00  4.45           H   new
ATOM      0  HD2 ARG A   8      -7.837   4.999  -3.909  1.00  5.61           H   new
ATOM      0  HD3 ARG A   8      -6.474   6.099  -3.842  1.00  5.61           H   new
ATOM      0  HE  ARG A   8      -9.336   6.813  -3.330  1.00  6.93           H   new
ATOM      0 HH11 ARG A   8      -5.992   8.006  -3.482  1.00  7.92           H   new
ATOM      0 HH12 ARG A   8      -6.289   9.274  -2.289  1.00  7.92           H   new
ATOM      0 HH21 ARG A   8      -9.589   8.261  -1.605  1.00  9.30           H   new
ATOM      0 HH22 ARG A   8      -8.303   9.415  -1.237  1.00  9.30           H   new
ATOM    137  N   SER A   9      -7.490   2.987  -6.158  1.00  2.42           N
ATOM    138  CA  SER A   9      -8.632   2.245  -6.640  1.00  3.44           C
ATOM    139  C   SER A   9      -9.776   3.220  -6.874  1.00  2.14           C
ATOM    140  O   SER A   9     -10.156   3.490  -8.007  1.00  2.84           O
ATOM    141  CB  SER A   9      -8.987   1.260  -5.527  1.00  5.39           C
ATOM    142  OG  SER A   9      -8.807   1.933  -4.284  1.00  5.66           O
ATOM      0  H   SER A   9      -7.431   3.000  -5.140  1.00  2.42           H   new
ATOM      0  HA  SER A   9      -8.433   1.720  -7.574  1.00  3.44           H   new
ATOM      0  HB2 SER A   9     -10.017   0.918  -5.632  1.00  5.39           H   new
ATOM      0  HB3 SER A   9      -8.351   0.376  -5.580  1.00  5.39           H   new
ATOM      0  HG  SER A   9      -9.144   1.370  -3.556  1.00  5.66           H   new
ATOM    148  N   GLY A  10     -10.332   3.725  -5.775  1.00  1.91           N
ATOM    149  CA  GLY A  10     -11.592   4.448  -5.751  1.00  2.29           C
ATOM    150  C   GLY A  10     -12.704   3.552  -5.203  1.00  2.23           C
ATOM    151  O   GLY A  10     -13.702   4.050  -4.683  1.00  3.72           O
ATOM      0  H   GLY A  10      -9.903   3.638  -4.854  1.00  1.91           H   new
ATOM      0  HA2 GLY A  10     -11.496   5.340  -5.133  1.00  2.29           H   new
ATOM      0  HA3 GLY A  10     -11.847   4.783  -6.756  1.00  2.29           H   new
ATOM    155  N   CYS A  11     -12.523   2.232  -5.280  1.00  1.28           N
ATOM    156  CA  CYS A  11     -13.476   1.252  -4.774  1.00  1.09           C
ATOM    157  C   CYS A  11     -13.370   1.272  -3.245  1.00  1.02           C
ATOM    158  O   CYS A  11     -12.260   1.106  -2.739  1.00  1.13           O
ATOM    159  CB  CYS A  11     -13.120  -0.165  -5.266  1.00  1.26           C
ATOM    160  SG  CYS A  11     -12.694  -0.394  -7.006  1.00  1.92           S
ATOM      0  H   CYS A  11     -11.696   1.811  -5.703  1.00  1.28           H   new
ATOM      0  HA  CYS A  11     -14.479   1.498  -5.122  1.00  1.09           H   new
ATOM      0  HB2 CYS A  11     -12.280  -0.521  -4.670  1.00  1.26           H   new
ATOM      0  HB3 CYS A  11     -13.966  -0.815  -5.044  1.00  1.26           H   new
ATOM      0  HG  CYS A  11     -12.425  -1.647  -7.226  1.00  1.92           H   new
ATOM    165  N   PRO A  12     -14.458   1.450  -2.484  1.00  1.07           N
ATOM    166  CA  PRO A  12     -14.401   1.560  -1.028  1.00  1.07           C
ATOM    167  C   PRO A  12     -13.668   0.375  -0.390  1.00  1.06           C
ATOM    168  O   PRO A  12     -12.812   0.547   0.476  1.00  1.09           O
ATOM    169  CB  PRO A  12     -15.859   1.663  -0.561  1.00  1.26           C
ATOM    170  CG  PRO A  12     -16.678   1.143  -1.742  1.00  1.41           C
ATOM    171  CD  PRO A  12     -15.826   1.509  -2.955  1.00  1.31           C
ATOM      0  HA  PRO A  12     -13.829   2.435  -0.719  1.00  1.07           H   new
ATOM      0  HB2 PRO A  12     -16.032   1.066   0.335  1.00  1.26           H   new
ATOM      0  HB3 PRO A  12     -16.125   2.691  -0.316  1.00  1.26           H   new
ATOM      0  HG2 PRO A  12     -16.840   0.067  -1.675  1.00  1.41           H   new
ATOM      0  HG3 PRO A  12     -17.661   1.611  -1.786  1.00  1.41           H   new
ATOM      0  HD2 PRO A  12     -15.991   0.813  -3.777  1.00  1.31           H   new
ATOM      0  HD3 PRO A  12     -16.073   2.504  -3.325  1.00  1.31           H   new
ATOM    179  N   TYR A  13     -13.973  -0.830  -0.867  1.00  1.18           N
ATOM    180  CA  TYR A  13     -13.439  -2.070  -0.330  1.00  1.44           C
ATOM    181  C   TYR A  13     -11.911  -2.052  -0.267  1.00  1.49           C
ATOM    182  O   TYR A  13     -11.303  -2.357   0.750  1.00  1.78           O
ATOM    183  CB  TYR A  13     -13.933  -3.209  -1.228  1.00  1.64           C
ATOM    184  CG  TYR A  13     -13.367  -4.580  -0.924  1.00  1.45           C
ATOM    185  CD1 TYR A  13     -13.171  -5.006   0.404  1.00  1.75           C
ATOM    186  CD2 TYR A  13     -13.074  -5.453  -1.986  1.00  2.68           C
ATOM    187  CE1 TYR A  13     -12.641  -6.280   0.660  1.00  2.04           C
ATOM    188  CE2 TYR A  13     -12.640  -6.759  -1.718  1.00  3.10           C
ATOM    189  CZ  TYR A  13     -12.404  -7.169  -0.398  1.00  2.37           C
ATOM    190  OH  TYR A  13     -11.947  -8.426  -0.147  1.00  3.08           O
ATOM      0  H   TYR A  13     -14.610  -0.969  -1.651  1.00  1.18           H   new
ATOM      0  HA  TYR A  13     -13.785  -2.206   0.694  1.00  1.44           H   new
ATOM      0  HB2 TYR A  13     -15.019  -3.260  -1.153  1.00  1.64           H   new
ATOM      0  HB3 TYR A  13     -13.696  -2.960  -2.262  1.00  1.64           H   new
ATOM      0  HD1 TYR A  13     -13.428  -4.353   1.225  1.00  1.75           H   new
ATOM      0  HD2 TYR A  13     -13.183  -5.118  -3.007  1.00  2.68           H   new
ATOM      0  HE1 TYR A  13     -12.415  -6.576   1.674  1.00  2.04           H   new
ATOM      0  HE2 TYR A  13     -12.487  -7.452  -2.532  1.00  3.10           H   new
ATOM      0  HH  TYR A  13     -11.838  -8.909  -0.992  1.00  3.08           H   new
ATOM    200  N   SER A  14     -11.266  -1.705  -1.373  1.00  1.36           N
ATOM    201  CA  SER A  14      -9.836  -1.699  -1.479  1.00  1.62           C
ATOM    202  C   SER A  14      -9.251  -0.537  -0.667  1.00  1.40           C
ATOM    203  O   SER A  14      -8.227  -0.676  -0.007  1.00  1.46           O
ATOM    204  CB  SER A  14      -9.614  -1.481  -2.958  1.00  1.75           C
ATOM    205  OG  SER A  14     -10.041  -0.223  -3.410  1.00  2.18           O
ATOM      0  H   SER A  14     -11.741  -1.417  -2.228  1.00  1.36           H   new
ATOM      0  HA  SER A  14      -9.363  -2.605  -1.100  1.00  1.62           H   new
ATOM      0  HB2 SER A  14      -8.553  -1.596  -3.179  1.00  1.75           H   new
ATOM      0  HB3 SER A  14     -10.141  -2.256  -3.514  1.00  1.75           H   new
ATOM      0  HG  SER A  14     -10.973  -0.079  -3.144  1.00  2.18           H   new
ATOM    211  N   VAL A  15      -9.896   0.630  -0.780  1.00  1.13           N
ATOM    212  CA  VAL A  15      -9.562   1.878  -0.080  1.00  0.96           C
ATOM    213  C   VAL A  15      -9.402   1.655   1.424  1.00  0.73           C
ATOM    214  O   VAL A  15      -8.592   2.351   2.040  1.00  0.64           O
ATOM    215  CB  VAL A  15     -10.597   2.976  -0.412  1.00  0.96           C
ATOM    216  CG1 VAL A  15     -10.576   4.155   0.570  1.00  1.11           C
ATOM    217  CG2 VAL A  15     -10.367   3.534  -1.822  1.00  1.05           C
ATOM      0  H   VAL A  15     -10.705   0.736  -1.392  1.00  1.13           H   new
ATOM      0  HA  VAL A  15      -8.593   2.226  -0.438  1.00  0.96           H   new
ATOM      0  HB  VAL A  15     -11.567   2.485  -0.337  1.00  0.96           H   new
ATOM      0 HG11 VAL A  15     -11.328   4.887   0.276  1.00  1.11           H   new
ATOM      0 HG12 VAL A  15     -10.794   3.795   1.575  1.00  1.11           H   new
ATOM      0 HG13 VAL A  15      -9.591   4.621   0.557  1.00  1.11           H   new
ATOM      0 HG21 VAL A  15     -11.108   4.305  -2.033  1.00  1.05           H   new
ATOM      0 HG22 VAL A  15      -9.367   3.964  -1.885  1.00  1.05           H   new
ATOM      0 HG23 VAL A  15     -10.462   2.730  -2.552  1.00  1.05           H   new
ATOM    227  N   ARG A  16     -10.099   0.670   2.000  1.00  0.75           N
ATOM    228  CA  ARG A  16      -9.825   0.193   3.352  1.00  0.68           C
ATOM    229  C   ARG A  16      -8.318   0.151   3.641  1.00  0.54           C
ATOM    230  O   ARG A  16      -7.899   0.521   4.726  1.00  0.49           O
ATOM    231  CB  ARG A  16     -10.412  -1.208   3.566  1.00  0.84           C
ATOM    232  CG  ARG A  16     -11.946  -1.303   3.495  1.00  1.37           C
ATOM    233  CD  ARG A  16     -12.649  -0.508   4.596  1.00  1.96           C
ATOM    234  NE  ARG A  16     -12.173  -0.889   5.938  1.00  2.07           N
ATOM    235  CZ  ARG A  16     -11.502  -0.077   6.772  1.00  3.53           C
ATOM    236  NH1 ARG A  16     -11.590   1.247   6.636  1.00  4.82           N
ATOM    237  NH2 ARG A  16     -10.725  -0.610   7.711  1.00  4.51           N
ATOM      0  H   ARG A  16     -10.868   0.184   1.539  1.00  0.75           H   new
ATOM      0  HA  ARG A  16     -10.297   0.897   4.038  1.00  0.68           H   new
ATOM      0  HB2 ARG A  16      -9.989  -1.878   2.817  1.00  0.84           H   new
ATOM      0  HB3 ARG A  16     -10.088  -1.574   4.540  1.00  0.84           H   new
ATOM      0  HG2 ARG A  16     -12.282  -0.941   2.523  1.00  1.37           H   new
ATOM      0  HG3 ARG A  16     -12.243  -2.350   3.565  1.00  1.37           H   new
ATOM      0  HD2 ARG A  16     -12.479   0.557   4.439  1.00  1.96           H   new
ATOM      0  HD3 ARG A  16     -13.725  -0.672   4.532  1.00  1.96           H   new
ATOM      0  HE  ARG A  16     -12.367  -1.838   6.257  1.00  2.07           H   new
ATOM      0 HH11 ARG A  16     -12.168   1.646   5.897  1.00  4.82           H   new
ATOM      0 HH12 ARG A  16     -11.079   1.860   7.271  1.00  4.82           H   new
ATOM      0 HH21 ARG A  16     -10.644  -1.624   7.791  1.00  4.51           H   new
ATOM      0 HH22 ARG A  16     -10.210  -0.005   8.351  1.00  4.51           H   new
ATOM    251  N   ALA A  17      -7.495  -0.281   2.684  1.00  0.65           N
ATOM    252  CA  ALA A  17      -6.047  -0.318   2.829  1.00  0.56           C
ATOM    253  C   ALA A  17      -5.457   1.049   3.195  1.00  0.49           C
ATOM    254  O   ALA A  17      -4.608   1.147   4.080  1.00  0.44           O
ATOM    255  CB  ALA A  17      -5.407  -0.805   1.527  1.00  0.59           C
ATOM      0  H   ALA A  17      -7.823  -0.618   1.779  1.00  0.65           H   new
ATOM      0  HA  ALA A  17      -5.827  -1.005   3.646  1.00  0.56           H   new
ATOM      0  HB1 ALA A  17      -4.323  -0.831   1.642  1.00  0.59           H   new
ATOM      0  HB2 ALA A  17      -5.771  -1.806   1.295  1.00  0.59           H   new
ATOM      0  HB3 ALA A  17      -5.670  -0.126   0.716  1.00  0.59           H   new
ATOM    261  N   LYS A  18      -5.856   2.100   2.473  1.00  0.55           N
ATOM    262  CA  LYS A  18      -5.287   3.425   2.675  1.00  0.53           C
ATOM    263  C   LYS A  18      -5.706   3.841   4.080  1.00  0.47           C
ATOM    264  O   LYS A  18      -4.882   4.267   4.887  1.00  0.51           O
ATOM    265  CB  LYS A  18      -5.825   4.432   1.651  1.00  0.64           C
ATOM    266  CG  LYS A  18      -5.454   5.858   2.108  1.00  0.86           C
ATOM    267  CD  LYS A  18      -5.884   6.898   1.082  1.00  1.33           C
ATOM    268  CE  LYS A  18      -7.380   7.228   1.222  1.00  2.58           C
ATOM    269  NZ  LYS A  18      -7.634   8.629   1.618  1.00  2.51           N
ATOM      0  H   LYS A  18      -6.570   2.054   1.746  1.00  0.55           H   new
ATOM      0  HA  LYS A  18      -4.204   3.404   2.552  1.00  0.53           H   new
ATOM      0  HB2 LYS A  18      -5.403   4.230   0.667  1.00  0.64           H   new
ATOM      0  HB3 LYS A  18      -6.907   4.335   1.560  1.00  0.64           H   new
ATOM      0  HG2 LYS A  18      -5.930   6.070   3.065  1.00  0.86           H   new
ATOM      0  HG3 LYS A  18      -4.377   5.923   2.265  1.00  0.86           H   new
ATOM      0  HD2 LYS A  18      -5.295   7.806   1.211  1.00  1.33           H   new
