USER  MOD reduce.3.24.130724 H: found=0, std=0, add=638, rem=0, adj=25
USER  MOD reduce.3.24.130724 removed 641 