ATOM      0  HD3 LYS A  18      -5.683   6.527   0.077  1.00  1.33           H   new
ATOM      0  HE2 LYS A  18      -7.879   7.029   0.274  1.00  2.58           H   new
ATOM      0  HE3 LYS A  18      -7.824   6.562   1.962  1.00  2.58           H   new
ATOM      0  HZ1 LYS A  18      -8.659   8.788   1.695  1.00  2.51           H   new
ATOM      0  HZ2 LYS A  18      -7.184   8.817   2.537  1.00  2.51           H   new
ATOM      0  HZ3 LYS A  18      -7.238   9.270   0.901  1.00  2.51           H   new
ATOM    283  N   ASP A  19      -7.017   3.759   4.325  1.00  0.44           N
ATOM    284  CA  ASP A  19      -7.605   4.136   5.602  1.00  0.51           C
ATOM    285  C   ASP A  19      -6.865   3.451   6.746  1.00  0.51           C
ATOM    286  O   ASP A  19      -6.514   4.076   7.739  1.00  0.58           O
ATOM    287  CB  ASP A  19      -9.082   3.743   5.628  1.00  0.62           C
ATOM    288  CG  ASP A  19      -9.660   4.033   6.993  1.00  0.92           C
ATOM    289  OD1 ASP A  19      -9.856   5.221   7.310  1.00  1.97           O
ATOM    290  OD2 ASP A  19      -9.886   3.062   7.744  1.00  1.74           O
ATOM      0  H   ASP A  19      -7.696   3.428   3.639  1.00  0.44           H   new
ATOM      0  HA  ASP A  19      -7.519   5.216   5.725  1.00  0.51           H   new
ATOM      0  HB2 ASP A  19      -9.629   4.297   4.865  1.00  0.62           H   new
ATOM      0  HB3 ASP A  19      -9.191   2.684   5.393  1.00  0.62           H   new
ATOM    295  N   LEU A  20      -6.614   2.159   6.571  1.00  0.49           N
ATOM    296  CA  LEU A  20      -5.911   1.319   7.521  1.00  0.50           C
ATOM    297  C   LEU A  20      -4.515   1.875   7.774  1.00  0.39           C
ATOM    298  O   LEU A  20      -4.153   2.085   8.926  1.00  0.41           O
ATOM    299  CB  LEU A  20      -5.884  -0.120   6.995  1.00  0.60           C
ATOM    300  CG  LEU A  20      -5.309  -1.181   7.944  1.00  0.70           C
ATOM    301  CD1 LEU A  20      -6.008  -1.162   9.307  1.00  1.85           C
ATOM    302  CD2 LEU A  20      -5.543  -2.555   7.304  1.00  1.68           C
ATOM      0  H   LEU A  20      -6.906   1.654   5.734  1.00  0.49           H   new
ATOM      0  HA  LEU A  20      -6.428   1.313   8.480  1.00  0.50           H   new
ATOM      0  HB2 LEU A  20      -6.903  -0.409   6.736  1.00  0.60           H   new
ATOM      0  HB3 LEU A  20      -5.304  -0.136   6.072  1.00  0.60           H   new
ATOM      0  HG  LEU A  20      -4.250  -0.974   8.101  1.00  0.70           H   new
ATOM      0 HD11 LEU A  20      -5.573  -1.927   9.950  1.00  1.85           H   new
ATOM      0 HD12 LEU A  20      -5.878  -0.183   9.769  1.00  1.85           H   new
ATOM      0 HD13 LEU A  20      -7.071  -1.362   9.174  1.00  1.85           H   new
ATOM      0 HD21 LEU A  20      -5.145  -3.333   7.956  1.00  1.68           H   new
ATOM      0 HD22 LEU A  20      -6.612  -2.713   7.162  1.00  1.68           H   new
ATOM      0 HD23 LEU A  20      -5.039  -2.597   6.339  1.00  1.68           H   new
ATOM    314  N   ALA A  21      -3.722   2.121   6.727  1.00  0.34           N
ATOM    315  CA  ALA A  21      -2.385   2.688   6.913  1.00  0.36           C
ATOM    316  C   ALA A  21      -2.456   4.006   7.676  1.00  0.37           C
ATOM    317  O   ALA A  21      -1.696   4.217   8.622  1.00  0.39           O
ATOM    318  CB  ALA A  21      -1.702   2.904   5.556  1.00  0.48           C
ATOM      0  H   ALA A  21      -3.978   1.940   5.756  1.00  0.34           H   new
ATOM      0  HA  ALA A  21      -1.796   1.981   7.497  1.00  0.36           H   new
ATOM      0  HB1 ALA A  21      -0.709   3.326   5.711  1.00  0.48           H   new
ATOM      0  HB2 ALA A  21      -1.613   1.949   5.037  1.00  0.48           H   new
ATOM      0  HB3 ALA A  21      -2.298   3.590   4.954  1.00  0.48           H   new
ATOM    324  N   GLU A  22      -3.358   4.897   7.272  1.00  0.43           N
ATOM    325  CA  GLU A  22      -3.467   6.184   7.926  1.00  0.52           C
ATOM    326  C   GLU A  22      -3.796   5.971   9.401  1.00  0.51           C
ATOM    327  O   GLU A  22      -3.097   6.473  10.279  1.00  0.55           O
ATOM    328  CB  GLU A  22      -4.496   7.064   7.208  1.00  0.70           C
ATOM    329  CG  GLU A  22      -4.651   8.374   7.986  1.00  0.92           C
ATOM    330  CD  GLU A  22      -5.331   9.463   7.199  1.00  1.66           C
ATOM    331  OE1 GLU A  22      -4.962   9.666   6.025  1.00  2.71           O
ATOM    332  OE2 GLU A  22      -6.191  10.136   7.800  1.00  2.37           O
ATOM      0  H   GLU A  22      -4.013   4.748   6.504  1.00  0.43           H   new
ATOM      0  HA  GLU A  22      -2.517   6.716   7.872  1.00  0.52           H   new
ATOM      0  HB2 GLU A  22      -4.173   7.267   6.187  1.00  0.70           H   new
ATOM      0  HB3 GLU A  22      -5.454   6.548   7.142  1.00  0.70           H   new
ATOM      0  HG2 GLU A  22      -5.222   8.182   8.894  1.00  0.92           H   new
ATOM      0  HG3 GLU A  22      -3.666   8.722   8.296  1.00  0.92           H   new
ATOM    339  N   LYS A  23      -4.853   5.215   9.683  1.00  0.52           N
ATOM    340  CA  LYS A  23      -5.310   4.983  11.038  1.00  0.61           C
ATOM    341  C   LYS A  23      -4.193   4.363  11.871  1.00  0.54           C
ATOM    342  O   LYS A  23      -3.941   4.781  12.999  1.00  0.63           O
ATOM    343  CB  LYS A  23      -6.565   4.106  11.030  1.00  0.85           C
ATOM    344  CG  LYS A  23      -7.223   4.049  12.413  1.00  1.72           C
ATOM    345  CD  LYS A  23      -7.643   5.445  12.899  1.00  3.26           C
ATOM    346  CE  LYS A  23      -8.650   5.365  14.052  1.00  3.99           C
ATOM    347  NZ  LYS A  23      -7.999   5.047  15.335  1.00  4.64           N
ATOM      0  H   LYS A  23      -5.415   4.747   8.972  1.00  0.52           H   new
ATOM      0  HA  LYS A  23      -5.575   5.936  11.497  1.00  0.61           H   new
ATOM      0  HB2 LYS A  23      -7.278   4.496  10.303  1.00  0.85           H   new
ATOM      0  HB3 LYS A  23      -6.303   3.098  10.709  1.00  0.85           H   new
ATOM      0  HG2 LYS A  23      -8.097   3.399  12.374  1.00  1.72           H   new
ATOM      0  HG3 LYS A  23      -6.529   3.608  13.129  1.00  1.72           H   new
ATOM      0  HD2 LYS A  23      -6.761   5.998  13.224  1.00  3.26           H   new
ATOM      0  HD3 LYS A  23      -8.081   6.002  12.071  1.00  3.26           H   new
ATOM      0  HE2 LYS A  23      -9.177   6.315  14.139  1.00  3.99           H   new
ATOM      0  HE3 LYS A  23      -9.398   4.605  13.827  1.00  3.99           H   new
ATOM      0  HZ1 LYS A  23      -8.666   5.217  16.114  1.00  4.64           H   new
ATOM      0  HZ2 LYS A  23      -7.709   4.048  15.339  1.00  4.64           H   new
ATOM      0  HZ3 LYS A  23      -7.161   5.651  15.458  1.00  4.64           H   new
ATOM    361  N   LEU A  24      -3.478   3.399  11.298  1.00  0.48           N
ATOM    362  CA  LEU A  24      -2.316   2.819  11.937  1.00  0.51           C
ATOM    363  C   LEU A  24      -1.280   3.899  12.266  1.00  0.52           C
ATOM    364  O   LEU A  24      -0.633   3.802  13.301  1.00  0.64           O
ATOM    365  CB  LEU A  24      -1.746   1.696  11.057  1.00  0.55           C
ATOM    366  CG  LEU A  24      -2.505   0.370  11.205  1.00  0.68           C
ATOM    367  CD1 LEU A  24      -1.894  -0.658  10.244  1.00  0.81           C
ATOM    368  CD2 LEU A  24      -2.407  -0.132  12.651  1.00  0.86           C
ATOM      0  H   LEU A  24      -3.692   3.004  10.382  1.00  0.48           H   new
ATOM      0  HA  LEU A  24      -2.607   2.373  12.888  1.00  0.51           H   new
ATOM      0  HB2 LEU A  24      -1.775   2.010  10.014  1.00  0.55           H   new
ATOM      0  HB3 LEU A  24      -0.698   1.538  11.313  1.00  0.55           H   new
ATOM      0  HG  LEU A  24      -3.558   0.517  10.963  1.00  0.68           H   new
ATOM      0 HD11 LEU A  24      -2.425  -1.605  10.339  1.00  0.81           H   new
ATOM      0 HD12 LEU A  24      -1.981  -0.295   9.220  1.00  0.81           H   new
ATOM      0 HD13 LEU A  24      -0.842  -0.805  10.489  1.00  0.81           H   new
ATOM      0 HD21 LEU A  24      -2.948  -1.073  12.747  1.00  0.86           H   new
ATOM      0 HD22 LEU A  24      -1.360  -0.287  12.912  1.00  0.86           H   new
ATOM      0 HD23 LEU A  24      -2.843   0.607  13.323  1.00  0.86           H   new
ATOM    380  N   SER A  25      -1.145   4.942  11.447  1.00  0.54           N
ATOM    381  CA  SER A  25      -0.228   6.052  11.706  1.00  0.65           C
ATOM    382  C   SER A  25      -0.841   7.067  12.694  1.00  0.89           C
ATOM    383  O   SER A  25      -0.321   8.170  12.872  1.00  1.50           O
ATOM    384  CB  SER A  25       0.178   6.685  10.363  1.00  0.64           C
ATOM    385  OG  SER A  25       1.373   7.443  10.457  1.00  2.11           O
ATOM      0  H   SER A  25      -1.672   5.041  10.580  1.00  0.54           H   new
ATOM      0  HA  SER A  25       0.675   5.684  12.192  1.00  0.65           H   new
ATOM      0  HB2 SER A  25       0.308   5.899   9.619  1.00  0.64           H   new
ATOM      0  HB3 SER A  25      -0.629   7.327  10.010  1.00  0.64           H   new
ATOM      0  HG  SER A  25       2.125   6.845  10.649  1.00  2.11           H   new
ATOM    391  N   ASN A  26      -1.979   6.745  13.311  1.00  0.85           N
ATOM    392  CA  ASN A  26      -2.473   7.344  14.538  1.00  1.05           C
ATOM    393  C   ASN A  26      -2.262   6.389  15.708  1.00  1.07           C
ATOM    394  O   ASN A  26      -1.946   6.827  16.808  1.00  1.31           O
ATOM    395  CB  ASN A  26      -3.960   7.697  14.452  1.00  1.23           C
ATOM    396  CG  ASN A  26      -4.394   8.621  13.320  1.00  1.37           C
ATOM    397  OD1 ASN A  26      -4.903   9.705  13.577  1.00  2.37           O
ATOM    398  ND2 ASN A  26      -4.273   8.241  12.060  1.00  1.64           N
ATOM      0  H   ASN A  26      -2.605   6.026  12.947  1.00  0.85           H   new
ATOM      0  HA  ASN A  26      -1.911   8.265  14.691  1.00  1.05           H   new
ATOM      0  HB2 ASN A  26      -4.523   6.768  14.364  1.00  1.23           H   new
ATOM      0  HB3 ASN A  26      -4.252   8.158  15.395  1.00  1.23           H   new
ATOM      0 HD21 ASN A  26      -4.602   8.849  11.310  1.00  1.64           H   new
ATOM      0 HD22 ASN A  26      -3.850   7.340  11.837  1.00  1.64           H   new
ATOM    405  N   GLU A  27      -2.456   5.086  15.487  1.00  0.98           N
ATOM    406  CA  GLU A  27      -2.426   4.089  16.549  1.00  1.14           C
ATOM    407  C   GLU A  27      -0.980   3.865  17.000  1.00  1.15           C
ATOM    408  O   GLU A  27      -0.706   3.798  18.198  1.00  1.48           O
ATOM    409  CB  GLU A  27      -3.021   2.767  16.015  1.00  1.28           C
ATOM    410  CG  GLU A  27      -4.382   2.409  16.614  1.00  1.86           C
ATOM    411  CD  GLU A  27      -5.517   3.314  16.188  1.00  2.41           C
ATOM    412  OE1 GLU A  27      -5.617   4.445  16.705  1.00  3.92           O
ATOM    413  OE2 GLU A  27      -6.401   2.864  15.435  1.00  2.73           O
ATOM      0  H   GLU A  27      -2.638   4.696  14.562  1.00  0.98           H   new
ATOM      0  HA  GLU A  27      -3.013   4.435  17.399  1.00  1.14           H   new
ATOM      0  HB2 GLU A  27      -3.120   2.837  14.932  1.00  1.28           H   new
ATOM      0  HB3 GLU A  27      -2.321   1.957  16.220  1.00  1.28           H   new
ATOM      0  HG2 GLU A  27      -4.628   1.384  16.336  1.00  1.86           H   new
ATOM      0  HG3 GLU A  27      -4.304   2.434  17.701  1.00  1.86           H   new
ATOM    420  N   ARG A  28      -0.078   3.700  16.040  1.00  0.99           N
ATOM    421  CA  ARG A  28       1.349   3.597  16.276  1.00  1.05           C
ATOM    422  C   ARG A  28       1.942   5.000  16.152  1.00  1.14           C
ATOM    423  O   ARG A  28       1.346   5.861  15.501  1.00  1.35           O
ATOM    424  CB  ARG A  28       1.979   2.645  15.254  1.00  0.97           C
ATOM    425  CG  ARG A  28       1.171   1.352  15.095  1.00  1.30           C
ATOM    426  CD  ARG A  28       2.004   0.275  14.377  1.00  1.61           C
ATOM    427  NE  ARG A  28       1.176  -0.783  13.770  1.00  2.57           N
ATOM    428  CZ  ARG A  28       0.322  -1.598  14.415  1.00  3.54           C
ATOM    429  NH1 ARG A  28       0.191  -1.513  15.734  1.00  3.92           N
ATOM    430  NH2 ARG A  28      -0.405  -2.471  13.717  1.00  4.97           N
ATOM      0  H   ARG A  28      -0.329   3.633  15.054  1.00  0.99           H   new
ATOM      0  HA  ARG A  28       1.551   3.196  17.269  1.00  1.05           H   new
ATOM      0  HB2 ARG A  28       2.053   3.147  14.289  1.00  0.97           H   new
ATOM      0  HB3 ARG A  28       2.995   2.401  15.565  1.00  0.97           H   new
ATOM      0  HG2 ARG A  28       0.863   0.987  16.075  1.00  1.30           H   new
ATOM      0  HG3 ARG A  28       0.261   1.553  14.529  1.00  1.30           H   new
ATOM      0  HD2 ARG A  28       2.607   0.747  13.601  1.00  1.61           H   new
ATOM      0  HD3 ARG A  28       2.696  -0.176  15.088  1.00  1.61           H   new
ATOM      0  HE  ARG A  28       1.259  -0.910  12.761  1.00  2.57           H   new
ATOM      0 HH11 ARG A  28       0.738  -0.830  16.258  1.00  3.92           H   new
ATOM      0 HH12 ARG A  28      -0.457  -2.131  16.223  1.00  3.92           H   new
ATOM      0 HH21 ARG A  28      -0.311  -2.517  12.702  1.00  4.97           H   new
ATOM      0 HH22 ARG A  28      -1.055  -3.093  14.198  1.00  4.97           H   new
ATOM    444  N   ASP A  29       3.119   5.212  16.744  1.00  1.28           N
ATOM    445  CA  ASP A  29       3.764   6.515  16.825  1.00  1.59           C
ATOM    446  C   ASP A  29       5.229   6.317  16.474  1.00  1.07           C
ATOM    447  O   ASP A  29       6.099   6.465  17.333  1.00  1.87           O
ATOM    448  CB  ASP A  29       3.643   7.132  18.228  1.00  2.42           C
ATOM    449  CG  ASP A  29       2.221   7.309  18.688  1.00  3.84           C
ATOM    450  OD1 ASP A  29       1.537   8.208  18.160  1.00  4.94           O
ATOM    451  OD2 ASP A  29       1.849   6.617  19.656  1.00  4.73           O
ATOM      0  H   ASP A  29       3.657   4.467  17.187  1.00  1.28           H   new
ATOM      0  HA  ASP A  29       3.276   7.203  16.135  1.00  1.59           H   new
ATOM      0  HB2 ASP A  29       4.170   6.498  18.941  1.00  2.42           H   new
ATOM      0  HB3 ASP A  29       4.141   8.101  18.234  1.00  2.42           H   new
ATOM    456  N   ASP A  30       5.488   5.894  15.243  1.00  0.99           N
ATOM    457  CA  ASP A  30       6.825   5.775  14.681  1.00  1.40           C
ATOM    458  C   ASP A  30       6.692   5.879  13.179  1.00  1.38           C
ATOM    459  O   ASP A  30       7.275   6.750  12.542  1.00  1.72           O
ATOM    460  CB  ASP A  30       7.485   4.430  15.003  1.00  2.01           C
ATOM    461  CG  ASP A  30       8.745   4.275  14.178  1.00  2.87           C
ATOM    462  OD1 ASP A  30       9.711   5.019  14.455  1.00  3.89           O
ATOM    463  OD2 ASP A  30       8.795   3.387  13.295  1.00  3.38           O
ATOM      0  H   ASP A  30       4.753   5.617  14.592  1.00  0.99           H   new
ATOM      0  HA  ASP A  30       7.447   6.560  15.110  1.00  1.40           H   new
ATOM      0  HB2 ASP A  30       7.724   4.375  16.065  1.00  2.01           H   new
ATOM      0  HB3 ASP A  30       6.795   3.614  14.789  1.00  2.01           H   new
ATOM    468  N   PHE A  31       5.908   4.968  12.612  1.00  1.08           N
ATOM    469  CA  PHE A  31       5.875   4.810  11.194  1.00  0.94           C
ATOM    470  C   PHE A  31       4.910   5.847  10.647  1.00  0.88           C
ATOM    471  O   PHE A  31       3.736   5.919  11.012  1.00  1.11           O
ATOM    472  CB  PHE A  31       5.541   3.349  10.871  1.00  0.82           C
ATOM    473  CG  PHE A  31       4.107   2.994  10.550  1.00  0.60           C
ATOM    474  CD1 PHE A  31       3.203   2.774  11.598  1.00  2.13           C
ATOM    475  CD2 PHE A  31       3.646   3.089   9.224  1.00  2.02           C
ATOM    476  CE1 PHE A  31       1.829   2.712  11.326  1.00  2.43           C
ATOM    477  CE2 PHE A  31       2.269   3.056   8.960  1.00  2.02           C
ATOM    478  CZ  PHE A  31       1.358   2.897  10.014  1.00  1.36           C
ATOM      0  H   PHE A  31       5.294   4.337  13.127  1.00  1.08           H   new
ATOM      0  HA  PHE A  31       6.832   4.994  10.707  1.00  0.94           H   new
ATOM      0  HB2 PHE A  31       6.156   3.048  10.023  1.00  0.82           H   new
ATOM      0  HB3 PHE A  31       5.851   2.742  11.721  1.00  0.82           H   new
ATOM      0  HD1 PHE A  31       3.563   2.653  12.609  1.00  2.13           H   new
ATOM      0  HD2 PHE A  31       4.351   3.187   8.412  1.00  2.02           H   new
ATOM      0  HE1 PHE A  31       1.130   2.522  12.127  1.00  2.43           H   new
ATOM      0  HE2 PHE A  31       1.911   3.153   7.946  1.00  2.02           H   new
ATOM      0  HZ  PHE A  31       0.296   2.917   9.818  1.00  1.36           H   new
ATOM    488  N   GLN A  32       5.454   6.690   9.782  1.00  0.97           N
ATOM    489  CA  GLN A  32       4.657   7.539   8.944  1.00  0.89           C
ATOM    490  C   GLN A  32       4.285   6.665   7.761  1.00  0.66           C
ATOM    491  O   GLN A  32       4.949   5.665   7.466  1.00  0.76           O
ATOM    492  CB  GLN A  32       5.510   8.733   8.508  1.00  1.03           C
ATOM    493  CG  GLN A  32       5.442   9.861   9.531  1.00  1.53           C
ATOM    494  CD  GLN A  32       4.259  10.777   9.266  1.00  3.07           C
ATOM    495  OE1 GLN A  32       3.299  10.398   8.601  1.00  4.19           O
ATOM    496  NE2 GLN A  32       4.328  12.013   9.732  1.00  4.11           N
ATOM      0  H   GLN A  32       6.460   6.796   9.650  1.00  0.97           H   new
ATOM      0  HA  GLN A  32       3.769   7.936   9.436  1.00  0.89           H   new
ATOM      0  HB2 GLN A  32       6.545   8.416   8.380  1.00  1.03           H   new
ATOM      0  HB3 GLN A  32       5.165   9.095   7.540  1.00  1.03           H   new
ATOM      0  HG2 GLN A  32       5.362   9.441  10.534  1.00  1.53           H   new
ATOM      0  HG3 GLN A  32       6.366  10.439   9.500  1.00  1.53           H   new
ATOM      0 HE21 GLN A  32       5.135  12.306  10.282  1.00  4.11           H   new
ATOM      0 HE22 GLN A  32       3.574  12.673   9.541  1.00  4.11           H   new
ATOM    505  N   TYR A  33       3.225   7.048   7.070  1.00  0.59           N
ATOM    506  CA  TYR A  33       3.023   6.582   5.723  1.00  0.53           C
ATOM    507  C   TYR A  33       3.224   7.797   4.823  1.00  0.51           C
ATOM    508  O   TYR A  33       3.270   8.927   5.317  1.00  0.66           O
ATOM    509  CB  TYR A  33       1.633   5.944   5.581  1.00  0.68           C
ATOM    510  CG  TYR A  33       0.484   6.885   5.278  1.00  0.69           C
ATOM    511  CD1 TYR A  33      -0.241   7.524   6.301  1.00  1.78           C
ATOM    512  CD2 TYR A  33       0.089   7.058   3.944  1.00  1.87           C
ATOM    513  CE1 TYR A  33      -1.399   8.263   5.981  1.00  1.82           C
ATOM    514  CE2 TYR A  33      -1.122   7.692   3.643  1.00  1.85           C
ATOM    515  CZ  TYR A  33      -1.878   8.282   4.660  1.00  0.80           C
ATOM    516  OH  TYR A  33      -3.106   8.781   4.349  1.00  0.98           O
ATOM      0  H   TYR A  33       2.501   7.675   7.422  1.00  0.59           H   new
ATOM      0  HA  TYR A  33       3.726   5.798   5.442  1.00  0.53           H   new
ATOM      0  HB2 TYR A  33       1.680   5.197   4.789  1.00  0.68           H   new
ATOM      0  HB3 TYR A  33       1.405   5.414   6.506  1.00  0.68           H   new
ATOM      0  HD1 TYR A  33       0.088   7.449   7.327  1.00  1.78           H   new
ATOM      0  HD2 TYR A  33       0.722   6.701   3.145  1.00  1.87           H   new
ATOM      0  HE1 TYR A  33      -1.918   8.814   6.751  1.00  1.82           H   new
ATOM      0  HE2 TYR A  33      -1.473   7.725   2.622  1.00  1.85           H   new
ATOM      0  HH  TYR A  33      -3.561   9.066   5.169  1.00  0.98           H   new
ATOM    526  N   GLN A  34       3.318   7.589   3.518  1.00  0.59           N
ATOM    527  CA  GLN A  34       3.176   8.647   2.539  1.00  0.62           C
ATOM    528  C   GLN A  34       2.327   8.102   1.408  1.00  0.58           C
ATOM    529  O   GLN A  34       2.418   6.927   1.079  1.00  0.67           O
ATOM    530  CB  GLN A  34       4.549   9.054   2.014  1.00  0.73           C
ATOM    531  CG  GLN A  34       4.540  10.473   1.449  1.00  1.57           C
ATOM    532  CD  GLN A  34       5.471  10.592   0.261  1.00  1.74           C
ATOM    533  OE1 GLN A  34       6.678  10.759   0.413  1.00  2.67           O
ATOM    534  NE2 GLN A  34       4.920  10.489  -0.936  1.00  2.55           N
ATOM      0  H   GLN A  34       3.497   6.672   3.109  1.00  0.59           H   new
ATOM      0  HA  GLN A  34       2.708   9.526   2.982  1.00  0.62           H   new
ATOM      0  HB2 GLN A  34       5.281   8.988   2.819  1.00  0.73           H   new
ATOM      0  HB3 GLN A  34       4.864   8.356   1.239  1.00  0.73           H   new
ATOM      0  HG2 GLN A  34       3.527  10.742   1.150  1.00  1.57           H   new
ATOM      0  HG3 GLN A  34       4.842  11.178   2.224  1.00  1.57           H   new
ATOM      0 HE21 GLN A  34       3.913  10.351  -1.024  1.00  2.55           H   new
ATOM      0 HE22 GLN A  34       5.502  10.548  -1.772  1.00  2.55           H   new
ATOM    543  N   TYR A  35       1.511   8.940   0.798  1.00  0.65           N
ATOM    544  CA  TYR A  35       0.762   8.562  -0.387  1.00  0.62           C
ATOM    545  C   TYR A  35       1.467   9.171  -1.593  1.00  0.66           C
ATOM    546  O   TYR A  35       2.044  10.256  -1.482  1.00  0.83           O
ATOM    547  CB  TYR A  35      -0.704   8.972  -0.238  1.00  0.73           C
ATOM    548  CG  TYR A  35      -1.607   8.429  -1.323  1.00  0.80           C
ATOM    549  CD1 TYR A  35      -1.584   9.096  -2.563  1.00  2.33           C
ATOM    550  CD2 TYR A  35      -2.680   7.571  -1.025  1.00  1.47           C
ATOM    551  CE1 TYR A  35      -2.534   8.802  -3.545  1.00  2.56           C
ATOM    552  CE2 TYR A  35      -3.578   7.203  -2.042  1.00  1.40           C
ATOM    553  CZ  TYR A  35      -3.488   7.813  -3.302  1.00  1.25           C
ATOM    554  OH  TYR A  35      -4.418   7.533  -4.250  1.00  1.60           O
ATOM      0  H   TYR A  35       1.348   9.898   1.107  1.00  0.65           H   new
ATOM      0  HA  TYR A  35       0.739   7.482  -0.529  1.00  0.62           H   new
ATOM      0  HB2 TYR A  35      -1.070   8.630   0.730  1.00  0.73           H   new
ATOM      0  HB3 TYR A  35      -0.768  10.060  -0.237  1.00  0.73           H   new
ATOM      0  HD1 TYR A  35      -0.826   9.841  -2.757  1.00  2.33           H   new
ATOM      0  HD2 TYR A  35      -2.814   7.197  -0.021  1.00  1.47           H   new
ATOM      0  HE1 TYR A  35      -2.530   9.336  -4.484  1.00  2.56           H   new
ATOM      0  HE2 TYR A  35      -4.333   6.454  -1.854  1.00  1.40           H   new
ATOM      0  HH  TYR A  35      -4.312   6.606  -4.549  1.00  1.60           H   new
ATOM    564  N   VAL A  36       1.456   8.454  -2.712  1.00  0.69           N
ATOM    565  CA  VAL A  36       2.186   8.750  -3.926  1.00  0.78           C
ATOM    566  C   VAL A  36       1.214   8.574  -5.100  1.00  0.89           C
ATOM    567  O   VAL A  36       0.488   7.578  -5.176  1.00  0.96           O
ATOM    568  CB  VAL A  36       3.378   7.782  -4.012  1.00  0.73           C
ATOM    569  CG1 VAL A  36       4.126   7.960  -5.338  1.00  0.96           C
ATOM    570  CG2 VAL A  36       4.390   8.035  -2.895  1.00  0.78           C
ATOM      0  H   VAL A  36       0.902   7.601  -2.794  1.00  0.69           H   new
ATOM      0  HA  VAL A  36       2.575   9.768  -3.945  1.00  0.78           H   new
ATOM      0  HB  VAL A  36       2.964   6.777  -3.926  1.00  0.73           H   new
ATOM      0 HG11 VAL A  36       4.965   7.266  -5.378  1.00  0.96           H   new
ATOM      0 HG12 VAL A  36       3.448   7.759  -6.168  1.00  0.96           H   new
ATOM      0 HG13 VAL A  36       4.497   8.982  -5.412  1.00  0.96           H   new
ATOM      0 HG21 VAL A  36       5.218   7.332  -2.988  1.00  0.78           H   new
ATOM      0 HG22 VAL A  36       4.769   9.054  -2.971  1.00  0.78           H   new
ATOM      0 HG23 VAL A  36       3.906   7.899  -1.928  1.00  0.78           H   new
ATOM    580  N   ASP A  37       1.182   9.558  -6.004  1.00  1.20           N
ATOM    581  CA  ASP A  37       0.393   9.506  -7.222  1.00  1.41           C
ATOM    582  C   ASP A  37       1.174   8.984  -8.419  1.00  1.33           C
ATOM    583  O   ASP A  37       1.998   9.697  -8.997  1.00  1.44           O
ATOM    584  CB  ASP A  37      -0.205  10.864  -7.590  1.00  1.78           C
ATOM    585  CG  ASP A  37      -1.248  11.361  -6.630  1.00  2.18           C
ATOM    586  OD1 ASP A  37      -2.329  10.741  -6.599  1.00  2.46           O
ATOM    587  OD2 ASP A  37      -1.031  12.435  -6.025  1.00  3.43           O
ATOM      0  H   ASP A  37       1.714  10.422  -5.901  1.00  1.20           H   new
ATOM      0  HA  ASP A  37      -0.410   8.805  -6.994  1.00  1.41           H   new
ATOM      0  HB2 ASP A  37       0.599  11.598  -7.647  1.00  1.78           H   new
ATOM      0  HB3 ASP A  37      -0.646  10.796  -8.584  1.00  1.78           H   new
ATOM    592  N   ILE A  38       0.751   7.824  -8.914  1.00  1.22           N
ATOM    593  CA  ILE A  38       1.076   7.348 -10.245  1.00  1.13           C
ATOM    594  C   ILE A  38       0.818   8.422 -11.316  1.00  1.31           C
ATOM    595  O   ILE A  38       1.504   8.433 -12.337  1.00  1.24           O
ATOM    596  CB  ILE A  38       0.313   6.046 -10.550  1.00  1.24           C
ATOM    597  CG1 ILE A  38      -1.214   6.244 -10.536  1.00  1.60           C
ATOM    598  CG2 ILE A  38       0.748   4.925  -9.594  1.00  1.29           C
ATOM    599  CD1 ILE A  38      -1.968   4.967 -10.913  1.00  1.61           C
ATOM      0  H   ILE A  38       0.162   7.180  -8.387  1.00  1.22           H   new
ATOM      0  HA  ILE A  38       2.144   7.131 -10.273  1.00  1.13           H   new
ATOM      0  HB  ILE A  38       0.574   5.747 -11.565  1.00  1.24           H   new
ATOM      0 HG12 ILE A  38      -1.527   6.569  -9.544  1.00  1.60           H   new
ATOM      0 HG13 ILE A  38      -1.481   7.040 -11.231  1.00  1.60           H   new
ATOM      0 HG21 ILE A  38       0.197   4.014  -9.827  1.00  1.29           H   new
ATOM      0 HG22 ILE A  38       1.816   4.742  -9.710  1.00  1.29           H   new
ATOM      0 HG23 ILE A  38       0.540   5.222  -8.566  1.00  1.29           H   new
ATOM      0 HD11 ILE A  38      -3.041   5.157 -10.889  1.00  1.61           H   new
ATOM      0 HD12 ILE A  38      -1.677   4.656 -11.916  1.00  1.61           H   new
ATOM      0 HD13 ILE A  38      -1.724   4.177 -10.203  1.00  1.61           H   new
ATOM    611  N   ARG A  39      -0.143   9.336 -11.113  1.00  1.73           N
ATOM    612  CA  ARG A  39      -0.413  10.391 -12.090  1.00  2.05           C
ATOM    613  C   ARG A  39       0.656  11.475 -12.089  1.00  2.24           C
ATOM    614  O   ARG A  39       0.859  12.154 -13.091  1.00  2.87           O
ATOM    615  CB  ARG A  39      -1.823  10.993 -11.956  1.00  2.69           C
ATOM    616  CG  ARG A  39      -2.090  11.571 -10.563  1.00  3.93           C
ATOM    617  CD  ARG A  39      -3.129  12.692 -10.514  1.00  4.96           C
ATOM    618  NE  ARG A  39      -4.463  12.284 -10.970  1.00  5.18           N
ATOM    619  CZ  ARG A  39      -5.548  13.063 -10.829  1.00  6.18           C
ATOM    620  NH1 ARG A  39      -5.451  14.268 -10.268  1.00  6.91           N
ATOM    621  NH2 ARG A  39      -6.738  12.632 -11.234  1.00  6.87           N
ATOM      0  H   ARG A  39      -0.740   9.363 -10.286  1.00  1.73           H   new
ATOM      0  HA  ARG A  39      -0.375   9.899 -13.062  1.00  2.05           H   new
ATOM      0  HB2 ARG A  39      -1.950  11.778 -12.701  1.00  2.69           H   new
ATOM      0  HB3 ARG A  39      -2.564  10.224 -12.174  1.00  2.69           H   new
ATOM      0  HG2 ARG A  39      -2.418  10.764  -9.908  1.00  3.93           H   new
ATOM      0  HG3 ARG A  39      -1.151  11.949 -10.157  1.00  3.93           H   new
ATOM      0  HD2 ARG A  39      -3.202  13.062  -9.491  1.00  4.96           H   new
ATOM      0  HD3 ARG A  39      -2.783  13.522 -11.130  1.00  4.96           H   new
ATOM      0  HE  ARG A  39      -4.571  11.371 -11.412  1.00  5.18           H   new
ATOM      0 HH11 ARG A  39      -4.546  14.607  -9.941  1.00  6.91           H   new
ATOM      0 HH12 ARG A  39      -6.281  14.851 -10.166  1.00  6.91           H   new
ATOM      0 HH21 ARG A  39      -6.830  11.707 -11.654  1.00  6.87           H   new
ATOM      0 HH22 ARG A  39      -7.560  13.226 -11.125  1.00  6.87           H   new
ATOM    635  N   ALA A  40       1.331  11.665 -10.967  1.00  2.07           N
ATOM    636  CA  ALA A  40       2.395  12.647 -10.851  1.00  2.32           C
ATOM    637  C   ALA A  40       3.672  12.015 -11.375  1.00  2.15           C
ATOM    638  O   ALA A  40       4.265  12.480 -12.354  1.00  2.37           O
ATOM    639  CB  ALA A  40       2.536  13.113  -9.404  1.00  2.47           C
ATOM      0  H   ALA A  40       1.156  11.141 -10.110  1.00  2.07           H   new
ATOM      0  HA  ALA A  40       2.168  13.535 -11.441  1.00  2.32           H   new
ATOM      0  HB1 ALA A  40       3.338  13.848  -9.335  1.00  2.47           H   new
ATOM      0  HB2 ALA A  40       1.600  13.564  -9.074  1.00  2.47           H   new
ATOM      0  HB3 ALA A  40       2.771  12.259  -8.768  1.00  2.47           H   new
ATOM    645  N   GLU A  41       4.076  10.913 -10.750  1.00  1.87           N
ATOM    646  CA  GLU A  41       5.345  10.273 -11.038  1.00  1.95           C
ATOM    647  C   GLU A  41       5.325   9.533 -12.381  1.00  1.97           C
ATOM    648  O   GLU A  41       6.357   9.449 -13.049  1.00  2.51           O
ATOM    649  CB  GLU A  41       5.794   9.491  -9.802  1.00  1.92           C
ATOM    650  CG  GLU A  41       5.372   8.024  -9.779  1.00  2.17           C
ATOM    651  CD  GLU A  41       5.704   7.419  -8.431  1.00  3.16           C
ATOM    652  OE1 GLU A  41       6.673   7.895  -7.797  1.00  3.52           O
ATOM    653  OE2 GLU A  41       4.999   6.482  -8.011  1.00  4.40           O
ATOM      0  H   GLU A  41       3.528  10.442 -10.030  1.00  1.87           H   new
ATOM      0  HA  GLU A  41       6.133  11.005 -11.211  1.00  1.95           H   new
ATOM      0  HB2 GLU A  41       6.881   9.542  -9.733  1.00  1.92           H   new
ATOM      0  HB3 GLU A  41       5.395   9.982  -8.915  1.00  1.92           H   new
ATOM      0  HG2 GLU A  41       4.303   7.940  -9.973  1.00  2.17           H   new
ATOM      0  HG3 GLU A  41       5.883   7.476 -10.570  1.00  2.17           H   new
ATOM    660  N   GLY A  42       4.150   9.119 -12.843  1.00  1.53           N
ATOM    661  CA  GLY A  42       3.970   8.566 -14.173  1.00  1.51           C
ATOM    662  C   GLY A  42       4.413   7.114 -14.177  1.00  1.53           C
ATOM    663  O   GLY A  42       5.483   6.788 -14.691  1.00  2.22           O
ATOM      0  H   GLY A  42       3.290   9.160 -12.296  1.00  1.53           H   new
ATOM      0  HA2 GLY A  42       2.924   8.640 -14.472  1.00  1.51           H   new
ATOM      0  HA3 GLY A  42       4.550   9.137 -14.898  1.00  1.51           H   new
ATOM    667  N   ILE A  43       3.590   6.256 -13.576  1.00  1.08           N
ATOM    668  CA  ILE A  43       3.837   4.832 -13.420  1.00  0.98           C
ATOM    669  C   ILE A  43       2.609   4.073 -13.922  1.00  0.96           C
ATOM    670  O   ILE A  43       1.472   4.506 -13.715  1.00  1.05           O
ATOM    671  CB  ILE A  43       4.236   4.551 -11.954  1.00  0.96           C
ATOM    672  CG1 ILE A  43       5.773   4.490 -11.918  1.00  1.46           C
ATOM    673  CG2 ILE A  43       3.611   3.286 -11.352  1.00  0.81           C
ATOM    674  CD1 ILE A  43       6.359   4.243 -10.531  1.00  2.29           C
ATOM      0  H   ILE A  43       2.701   6.549 -13.171  1.00  1.08           H   new
ATOM      0  HA  ILE A  43       4.675   4.479 -14.021  1.00  0.98           H   new
ATOM      0  HB  ILE A  43       3.844   5.353 -11.328  1.00  0.96           H   new
ATOM      0 HG12 ILE A  43       6.109   3.699 -12.588  1.00  1.46           H   new
ATOM      0 HG13 ILE A  43       6.171   5.427 -12.306  1.00  1.46           H   new
ATOM      0 HG21 ILE A  43       3.947   3.169 -10.322  1.00  0.81           H   new
ATOM      0 HG22 ILE A  43       2.525   3.372 -11.372  1.00  0.81           H   new
ATOM      0 HG23 ILE A  43       3.917   2.417 -11.934  1.00  0.81           H   new
ATOM      0 HD11 ILE A  43       7.447   4.214 -10.595  1.00  2.29           H   new
ATOM      0 HD12 ILE A  43       6.056   5.047  -9.860  1.00  2.29           H   new
ATOM      0 HD13 ILE A  43       5.993   3.291 -10.146  1.00  2.29           H   new
ATOM    686  N   THR A  44       2.843   2.978 -14.639  1.00  0.96           N
ATOM    687  CA  THR A  44       1.814   2.169 -15.255  1.00  1.01           C
ATOM    688  C   THR A  44       1.383   1.061 -14.298  1.00  0.83           C
ATOM    689  O   THR A  44       2.070   0.746 -13.328  1.00  0.74           O
ATOM    690  CB  THR A  44       2.379   1.620 -16.575  1.00  1.18           C
ATOM    691  OG1 THR A  44       3.671   1.090 -16.376  1.00  1.23           O
ATOM    692  CG2 THR A  44       2.518   2.769 -17.567  1.00  1.38           C
ATOM      0  H   THR A  44       3.785   2.624 -14.808  1.00  0.96           H   new
ATOM      0  HA  THR A  44       0.922   2.756 -15.473  1.00  1.01           H   new
ATOM      0  HB  THR A  44       1.705   0.846 -16.943  1.00  1.18           H   new
ATOM      0  HG1 THR A  44       4.017   0.743 -17.225  1.00  1.23           H   new
ATOM      0 HG21 THR A  44       2.918   2.391 -18.508  1.00  1.38           H   new
ATOM      0 HG22 THR A  44       1.541   3.218 -17.743  1.00  1.38           H   new
ATOM      0 HG23 THR A  44       3.195   3.521 -17.161  1.00  1.38           H   new
ATOM    700  N   LYS A  45       0.243   0.441 -14.582  1.00  0.92           N
ATOM    701  CA  LYS A  45      -0.192  -0.767 -13.903  1.00  0.92           C
ATOM    702  C   LYS A  45       0.826  -1.884 -14.169  1.00  0.84           C
ATOM    703  O   LYS A  45       1.119  -2.700 -13.292  1.00  0.85           O
ATOM    704  CB  LYS A  45      -1.598  -1.098 -14.432  1.00  1.15           C
ATOM    705  CG  LYS A  45      -2.560  -1.575 -13.341  1.00  1.26           C
ATOM    706  CD  LYS A  45      -3.999  -1.330 -13.818  1.00  2.31           C
ATOM    707  CE  LYS A  45      -5.031  -1.584 -12.718  1.00  3.09           C
ATOM    708  NZ  LYS A  45      -5.288  -3.016 -12.500  1.00  3.44           N
ATOM      0  H   LYS A  45      -0.408   0.768 -15.296  1.00  0.92           H   new
ATOM      0  HA  LYS A  45      -0.246  -0.645 -12.821  1.00  0.92           H   new
ATOM      0  HB2 LYS A  45      -2.015  -0.213 -14.913  1.00  1.15           H   new
ATOM      0  HB3 LYS A  45      -1.518  -1.869 -15.198  1.00  1.15           H   new
ATOM      0  HG2 LYS A  45      -2.404  -2.634 -13.136  1.00  1.26           H   new
ATOM      0  HG3 LYS A  45      -2.373  -1.039 -12.411  1.00  1.26           H   new
ATOM      0  HD2 LYS A  45      -4.092  -0.302 -14.169  1.00  2.31           H   new
ATOM      0  HD3 LYS A  45      -4.212  -1.978 -14.668  1.00  2.31           H   new
ATOM      0  HE2 LYS A  45      -4.682  -1.136 -11.788  1.00  3.09           H   new
ATOM      0  HE3 LYS A  45      -5.965  -1.087 -12.980  1.00  3.09           H   new
ATOM      0  HZ1 LYS A  45      -5.247  -3.225 -11.482  1.00  3.44           H   new
ATOM      0  HZ2 LYS A  45      -6.231  -3.259 -12.866  1.00  3.44           H   new
ATOM      0  HZ3 LYS A  45      -4.568  -3.578 -12.998  1.00  3.44           H   new
ATOM    722  N   GLU A  46       1.373  -1.893 -15.386  1.00  0.88           N
ATOM    723  CA  GLU A  46       2.467  -2.762 -15.777  1.00  0.84           C
ATOM    724  C   GLU A  46       3.660  -2.491 -14.870  1.00  0.70           C
ATOM    725  O   GLU A  46       4.155  -3.431 -14.253  1.00  0.68           O
ATOM    726  CB  GLU A  46       2.819  -2.492 -17.242  1.00  0.99           C
ATOM    727  CG  GLU A  46       4.153  -3.093 -17.705  1.00  2.04           C
ATOM    728  CD  GLU A  46       4.528  -2.509 -19.039  1.00  2.30           C
ATOM    729  OE1 GLU A  46       3.695  -2.618 -19.964  1.00  2.27           O
ATOM    730  OE2 GLU A  46       5.573  -1.835 -19.131  1.00  3.40           O
ATOM      0  H   GLU A  46       1.056  -1.281 -16.138  1.00  0.88           H   new
ATOM      0  HA  GLU A  46       2.182  -3.809 -15.676  1.00  0.84           H   new
ATOM      0  HB2 GLU A  46       2.021  -2.886 -17.871  1.00  0.99           H   new
ATOM      0  HB3 GLU A  46       2.847  -1.414 -17.401  1.00  0.99           H   new
ATOM      0  HG2 GLU A  46       4.932  -2.884 -16.972  1.00  2.04           H   new
ATOM      0  HG3 GLU A  46       4.069  -4.177 -17.781  1.00  2.04           H   new
ATOM    737  N   ASP A  47       4.135  -1.237 -14.820  1.00  0.69           N
ATOM    738  CA  ASP A  47       5.293  -0.868 -14.012  1.00  0.66           C
ATOM    739  C   ASP A  47       5.089  -1.406 -12.617  1.00  0.61           C
ATOM    740  O   ASP A  47       5.919  -2.139 -12.108  1.00  0.65           O
ATOM    741  CB  ASP A  47       5.486   0.646 -13.894  1.00  0.80           C
ATOM    742  CG  ASP A  47       6.600   0.936 -12.902  1.00  0.98           C
ATOM    743  OD1 ASP A  47       6.327   1.031 -11.688  1.00  1.86           O
ATOM    744  OD2 ASP A  47       7.740   1.066 -13.394  1.00  1.52           O
ATOM      0  H   ASP A  47       3.726  -0.459 -15.337  1.00  0.69           H   new
ATOM      0  HA  ASP A  47       6.173  -1.284 -14.503  1.00  0.66           H   new
ATOM      0  HB2 ASP A  47       5.732   1.070 -14.868  1.00  0.80           H   new
ATOM      0  HB3 ASP A  47       4.560   1.118 -13.566  1.00  0.80           H   new
ATOM    749  N   LEU A  48       3.951  -1.060 -12.030  1.00  0.59           N
ATOM    750  CA  LEU A  48       3.608  -1.471 -10.693  1.00  0.60           C
ATOM    751  C   LEU A  48       3.821  -2.964 -10.499  1.00  0.57           C
ATOM    752  O   LEU A  48       4.509  -3.361  -9.566  1.00  0.61           O
ATOM    753  CB  LEU A  48       2.160  -1.042 -10.406  1.00  0.63           C
ATOM    754  CG  LEU A  48       2.121   0.266  -9.613  1.00  0.79           C
ATOM    755  CD1 LEU A  48       0.713   0.865  -9.674  1.00  0.93           C
ATOM    756  CD2 LEU A  48       2.523   0.013  -8.154  1.00  1.06           C
ATOM      0  H   LEU A  48       3.241  -0.482 -12.479  1.00  0.59           H   new
ATOM      0  HA  LEU A  48       4.267  -0.983  -9.975  1.00  0.60           H   new
ATOM      0  HB2 LEU A  48       1.621  -0.918 -11.345  1.00  0.63           H   new
ATOM      0  HB3 LEU A  48       1.649  -1.826  -9.847  1.00  0.63           H   new
ATOM      0  HG  LEU A  48       2.828   0.969 -10.053  1.00  0.79           H   new
ATOM      0 HD11 LEU A  48       0.689   1.796  -9.108  1.00  0.93           H   new
ATOM      0 HD12 LEU A  48       0.447   1.064 -10.712  1.00  0.93           H   new
ATOM      0 HD13 LEU A  48      -0.001   0.161  -9.245  1.00  0.93           H   new
ATOM      0 HD21 LEU A  48       2.491   0.951  -7.600  1.00  1.06           H   new
ATOM      0 HD22 LEU A  48       1.830  -0.698  -7.704  1.00  1.06           H   new
ATOM      0 HD23 LEU A  48       3.533  -0.394  -8.120  1.00  1.06           H   new
ATOM    768  N   GLN A  49       3.254  -3.805 -11.358  1.00  0.58           N
ATOM    769  CA  GLN A  49       3.390  -5.237 -11.237  1.00  0.61           C
ATOM    770  C   GLN A  49       4.843  -5.691 -11.480  1.00  0.69           C
ATOM    771  O   GLN A  49       5.354  -6.602 -10.822  1.00  0.76           O
ATOM    772  CB  GLN A  49       2.308  -5.834 -12.142  1.00  0.72           C
ATOM    773  CG  GLN A  49       2.786  -6.601 -13.376  1.00  0.91           C
ATOM    774  CD  GLN A  49       1.646  -6.860 -14.360  1.00  1.20           C
ATOM    775  OE1 GLN A  49       1.401  -7.986 -14.783  1.00  1.89           O
ATOM    776  NE2 GLN A  49       0.905  -5.817 -14.702  1.00  1.85           N
ATOM      0  H   GLN A  49       2.690  -3.505 -12.153  1.00  0.58           H   new
ATOM      0  HA  GLN A  49       3.218  -5.610 -10.227  1.00  0.61           H   new
ATOM      0  HB2 GLN A  49       1.695  -6.506 -11.541  1.00  0.72           H   new
ATOM      0  HB3 GLN A  49       1.660  -5.024 -12.476  1.00  0.72           H   new
ATOM      0  HG2 GLN A  49       3.574  -6.035 -13.873  1.00  0.91           H   new
ATOM      0  HG3 GLN A  49       3.222  -7.551 -13.067  1.00  0.91           H   new
ATOM      0 HE21 GLN A  49       1.129  -4.891 -14.337  1.00  1.85           H   new
ATOM      0 HE22 GLN A  49       0.111  -5.940 -15.330  1.00  1.85           H   new
ATOM    785  N   GLN A  50       5.537  -5.039 -12.411  1.00  0.72           N
ATOM    786  CA  GLN A  50       6.952  -5.256 -12.659  1.00  0.79           C
ATOM    787  C   GLN A  50       7.729  -5.025 -11.363  1.00  0.87           C
ATOM    788  O   GLN A  50       8.317  -5.961 -10.824  1.00  1.11           O
ATOM    789  CB  GLN A  50       7.436  -4.372 -13.825  1.00  0.80           C
ATOM    790  CG  GLN A  50       7.676  -5.155 -15.124  1.00  1.80           C
ATOM    791  CD  GLN A  50       6.590  -6.168 -15.465  1.00  3.21           C
ATOM    792  OE1 GLN A  50       6.868  -7.360 -15.566  1.00  3.93           O
ATOM    793  NE2 GLN A  50       5.351  -5.730 -15.622  1.00  4.64           N
ATOM      0  H   GLN A  50       5.121  -4.335 -13.021  1.00  0.72           H   new
ATOM      0  HA  GLN A  50       7.131  -6.286 -12.968  1.00  0.79           H   new
ATOM      0  HB2 GLN A  50       6.698  -3.592 -14.011  1.00  0.80           H   new
ATOM      0  HB3 GLN A  50       8.360  -3.873 -13.534  1.00  0.80           H   new
ATOM      0  HG2 GLN A  50       7.766  -4.447 -15.948  1.00  1.80           H   new
ATOM      0  HG3 GLN A  50       8.630  -5.677 -15.047  1.00  1.80           H   new
ATOM      0 HE21 GLN A  50       5.147  -4.735 -15.533  1.00  4.64           H   new
ATOM      0 HE22 GLN A  50       4.600  -6.388 -15.832  1.00  4.64           H   new
ATOM    802  N   LYS A  51       7.698  -3.806 -10.837  1.00  0.81           N
ATOM    803  CA  LYS A  51       8.461  -3.390  -9.680  1.00  0.99           C
ATOM    804  C   LYS A  51       8.049  -4.221  -8.465  1.00  0.94           C
ATOM    805  O   LYS A  51       8.893  -4.684  -7.702  1.00  1.11           O
ATOM    806  CB  LYS A  51       8.246  -1.882  -9.457  1.00  1.08           C
ATOM    807  CG  LYS A  51       9.593  -1.172  -9.238  1.00  1.67           C
ATOM    808  CD  LYS A  51       9.466   0.335  -8.959  1.00  1.90           C
ATOM    809  CE  LYS A  51       9.139   0.697  -7.500  1.00  1.74           C
ATOM    810  NZ  LYS A  51       7.878   0.126  -7.010  1.00  2.57           N
ATOM      0  H   LYS A  51       7.119  -3.059 -11.222  1.00  0.81           H   new
ATOM      0  HA  LYS A  51       9.526  -3.559  -9.839  1.00  0.99           H   new
ATOM      0  HB2 LYS A  51       7.736  -1.450 -10.318  1.00  1.08           H   new
ATOM      0  HB3 LYS A  51       7.601  -1.725  -8.593  1.00  1.08           H   new
ATOM      0  HG2 LYS A  51      10.109  -1.644  -8.402  1.00  1.67           H   new
ATOM      0  HG3 LYS A  51      10.216  -1.317 -10.120  1.00  1.67           H   new
ATOM      0  HD2 LYS A  51      10.400   0.822  -9.238  1.00  1.90           H   new
ATOM      0  HD3 LYS A  51       8.688   0.745  -9.603  1.00  1.90           H   new
ATOM      0  HE2 LYS A  51       9.953   0.355  -6.861  1.00  1.74           H   new
ATOM      0  HE3 LYS A  51       9.095   1.782  -7.407  1.00  1.74           H   new
ATOM      0  HZ1 LYS A  51       7.545   0.672  -6.190  1.00  2.57           H   new
ATOM      0  HZ2 LYS A  51       7.163   0.165  -7.764  1.00  2.57           H   new
ATOM      0  HZ3 LYS A  51       8.031  -0.863  -6.729  1.00  2.57           H   new
ATOM    824  N   ALA A  52       6.740  -4.412  -8.291  1.00  0.76           N
ATOM    825  CA  ALA A  52       6.172  -5.240  -7.238  1.00  0.78           C
ATOM    826  C   ALA A  52       6.745  -6.658  -7.276  1.00  0.91           C
ATOM    827  O   ALA A  52       6.776  -7.345  -6.256  1.00  1.26           O
ATOM    828  CB  ALA A  52       4.656  -5.338  -7.414  1.00  0.72           C
ATOM      0  H   ALA A  52       6.036  -3.985  -8.892  1.00  0.76           H   new
ATOM      0  HA  ALA A  52       6.422  -4.774  -6.285  1.00  0.78           H   new
ATOM      0  HB1 ALA A  52       4.237  -5.959  -6.622  1.00  0.72           H   new
ATOM      0  HB2 ALA A  52       4.219  -4.341  -7.363  1.00  0.72           H   new
ATOM      0  HB3 ALA A  52       4.430  -5.784  -8.383  1.00  0.72           H   new
ATOM    834  N   GLY A  53       7.125  -7.123  -8.466  1.00  0.78           N
ATOM    835  CA  GLY A  53       7.746  -8.417  -8.656  1.00  0.83           C
ATOM    836  C   GLY A  53       6.715  -9.510  -8.920  1.00  0.99           C
ATOM    837  O   GLY A  53       7.028 -10.696  -8.767  1.00  1.35           O
ATOM      0  H   GLY A  53       7.005  -6.598  -9.332  1.00  0.78           H   new
ATOM      0  HA2 GLY A  53       8.443  -8.366  -9.493  1.00  0.83           H   new
ATOM      0  HA3 GLY A  53       8.328  -8.674  -7.771  1.00  0.83           H   new
ATOM    841  N   LYS A  54       5.497  -9.155  -9.342  1.00  0.95           N
ATOM    842  CA  LYS A  54       4.445 -10.128  -9.602  1.00  1.20           C
ATOM    843  C   LYS A  54       3.315  -9.448 -10.367  1.00  0.94           C
ATOM    844  O   LYS A  54       3.171  -8.232 -10.249  1.00  0.70           O
ATOM    845  CB  LYS A  54       3.959 -10.755  -8.281  1.00  1.56           C
ATOM    846  CG  LYS A  54       2.821  -9.990  -7.596  1.00  1.86           C
ATOM    847  CD  LYS A  54       2.739 -10.466  -6.145  1.00  1.57           C
ATOM    848  CE  LYS A  54       1.462 -10.003  -5.441  1.00  2.48           C
ATOM    849  NZ  LYS A  54       0.307 -10.899  -5.651  1.00  3.42           N
ATOM      0  H   LYS A  54       5.219  -8.188  -9.511  1.00  0.95           H   new
ATOM      0  HA  LYS A  54       4.830 -10.942 -10.217  1.00  1.20           H   new
ATOM      0  HB2 LYS A  54       3.628 -11.775  -8.478  1.00  1.56           H   new
ATOM      0  HB3 LYS A  54       4.802 -10.821  -7.593  1.00  1.56           H   new
ATOM      0  HG2 LYS A  54       3.006  -8.916  -7.635  1.00  1.86           H   new
ATOM      0  HG3 LYS A  54       1.877 -10.170  -8.110  1.00  1.86           H   new
ATOM      0  HD2 LYS A  54       2.787 -11.555  -6.121  1.00  1.57           H   new
ATOM      0  HD3 LYS A  54       3.605 -10.096  -5.597  1.00  1.57           H   new
ATOM      0  HE2 LYS A  54       1.657  -9.922  -4.372  1.00  2.48           H   new
ATOM      0  HE3 LYS A  54       1.205  -9.005  -5.795  1.00  2.48           H   new
ATOM      0  HZ1 LYS A  54      -0.521 -10.523  -5.146  1.00  3.42           H   new
ATOM      0  HZ2 LYS A  54       0.094 -10.959  -6.667  1.00  3.42           H   new
ATOM      0  HZ3 LYS A  54       0.533 -11.847  -5.288  1.00  3.42           H   new
ATOM    863  N   PRO A  55       2.485 -10.196 -11.104  1.00  1.14           N
ATOM    864  CA  PRO A  55       1.323  -9.647 -11.781  1.00  1.11           C
ATOM    865  C   PRO A  55       0.230  -9.251 -10.780  1.00  0.95           C
ATOM    866  O   PRO A  55      -0.847  -9.844 -10.753  1.00  1.18           O
ATOM    867  CB  PRO A  55       0.896 -10.726 -12.783  1.00  1.52           C
ATOM    868  CG  PRO A  55       1.358 -12.020 -12.116  1.00  1.66           C
ATOM    869  CD  PRO A  55       2.646 -11.609 -11.407  1.00  1.56           C
ATOM      0  HA  PRO A  55       1.539  -8.717 -12.306  1.00  1.11           H   new
ATOM      0  HB2 PRO A  55      -0.181 -10.720 -12.948  1.00  1.52           H   new
ATOM      0  HB3 PRO A  55       1.368 -10.583 -13.755  1.00  1.52           H   new
ATOM      0  HG2 PRO A  55       0.615 -12.398 -11.414  1.00  1.66           H   new
ATOM      0  HG3 PRO A  55       1.535 -12.809 -12.847  1.00  1.66           H   new
ATOM      0  HD2 PRO A  55       2.797 -12.191 -10.498  1.00  1.56           H   new
ATOM      0  HD3 PRO A  55       3.515 -11.778 -12.042  1.00  1.56           H   new
ATOM    877  N   VAL A  56       0.471  -8.229  -9.956  1.00  0.78           N
ATOM    878  CA  VAL A  56      -0.609  -7.572  -9.241  1.00  0.81           C
ATOM    879  C   VAL A  56      -1.380  -6.709 -10.215  1.00  0.81           C
ATOM    880  O   VAL A  56      -0.816  -5.883 -10.933  1.00  1.05           O
ATOM    881  CB  VAL A  56      -0.165  -6.804  -7.996  1.00  0.89           C
ATOM    882  CG1 VAL A  56       1.130  -6.006  -8.187  1.00  0.93           C
ATOM    883  CG2 VAL A  56      -1.278  -5.912  -7.432  1.00  1.45           C
ATOM      0  H   VAL A  56       1.398  -7.846  -9.773  1.00  0.78           H   new
ATOM      0  HA  VAL A  56      -1.263  -8.346  -8.840  1.00  0.81           H   new
ATOM      0  HB  VAL A  56       0.056  -7.577  -7.260  1.00  0.89           H   new
ATOM      0 HG11 VAL A  56       1.379  -5.489  -7.260  1.00  0.93           H   new
ATOM      0 HG12 VAL A  56       1.940  -6.685  -8.453  1.00  0.93           H   new
ATOM      0 HG13 VAL A  56       0.993  -5.276  -8.984  1.00  0.93           H   new
ATOM      0 HG21 VAL A  56      -0.912  -5.388  -6.549  1.00  1.45           H   new
ATOM      0 HG22 VAL A  56      -1.579  -5.185  -8.186  1.00  1.45           H   new
ATOM      0 HG23 VAL A  56      -2.135  -6.528  -7.160  1.00  1.45           H   new
ATOM    893  N   GLU A  57      -2.681  -6.931 -10.196  1.00  0.78           N
ATOM    894  CA  GLU A  57      -3.664  -6.246 -11.011  1.00  0.89           C
ATOM    895  C   GLU A  57      -4.752  -5.646 -10.112  1.00  0.85           C
ATOM    896  O   GLU A  57      -5.551  -4.829 -10.573  1.00  1.18           O
ATOM    897  CB  GLU A  57      -4.198  -7.234 -12.065  1.00  1.20           C
ATOM    898  CG  GLU A  57      -5.099  -6.650 -13.167  1.00  1.90           C
ATOM    899  CD  GLU A  57      -4.393  -5.737 -14.144  1.00  2.51           C
ATOM    900  OE1 GLU A  57      -3.778  -4.744 -13.701  1.00  3.97           O
ATOM    901  OE2 GLU A  57      -4.526  -5.976 -15.364  1.00  2.93           O
ATOM      0  H   GLU A  57      -3.100  -7.628  -9.581  1.00  0.78           H   new
ATOM      0  HA  GLU A  57      -3.225  -5.406 -11.550  1.00  0.89           H   new
ATOM      0  HB2 GLU A  57      -3.345  -7.715 -12.543  1.00  1.20           H   new
ATOM      0  HB3 GLU A  57      -4.756  -8.015 -11.548  1.00  1.20           H   new
ATOM      0  HG2 GLU A  57      -5.551  -7.472 -13.721  1.00  1.90           H   new
ATOM      0  HG3 GLU A  57      -5.912  -6.097 -12.697  1.00  1.90           H   new
ATOM    908  N   THR A  58      -4.791  -5.979  -8.820  1.00  0.96           N
ATOM    909  CA  THR A  58      -5.674  -5.286  -7.899  1.00  0.96           C
ATOM    910  C   THR A  58      -4.950  -4.016  -7.469  1.00  0.92           C
ATOM    911  O   THR A  58      -3.719  -3.992  -7.415  1.00  1.09           O
ATOM    912  CB  THR A  58      -5.979  -6.184  -6.688  1.00  1.01           C
ATOM    913  OG1 THR A  58      -4.816  -6.878  -6.263  1.00  1.14           O
ATOM    914  CG2 THR A  58      -7.054  -7.204  -7.062  1.00  1.13           C
ATOM      0  H   THR A  58      -4.226  -6.716  -8.398  1.00  0.96           H   new
ATOM      0  HA  THR A  58      -6.627  -5.041  -8.368  1.00  0.96           H   new
ATOM      0  HB  THR A  58      -6.328  -5.548  -5.874  1.00  1.01           H   new
ATOM      0  HG1 THR A  58      -5.035  -7.441  -5.491  1.00  1.14           H   new
ATOM      0 HG21 THR A  58      -7.268  -7.839  -6.202  1.00  1.13           H   new
ATOM      0 HG22 THR A  58      -7.962  -6.682  -7.363  1.00  1.13           H   new
ATOM      0 HG23 THR A  58      -6.699  -7.820  -7.888  1.00  1.13           H   new
ATOM    922  N   VAL A  59      -5.691  -2.959  -7.159  1.00  0.87           N
ATOM    923  CA  VAL A  59      -5.141  -1.732  -6.603  1.00  0.78           C
ATOM    924  C   VAL A  59      -5.929  -1.427  -5.315  1.00  0.79           C
ATOM    925  O   VAL A  59      -7.013  -1.989  -5.137  1.00  0.95           O
ATOM    926  CB  VAL A  59      -5.167  -0.631  -7.678  1.00  0.96           C
ATOM    927  CG1 VAL A  59      -4.478  -1.084  -8.971  1.00  1.37           C
ATOM    928  CG2 VAL A  59      -6.583  -0.155  -7.968  1.00  1.18           C
ATOM      0  H   VAL A  59      -6.702  -2.931  -7.289  1.00  0.87           H   new
ATOM      0  HA  VAL A  59      -4.092  -1.813  -6.320  1.00  0.78           H   new
ATOM      0  HB  VAL A  59      -4.606   0.212  -7.273  1.00  0.96           H   new
ATOM      0 HG11 VAL A  59      -4.517  -0.279  -9.705  1.00  1.37           H   new
ATOM      0 HG12 VAL A  59      -3.438  -1.333  -8.761  1.00  1.37           H   new
ATOM      0 HG13 VAL A  59      -4.989  -1.962  -9.367  1.00  1.37           H   new
ATOM      0 HG21 VAL A  59      -6.556   0.622  -8.732  1.00  1.18           H   new
ATOM      0 HG22 VAL A  59      -7.183  -0.993  -8.323  1.00  1.18           H   new
ATOM      0 HG23 VAL A  59      -7.025   0.247  -7.057  1.00  1.18           H   new
ATOM    938  N   PRO A  60      -5.447  -0.585  -4.387  1.00  0.75           N
ATOM    939  CA  PRO A  60      -4.180   0.126  -4.427  1.00  0.69           C
ATOM    940  C   PRO A  60      -3.027  -0.858  -4.263  1.00  0.62           C
ATOM    941  O   PRO A  60      -3.246  -2.031  -3.951  1.00  0.65           O
ATOM    942  CB  PRO A  60      -4.241   1.098  -3.242  1.00  0.70           C
ATOM    943  CG  PRO A  60      -5.047   0.307  -2.212  1.00  0.73           C
ATOM    944  CD  PRO A  60      -6.073  -0.416  -3.083  1.00  0.85           C
ATOM      0  HA  PRO A  60      -4.019   0.647  -5.371  1.00  0.69           H   new
ATOM      0  HB2 PRO A  60      -3.247   1.352  -2.873  1.00  0.70           H   new
ATOM      0  HB3 PRO A  60      -4.731   2.035  -3.509  1.00  0.70           H   new
ATOM      0  HG2 PRO A  60      -4.422  -0.392  -1.656  1.00  0.73           H   new
ATOM      0  HG3 PRO A  60      -5.523   0.960  -1.480  1.00  0.73           H   new
ATOM      0  HD2 PRO A  60      -6.341  -1.380  -2.651  1.00  0.85           H   new
ATOM      0  HD3 PRO A  60      -6.993   0.163  -3.164  1.00  0.85           H   new
ATOM    952  N   GLN A  61      -1.807  -0.368  -4.455  1.00  0.68           N
ATOM    953  CA  GLN A  61      -0.626  -1.018  -3.931  1.00  0.67           C
ATOM    954  C   GLN A  61      -0.201  -0.192  -2.720  1.00  0.87           C
ATOM    955  O   GLN A  61      -0.336   1.033  -2.745  1.00  1.62           O
ATOM    956  CB  GLN A  61       0.475  -1.109  -5.003  1.00  0.76           C
ATOM    957  CG  GLN A  61       0.256  -2.294  -5.959  1.00  0.92           C
ATOM    958  CD  GLN A  61      -0.540  -1.953  -7.217  1.00  1.80           C
ATOM    959  OE1 GLN A  61      -1.244  -0.947  -7.288  1.00  3.24           O
ATOM    960  NE2 GLN A  61      -0.387  -2.783  -8.240  1.00  2.03           N
ATOM      0  H   GLN A  61      -1.616   0.487  -4.977  1.00  0.68           H   new
ATOM      0  HA  GLN A  61      -0.822  -2.049  -3.637  1.00  0.67           H   new
ATOM      0  HB2 GLN A  61       0.500  -0.182  -5.576  1.00  0.76           H   new
ATOM      0  HB3 GLN A  61       1.446  -1.210  -4.517  1.00  0.76           H   new
ATOM      0  HG2 GLN A  61       1.227  -2.690  -6.255  1.00  0.92           H   new
ATOM      0  HG3 GLN A  61      -0.262  -3.088  -5.421  1.00  0.92           H   new
ATOM      0 HE21 GLN A  61       0.205  -3.608  -8.143  1.00  2.03           H   new
ATOM      0 HE22 GLN A  61      -0.862  -2.597  -9.123  1.00  2.03           H   new
ATOM    969  N   ILE A  62       0.275  -0.847  -1.668  1.00  0.45           N
ATOM    970  CA  ILE A  62       0.921  -0.224  -0.531  1.00  0.52           C
ATOM    971  C   ILE A  62       2.239  -0.972  -0.371  1.00  0.53           C
ATOM    972  O   ILE A  62       2.255  -2.203  -0.336  1.00  0.64           O
ATOM    973  CB  ILE A  62       0.043  -0.303   0.735  1.00  0.64           C
ATOM    974  CG1 ILE A  62      -1.010   0.825   0.825  1.00  0.71           C
ATOM    975  CG2 ILE A  62       0.882  -0.242   2.018  1.00  0.77           C
ATOM    976  CD1 ILE A  62      -2.298   0.210   1.355  1.00  0.67           C
ATOM      0  H   ILE A  62       0.217  -1.862  -1.585  1.00  0.45           H   new
ATOM      0  HA  ILE A  62       1.086   0.842  -0.685  1.00  0.52           H   new
ATOM      0  HB  ILE A  62      -0.466  -1.263   0.649  1.00  0.64           H   new
ATOM      0 HG12 ILE A  62      -0.665   1.620   1.486  1.00  0.71           H   new
ATOM      0 HG13 ILE A  62      -1.175   1.274  -0.154  1.00  0.71           H   new
ATOM      0 HG21 ILE A  62       0.225  -0.301   2.886  1.00  0.77           H   new
ATOM      0 HG22 ILE A  62       1.581  -1.078   2.035  1.00  0.77           H   new
ATOM      0 HG23 ILE A  62       1.437   0.696   2.046  1.00  0.77           H   new
ATOM      0 HD11 ILE A  62      -3.065   0.981   1.431  1.00  0.67           H   new
ATOM      0 HD12 ILE A  62      -2.635  -0.571   0.674  1.00  0.67           H   new
ATOM      0 HD13 ILE A  62      -2.117  -0.221   2.340  1.00  0.67           H   new
ATOM    988  N   PHE A  63       3.334  -0.229  -0.275  1.00  0.51           N
ATOM    989  CA  PHE A  63       4.620  -0.774   0.107  1.00  0.56           C
ATOM    990  C   PHE A  63       4.794  -0.485   1.594  1.00  0.70           C
ATOM    991  O   PHE A  63       4.355   0.570   2.049  1.00  1.07           O
ATOM    992  CB  PHE A  63       5.735  -0.113  -0.714  1.00  0.61           C
ATOM    993  CG  PHE A  63       5.820  -0.560  -2.164  1.00  0.59           C
ATOM    994  CD1 PHE A  63       4.834  -0.208  -3.106  1.00  1.92           C
ATOM    995  CD2 PHE A  63       6.896  -1.364  -2.569  1.00  1.95           C
ATOM    996  CE1 PHE A  63       4.933  -0.652  -4.440  1.00  1.81           C
ATOM    997  CE2 PHE A  63       6.948  -1.876  -3.871  1.00  2.07           C
ATOM    998  CZ  PHE A  63       5.979  -1.513  -4.819  1.00  0.69           C
ATOM      0  H   PHE A  63       3.350   0.774  -0.462  1.00  0.51           H   new
ATOM      0  HA  PHE A  63       4.671  -1.846  -0.083  1.00  0.56           H   new
ATOM      0  HB2 PHE A  63       5.590   0.967  -0.691  1.00  0.61           H   new
ATOM      0  HB3 PHE A  63       6.690  -0.317  -0.231  1.00  0.61           H   new
ATOM      0  HD1 PHE A  63       3.998   0.405  -2.805  1.00  1.92           H   new
ATOM      0  HD2 PHE A  63       7.689  -1.589  -1.872  1.00  1.95           H   new
ATOM      0  HE1 PHE A  63       4.206  -0.331  -5.171  1.00  1.81           H   new
ATOM      0  HE2 PHE A  63       7.740  -2.556  -4.148  1.00  2.07           H   new
ATOM      0  HZ  PHE A  63       6.036  -1.891  -5.829  1.00  0.69           H   new
ATOM   1008  N   VAL A  64       5.432  -1.374   2.352  1.00  0.55           N
ATOM   1009  CA  VAL A  64       5.938  -1.059   3.684  1.00  0.60           C
ATOM   1010  C   VAL A  64       7.435  -1.303   3.624  1.00  0.61           C
ATOM   1011  O   VAL A  64       7.839  -2.309   3.054  1.00  0.68           O
ATOM   1012  CB  VAL A  64       5.276  -1.915   4.776  1.00  0.82           C
ATOM   1013  CG1 VAL A  64       5.808  -1.495   6.155  1.00  1.15           C
ATOM   1014  CG2 VAL A  64       3.751  -1.759   4.780  1.00  0.81           C
ATOM      0  H   VAL A  64       5.612  -2.334   2.059  1.00  0.55           H   new
ATOM      0  HA  VAL A  64       5.707  -0.028   3.951  1.00  0.60           H   new
ATOM      0  HB  VAL A  64       5.520  -2.956   4.564  1.00  0.82           H   new
ATOM      0 HG11 VAL A  64       5.337  -2.103   6.927  1.00  1.15           H   new
ATOM      0 HG12 VAL A  64       6.888  -1.639   6.188  1.00  1.15           H   new
ATOM      0 HG13 VAL A  64       5.577  -0.444   6.330  1.00  1.15           H   new
ATOM      0 HG21 VAL A  64       3.324  -2.381   5.567  1.00  0.81           H   new
ATOM      0 HG22 VAL A  64       3.492  -0.716   4.961  1.00  0.81           H   new
ATOM      0 HG23 VAL A  64       3.351  -2.069   3.815  1.00  0.81           H   new
ATOM   1024  N   ASP A  65       8.244  -0.386   4.154  1.00  0.69           N
ATOM   1025  CA  ASP A  65       9.699  -0.439   4.124  1.00  0.84           C
ATOM   1026  C   ASP A  65      10.175  -0.877   2.743  1.00  0.93           C
ATOM   1027  O   ASP A  65      10.871  -1.884   2.602  1.00  2.00           O
ATOM   1028  CB  ASP A  65      10.226  -1.373   5.216  1.00  1.05           C
ATOM   1029  CG  ASP A  65      10.126  -0.824   6.619  1.00  2.06           C
ATOM   1030  OD1 ASP A  65       9.486   0.231   6.832  1.00  3.09           O
ATOM   1031  OD2 ASP A  65      10.791  -1.449   7.472  1.00  2.85           O
ATOM      0  H   ASP A  65       7.888   0.442   4.632  1.00  0.69           H   new
ATOM      0  HA  ASP A  65      10.095   0.557   4.322  1.00  0.84           H   new
ATOM      0  HB2 ASP A  65       9.675  -2.313   5.168  1.00  1.05           H   new
ATOM      0  HB3 ASP A  65      11.270  -1.604   5.005  1.00  1.05           H   new
ATOM   1036  N   GLN A  66       9.751  -0.141   1.718  1.00  0.91           N
ATOM   1037  CA  GLN A  66      10.113  -0.334   0.324  1.00  0.95           C
ATOM   1038  C   GLN A  66       9.758  -1.724  -0.226  1.00  0.90           C
ATOM   1039  O   GLN A  66      10.189  -2.043  -1.336  1.00  1.06           O
ATOM   1040  CB  GLN A  66      11.609  -0.045   0.133  1.00  1.08           C
ATOM   1041  CG  GLN A  66      12.053   1.290   0.748  1.00  3.09           C
ATOM   1042  CD  GLN A  66      13.535   1.589   0.526  1.00  3.36           C
ATOM   1043  OE1 GLN A  66      14.353   0.571   0.293  1.00  4.41           O   flip
ATOM   1044  NE2 GLN A  66      13.949   2.746   0.586  1.00  3.23           N   flip
ATOM      0  H   GLN A  66       9.114   0.645   1.849  1.00  0.91           H   new
ATOM      0  HA  GLN A  66       9.515   0.372  -0.253  1.00  0.95           H   new
ATOM      0  HB2 GLN A  66      12.188  -0.853   0.580  1.00  1.08           H   new
ATOM      0  HB3 GLN A  66      11.838  -0.040  -0.933  1.00  1.08           H   new
ATOM      0  HG2 GLN A  66      11.458   2.096   0.320  1.00  3.09           H   new
ATOM      0  HG3 GLN A  66      11.848   1.276   1.818  1.00  3.09           H   new
ATOM      0 HE21 GLN A  66      13.299   3.511   0.766  1.00  3.23           H   new
ATOM      0 HE22 GLN A  66      14.942   2.940   0.455  1.00  3.23           H   new
ATOM   1053  N   GLN A  67       8.999  -2.551   0.498  1.00  0.86           N
ATOM   1054  CA  GLN A  67       8.632  -3.897   0.112  1.00  0.77           C
ATOM   1055  C   GLN A  67       7.165  -3.875  -0.295  1.00  0.57           C
ATOM   1056  O   GLN A  67       6.318  -3.424   0.474  1.00  0.57           O
ATOM   1057  CB  GLN A  67       8.922  -4.855   1.279  1.00  0.78           C
ATOM   1058  CG  GLN A  67       8.091  -6.136   1.250  1.00  0.80           C
ATOM   1059  CD  GLN A  67       8.381  -7.020   2.456  1.00  1.34           C
ATOM   1060  OE1 GLN A  67       9.338  -6.798   3.200  1.00  2.49           O
ATOM   1061  NE2 GLN A  67       7.543  -8.017   2.688  1.00  1.92           N
ATOM      0  H   GLN A  67       8.613  -2.281   1.403  1.00  0.86           H   new
ATOM      0  HA  GLN A  67       9.215  -4.256  -0.736  1.00  0.77           H   new
ATOM      0  HB2 GLN A  67       9.979  -5.119   1.265  1.00  0.78           H   new
ATOM      0  HB3 GLN A  67       8.736  -4.334   2.218  1.00  0.78           H   new
ATOM      0  HG2 GLN A  67       7.031  -5.882   1.231  1.00  0.80           H   new
ATOM      0  HG3 GLN A  67       8.304  -6.688   0.334  1.00  0.80           H   new
ATOM      0 HE21 GLN A  67       6.758  -8.181   2.058  1.00  1.92           H   new
ATOM      0 HE22 GLN A  67       7.682  -8.622   3.497  1.00  1.92           H   new
ATOM   1070  N   HIS A  68       6.882  -4.342  -1.509  1.00  0.49           N
ATOM   1071  CA  HIS A  68       5.537  -4.479  -2.040  1.00  0.41           C
ATOM   1072  C   HIS A  68       4.745  -5.460  -1.184  1.00  0.41           C
ATOM   1073  O   HIS A  68       5.165  -6.605  -1.011  1.00  0.49           O
ATOM   1074  CB  HIS A  68       5.638  -4.995  -3.477  1.00  0.50           C
ATOM   1075  CG  HIS A  68       4.301  -5.343  -4.053  1.00  0.60           C
ATOM   1076  ND1 HIS A  68       3.702  -6.576  -3.970  1.00  0.68           N
ATOM   1077  CD2 HIS A  68       3.392  -4.463  -4.567  1.00  0.73           C
ATOM   1078  CE1 HIS A  68       2.447  -6.442  -4.421  1.00  0.74           C
ATOM   1079  NE2 HIS A  68       2.200  -5.168  -4.783  1.00  0.78           N
ATOM      0  H   HIS A  68       7.604  -4.642  -2.164  1.00  0.49           H   new
ATOM      0  HA  HIS A  68       5.025  -3.517  -2.027  1.00  0.41           H   new
ATOM      0  HB2 HIS A  68       6.113  -4.237  -4.100  1.00  0.50           H   new
ATOM      0  HB3 HIS A  68       6.281  -5.875  -3.500  1.00  0.50           H   new
ATOM      0  HD2 HIS A  68       3.561  -3.416  -4.770  1.00  0.73           H   new
ATOM      0  HE1 HIS A  68       1.730  -7.247  -4.486  1.00  0.74           H   new
ATOM      0  HE2 HIS A  68       1.322  -4.792  -5.142  1.00  0.78           H   new
ATOM   1087  N   ILE A  69       3.583  -5.039  -0.688  1.00  0.46           N
ATOM   1088  CA  ILE A  69       2.719  -5.917   0.077  1.00  0.48           C
ATOM   1089  C   ILE A  69       1.689  -6.575  -0.835  1.00  0.63           C
ATOM   1090  O   ILE A  69       1.563  -7.797  -0.872  1.00  0.78           O
ATOM   1091  CB  ILE A  69       2.047  -5.133   1.207  1.00  0.66           C
ATOM   1092  CG1 ILE A  69       3.056  -4.384   2.092  1.00  0.87           C
ATOM   1093  CG2 ILE A  69       1.232  -6.116   2.049  1.00  0.73           C
ATOM   1094  CD1 ILE A  69       4.116  -5.324   2.660  1.00  0.91           C
ATOM      0  H   ILE A  69       3.223  -4.092  -0.806  1.00  0.46           H   new
ATOM      0  HA  ILE A  69       3.318  -6.710   0.525  1.00  0.48           H   new
ATOM      0  HB  ILE A  69       1.405  -4.371   0.764  1.00  0.66           H   new
ATOM      0 HG12 ILE A  69       3.540  -3.600   1.509  1.00  0.87           H   new
ATOM      0 HG13 ILE A  69       2.529  -3.894   2.910  1.00  0.87           H   new
ATOM      0 HG21 ILE A  69       0.743  -5.580   2.862  1.00  0.73           H   new
ATOM      0 HG22 ILE A  69       0.478  -6.593   1.423  1.00  0.73           H   new
ATOM      0 HG23 ILE A  69       1.894  -6.877   2.463  1.00  0.73           H   new
ATOM      0 HD11 ILE A  69       4.811  -4.757   3.280  1.00  0.91           H   new
ATOM      0 HD12 ILE A  69       3.634  -6.093   3.264  1.00  0.91           H   new
ATOM      0 HD13 ILE A  69       4.661  -5.795   1.842  1.00  0.91           H   new
ATOM   1106  N   GLY A  70       0.933  -5.758  -1.560  1.00  0.83           N
ATOM   1107  CA  GLY A  70      -0.271  -6.178  -2.266  1.00  1.05           C
ATOM   1108  C   GLY A  70      -1.422  -5.235  -1.930  1.00  0.94           C
ATOM   1109  O   GLY A  70      -1.201  -4.032  -1.792  1.00  1.18           O
ATOM      0  H   GLY A  70       1.144  -4.767  -1.675  1.00  0.83           H   new
ATOM      0  HA2 GLY A  70      -0.092  -6.179  -3.341  1.00  1.05           H   new
ATOM      0  HA3 GLY A  70      -0.531  -7.199  -1.985  1.00  1.05           H   new
ATOM   1113  N   GLY A  71      -2.645  -5.744  -1.845  1.00  0.93           N
ATOM   1114  CA  GLY A  71      -3.824  -4.932  -1.625  1.00  0.86           C
ATOM   1115  C   GLY A  71      -4.166  -4.839  -0.143  1.00  0.68           C
ATOM   1116  O   GLY A  71      -3.368  -5.161   0.729  1.00  0.62           O
ATOM      0  H   GLY A  71      -2.843  -6.741  -1.928  1.00  0.93           H   new
ATOM      0  HA2 GLY A  71      -3.659  -3.932  -2.025  1.00  0.86           H   new
ATOM      0  HA3 GLY A  71      -4.667  -5.358  -2.169  1.00  0.86           H   new
ATOM   1120  N   TYR A  72      -5.387  -4.394   0.147  1.00  0.66           N
ATOM   1121  CA  TYR A  72      -5.924  -4.282   1.497  1.00  0.59           C
ATOM   1122  C   TYR A  72      -5.686  -5.541   2.336  1.00  0.43           C
ATOM   1123  O   TYR A  72      -5.064  -5.479   3.391  1.00  0.44           O
ATOM   1124  CB  TYR A  72      -7.432  -3.991   1.355  1.00  0.84           C
ATOM   1125  CG  TYR A  72      -8.300  -4.148   2.588  1.00  0.82           C
ATOM   1126  CD1 TYR A  72      -7.813  -3.826   3.870  1.00  1.62           C
ATOM   1127  CD2 TYR A  72      -9.630  -4.584   2.435  1.00  2.92           C
ATOM   1128  CE1 TYR A  72      -8.625  -4.033   4.996  1.00  1.64           C
ATOM   1129  CE2 TYR A  72     -10.462  -4.716   3.557  1.00  3.03           C
ATOM   1130  CZ  TYR A  72      -9.951  -4.456   4.835  1.00  1.25           C
ATOM   1131  OH  TYR A  72     -10.742  -4.608   5.931  1.00  1.59           O
ATOM      0  H   TYR A  72      -6.046  -4.094  -0.571  1.00  0.66           H   new
ATOM      0  HA  TYR A  72      -5.412  -3.480   2.028  1.00  0.59           H   new
ATOM      0  HB2 TYR A  72      -7.544  -2.968   0.995  1.00  0.84           H   new
ATOM      0  HB3 TYR A  72      -7.829  -4.647   0.580  1.00  0.84           H   new
ATOM      0  HD1 TYR A  72      -6.818  -3.421   3.986  1.00  1.62           H   new
ATOM      0  HD2 TYR A  72     -10.011  -4.817   1.452  1.00  2.92           H   new
ATOM      0  HE1 TYR A  72      -8.228  -3.866   5.986  1.00  1.64           H   new
ATOM      0  HE2 TYR A  72     -11.492  -5.017   3.436  1.00  3.03           H   new
ATOM      0  HH  TYR A  72     -11.633  -4.905   5.652  1.00  1.59           H   new
ATOM   1141  N   THR A  73      -6.225  -6.672   1.907  1.00  0.58           N
ATOM   1142  CA  THR A  73      -6.174  -7.888   2.695  1.00  0.73           C
ATOM   1143  C   THR A  73      -4.723  -8.375   2.824  1.00  0.62           C
ATOM   1144  O   THR A  73      -4.324  -8.826   3.894  1.00  0.62           O
ATOM   1145  CB  THR A  73      -7.150  -8.886   2.064  1.00  1.17           C
ATOM   1146  OG1 THR A  73      -7.138  -8.707   0.659  1.00  1.72           O
ATOM   1147  CG2 THR A  73      -8.581  -8.583   2.518  1.00  1.92           C
ATOM      0  H   THR A  73      -6.705  -6.770   1.012  1.00  0.58           H   new
ATOM      0  HA  THR A  73      -6.496  -7.735   3.725  1.00  0.73           H   new
ATOM      0  HB  THR A  73      -6.852  -9.893   2.357  1.00  1.17           H   new
ATOM      0  HG1 THR A  73      -7.758  -9.342   0.243  1.00  1.72           H   new
ATOM      0 HG21 THR A  73      -9.266  -9.299   2.063  1.00  1.92           H   new
ATOM      0 HG22 THR A  73      -8.643  -8.661   3.603  1.00  1.92           H   new
ATOM      0 HG23 THR A  73      -8.854  -7.574   2.211  1.00  1.92           H   new
ATOM   1155  N   ASP A  74      -3.903  -8.206   1.778  1.00  0.62           N
ATOM   1156  CA  ASP A  74      -2.466  -8.452   1.880  1.00  0.63           C
ATOM   1157  C   ASP A  74      -1.880  -7.596   2.995  1.00  0.55           C
ATOM   1158  O   ASP A  74      -1.063  -8.062   3.777  1.00  0.61           O
ATOM   1159  CB  ASP A  74      -1.713  -8.098   0.592  1.00  0.71           C
ATOM   1160  CG  ASP A  74      -2.097  -8.941  -0.590  1.00  1.10           C
ATOM   1161  OD1 ASP A  74      -1.604 -10.081  -0.692  1.00  2.36           O
ATOM   1162  OD2 ASP A  74      -2.879  -8.442  -1.423  1.00  1.48           O
ATOM      0  H   ASP A  74      -4.213  -7.901   0.856  1.00  0.62           H   new
ATOM      0  HA  ASP A  74      -2.347  -9.517   2.077  1.00  0.63           H   new
ATOM      0  HB2 ASP A  74      -1.895  -7.050   0.353  1.00  0.71           H   new
ATOM      0  HB3 ASP A  74      -0.643  -8.203   0.768  1.00  0.71           H   new
ATOM   1167  N   PHE A  75      -2.244  -6.317   3.034  1.00  0.46           N
ATOM   1168  CA  PHE A  75      -1.660  -5.365   3.956  1.00  0.43           C
ATOM   1169  C   PHE A  75      -2.057  -5.716   5.388  1.00  0.46           C
ATOM   1170  O   PHE A  75      -1.239  -5.623   6.306  1.00  0.61           O
ATOM   1171  CB  PHE A  75      -2.151  -3.966   3.563  1.00  0.42           C
ATOM   1172  CG  PHE A  75      -1.702  -2.847   4.471  1.00  0.43           C
ATOM   1173  CD1 PHE A  75      -0.352  -2.737   4.861  1.00  1.82           C
ATOM   1174  CD2 PHE A  75      -2.622  -1.857   4.846  1.00  2.05           C
ATOM   1175  CE1 PHE A  75       0.073  -1.630   5.612  1.00  1.81           C
ATOM   1176  CE2 PHE A  75      -2.195  -0.760   5.602  1.00  2.08           C
ATOM   1177  CZ  PHE A  75      -0.845  -0.627   5.958  1.00  0.58           C
ATOM      0  H   PHE A  75      -2.955  -5.917   2.422  1.00  0.46           H   new
ATOM      0  HA  PHE A  75      -0.571  -5.393   3.906  1.00  0.43           H   new
ATOM      0  HB2 PHE A  75      -1.809  -3.750   2.551  1.00  0.42           H   new
ATOM      0  HB3 PHE A  75      -3.241  -3.975   3.536  1.00  0.42           H   new
ATOM      0  HD1 PHE A  75       0.355  -3.504   4.582  1.00  1.82           H   new
ATOM      0  HD2 PHE A  75      -3.658  -1.941   4.552  1.00  2.05           H   new
ATOM      0  HE1 PHE A  75       1.104  -1.550   5.923  1.00  1.81           H   new
ATOM      0  HE2 PHE A  75      -2.909  -0.012   5.913  1.00  2.08           H   new
ATOM      0  HZ  PHE A  75      -0.512   0.247   6.498  1.00  0.58           H   new
ATOM   1187  N   ALA A  76      -3.315  -6.104   5.590  1.00  0.48           N
ATOM   1188  CA  ALA A  76      -3.757  -6.649   6.863  1.00  0.58           C
ATOM   1189  C   ALA A  76      -2.874  -7.842   7.224  1.00  0.71           C
ATOM   1190  O   ALA A  76      -2.256  -7.866   8.287  1.00  1.01           O
ATOM   1191  CB  ALA A  76      -5.233  -7.038   6.784  1.00  0.74           C
ATOM      0  H   ALA A  76      -4.046  -6.049   4.881  1.00  0.48           H   new
ATOM      0  HA  ALA A  76      -3.662  -5.899   7.648  1.00  0.58           H   new
ATOM      0  HB1 ALA A  76      -5.554  -7.445   7.743  1.00  0.74           H   new
ATOM      0  HB2 ALA A  76      -5.829  -6.157   6.546  1.00  0.74           H   new
ATOM      0  HB3 ALA A  76      -5.370  -7.790   6.007  1.00  0.74           H   new
ATOM   1197  N   ALA A  77      -2.782  -8.807   6.310  1.00  0.62           N
ATOM   1198  CA  ALA A  77      -1.985 -10.005   6.497  1.00  0.64           C
ATOM   1199  C   ALA A  77      -0.549  -9.659   6.888  1.00  0.63           C
ATOM   1200  O   ALA A  77      -0.005 -10.278   7.799  1.00  0.86           O
ATOM   1201  CB  ALA A  77      -2.029 -10.884   5.243  1.00  0.63           C
ATOM      0  H   ALA A  77      -3.266  -8.773   5.413  1.00  0.62           H   new
ATOM      0  HA  ALA A  77      -2.416 -10.575   7.320  1.00  0.64           H   new
ATOM      0  HB1 ALA A  77      -1.425 -11.777   5.403  1.00  0.63           H   new
ATOM      0  HB2 ALA A  77      -3.059 -11.174   5.038  1.00  0.63           H   new
ATOM      0  HB3 ALA A  77      -1.634 -10.327   4.394  1.00  0.63           H   new
ATOM   1207  N   TRP A  78       0.073  -8.683   6.222  1.00  0.53           N
ATOM   1208  CA  TRP A  78       1.484  -8.411   6.408  1.00  0.61           C
ATOM   1209  C   TRP A  78       1.635  -7.846   7.823  1.00  0.70           C
ATOM   1210  O   TRP A  78       2.480  -8.291   8.600  1.00  0.78           O
ATOM   1211  CB  TRP A  78       1.972  -7.384   5.377  1.00  0.62           C
ATOM   1212  CG  TRP A  78       3.416  -6.998   5.551  1.00  0.86           C
ATOM   1213  CD1 TRP A  78       4.449  -7.651   4.967  1.00  1.10           C
ATOM   1214  CD2 TRP A  78       4.028  -6.002   6.427  1.00  1.06           C
ATOM   1215  NE1 TRP A  78       5.643  -7.099   5.375  1.00  1.36           N
ATOM   1216  CE2 TRP A  78       5.448  -6.102   6.304  1.00  1.36           C
ATOM   1217  CE3 TRP A  78       3.535  -5.048   7.339  1.00  1.15           C
ATOM   1218  CZ2 TRP A  78       6.323  -5.314   7.064  1.00  1.66           C
ATOM   1219  CZ3 TRP A  78       4.403  -4.293   8.148  1.00  1.50           C
ATOM   1220  CH2 TRP A  78       5.796  -4.431   8.015  1.00  1.72           C
ATOM      0  H   TRP A  78      -0.388  -8.071   5.549  1.00  0.53           H   new
ATOM      0  HA  TRP A  78       2.077  -9.316   6.276  1.00  0.61           H   new
ATOM      0  HB2 TRP A  78       1.831  -7.791   4.376  1.00  0.62           H   new
ATOM      0  HB3 TRP A  78       1.354  -6.489   5.447  1.00  0.62           H   new
ATOM      0  HD1 TRP A  78       4.351  -8.481   4.283  1.00  1.10           H   new
ATOM      0  HE1 TRP A  78       6.558  -7.392   5.032  1.00  1.36           H   new
ATOM      0  HE3 TRP A  78       2.469  -4.893   7.418  1.00  1.15           H   new
ATOM      0  HZ2 TRP A  78       7.391  -5.387   6.918  1.00  1.66           H   new
ATOM      0  HZ3 TRP A  78       3.998  -3.604   8.875  1.00  1.50           H   new
ATOM      0  HH2 TRP A  78       6.459  -3.857   8.645  1.00  1.72           H   new
ATOM   1231  N   VAL A  79       0.800  -6.855   8.165  1.00  0.74           N
ATOM   1232  CA  VAL A  79       0.780  -6.278   9.502  1.00  0.87           C
ATOM   1233  C   VAL A  79       0.556  -7.374  10.539  1.00  0.81           C
ATOM   1234  O   VAL A  79       1.098  -7.285  11.638  1.00  0.75           O
ATOM   1235  CB  VAL A  79      -0.258  -5.142   9.596  1.00  1.06           C
ATOM   1236  CG1 VAL A  79      -0.679  -4.835  11.040  1.00  1.06           C
ATOM   1237  CG2 VAL A  79       0.328  -3.868   8.969  1.00  1.33           C
ATOM      0  H   VAL A  79       0.127  -6.438   7.522  1.00  0.74           H   new
ATOM      0  HA  VAL A  79       1.748  -5.824   9.715  1.00  0.87           H   new
ATOM      0  HB  VAL A  79      -1.146  -5.475   9.059  1.00  1.06           H   new
ATOM      0 HG11 VAL A  79      -1.411  -4.027  11.042  1.00  1.06           H   new
ATOM      0 HG12 VAL A  79      -1.121  -5.725  11.487  1.00  1.06           H   new
ATOM      0 HG13 VAL A  79       0.195  -4.534  11.618  1.00  1.06           H   new
ATOM      0 HG21 VAL A  79      -0.403  -3.062   9.033  1.00  1.33           H   new
ATOM      0 HG22 VAL A  79       1.233  -3.581   9.505  1.00  1.33           H   new
ATOM      0 HG23 VAL A  79       0.570  -4.056   7.923  1.00  1.33           H   new
ATOM   1247  N   LYS A  80      -0.225  -8.400  10.212  1.00  0.95           N
ATOM   1248  CA  LYS A  80      -0.321  -9.564  11.066  1.00  1.13           C
ATOM   1249  C   LYS A  80       1.047 -10.235  11.182  1.00  1.42           C
ATOM   1250  O   LYS A  80       1.699 -10.070  12.207  1.00  2.64           O
ATOM   1251  CB  LYS A  80      -1.480 -10.474  10.640  1.00  1.55           C
ATOM   1252  CG  LYS A  80      -2.752 -10.137  11.426  1.00  1.63           C
ATOM   1253  CD  LYS A  80      -3.387  -8.780  11.079  1.00  2.69           C
ATOM   1254  CE  LYS A  80      -4.332  -8.278  12.181  1.00  3.66           C
ATOM   1255  NZ  LYS A  80      -5.154  -9.348  12.782  1.00  3.77           N
ATOM      0  H   LYS A  80      -0.794  -8.443   9.367  1.00  0.95           H   new
ATOM      0  HA  LYS A  80      -0.585  -9.272  12.082  1.00  1.13           H   new
ATOM      0  HB2 LYS A  80      -1.665 -10.359   9.572  1.00  1.55           H   new
ATOM      0  HB3 LYS A  80      -1.210 -11.517  10.806  1.00  1.55           H   new
ATOM      0  HG2 LYS A  80      -3.488 -10.922  11.251  1.00  1.63           H   new
ATOM      0  HG3 LYS A  80      -2.518 -10.151  12.491  1.00  1.63           H   new
ATOM      0  HD2 LYS A  80      -2.599  -8.044  10.916  1.00  2.69           H   new
ATOM      0  HD3 LYS A  80      -3.939  -8.869  10.143  1.00  2.69           H   new
ATOM      0  HE2 LYS A  80      -3.743  -7.799  12.964  1.00  3.66           H   new
ATOM      0  HE3 LYS A  80      -4.990  -7.515  11.765  1.00  3.66           H   new
ATOM      0  HZ1 LYS A  80      -5.883  -8.925  13.391  1.00  3.77           H   new
ATOM      0  HZ2 LYS A  80      -5.611  -9.900  12.028  1.00  3.77           H   new
ATOM      0  HZ3 LYS A  80      -4.548  -9.974  13.350  1.00  3.77           H   new
ATOM   1269  N   GLU A  81       1.534 -10.930  10.156  1.00  1.10           N
ATOM   1270  CA  GLU A  81       2.727 -11.754  10.326  1.00  1.11           C
ATOM   1271  C   GLU A  81       3.938 -10.976  10.867  1.00  1.10           C
ATOM   1272  O   GLU A  81       4.823 -11.575  11.488  1.00  1.30           O
ATOM   1273  CB  GLU A  81       3.054 -12.547   9.055  1.00  1.30           C
ATOM   1274  CG  GLU A  81       3.073 -11.700   7.779  1.00  1.95           C
ATOM   1275  CD  GLU A  81       3.800 -12.437   6.685  1.00  2.41           C
ATOM   1276  OE1 GLU A  81       5.003 -12.706   6.861  1.00  3.43           O
ATOM   1277  OE2 GLU A  81       3.163 -12.824   5.687  1.00  2.54           O
ATOM      0  H   GLU A  81       1.132 -10.940   9.219  1.00  1.10           H   new
ATOM      0  HA  GLU A  81       2.486 -12.479  11.104  1.00  1.11           H   new
ATOM      0  HB2 GLU A  81       4.027 -13.024   9.177  1.00  1.30           H   new
ATOM      0  HB3 GLU A  81       2.321 -13.345   8.938  1.00  1.30           H   new
ATOM      0  HG2 GLU A  81       2.053 -11.478   7.464  1.00  1.95           H   new
ATOM      0  HG3 GLU A  81       3.562 -10.745   7.973  1.00  1.95           H   new
ATOM   1284  N   ASN A  82       3.992  -9.661  10.636  1.00  1.11           N
ATOM   1285  CA  ASN A  82       5.054  -8.798  11.137  1.00  1.15           C
ATOM   1286  C   ASN A  82       4.765  -8.291  12.549  1.00  1.23           C
ATOM   1287  O   ASN A  82       5.644  -8.382  13.402  1.00  1.49           O
ATOM   1288  CB  ASN A  82       5.341  -7.643  10.172  1.00  1.25           C
ATOM   1289  CG  ASN A  82       6.014  -8.174   8.914  1.00  1.48           C
ATOM   1290  OD1 ASN A  82       7.238  -8.188   8.795  1.00  2.21           O
ATOM   1291  ND2 ASN A  82       5.229  -8.692   7.987  1.00  1.25           N
ATOM      0  H   ASN A  82       3.289  -9.165  10.089  1.00  1.11           H   new
ATOM      0  HA  ASN A  82       5.956  -9.407  11.198  1.00  1.15           H   new
ATOM      0  HB2 ASN A  82       4.412  -7.136   9.912  1.00  1.25           H   new
ATOM      0  HB3 ASN A  82       5.982  -6.905  10.654  1.00  1.25           H   new
ATOM      0 HD21 ASN A  82       5.635  -9.114   7.152  1.00  1.25           H   new
ATOM      0 HD22 ASN A  82       4.216  -8.670   8.106  1.00  1.25           H   new
ATOM   1298  N   LEU A  83       3.586  -7.718  12.806  1.00  1.15           N
ATOM   1299  CA  LEU A  83       3.274  -7.062  14.076  1.00  1.32           C
ATOM   1300  C   LEU A  83       2.283  -7.896  14.899  1.00  1.30           C
ATOM   1301  O   LEU A  83       2.645  -8.438  15.940  1.00  1.72           O
ATOM   1302  CB  LEU A  83       2.750  -5.627  13.858  1.00  1.41           C
ATOM   1303  CG  LEU A  83       3.611  -4.727  12.952  1.00  1.41           C
ATOM   1304  CD1 LEU A  83       2.915  -3.372  12.797  1.00  1.59           C
ATOM   1305  CD2 LEU A  83       4.999  -4.439  13.526  1.00  1.91           C
ATOM      0  H   LEU A  83       2.818  -7.697  12.135  1.00  1.15           H   new
ATOM      0  HA  LEU A  83       4.201  -6.988  14.644  1.00  1.32           H   new
ATOM      0  HB2 LEU A  83       1.749  -5.687  13.431  1.00  1.41           H   new
ATOM      0  HB3 LEU A  83       2.654  -5.144  14.831  1.00  1.41           H   new
ATOM      0  HG  LEU A  83       3.727  -5.262  12.009  1.00  1.41           H   new
ATOM      0 HD11 LEU A  83       3.516  -2.726  12.157  1.00  1.59           H   new
ATOM      0 HD12 LEU A  83       1.933  -3.517  12.347  1.00  1.59           H   new
ATOM      0 HD13 LEU A  83       2.800  -2.908  13.776  1.00  1.59           H   new
ATOM      0 HD21 LEU A  83       5.552  -3.800  12.838  1.00  1.91           H   new
ATOM      0 HD22 LEU A  83       4.898  -3.935  14.487  1.00  1.91           H   new
ATOM      0 HD23 LEU A  83       5.538  -5.377  13.663  1.00  1.91           H   new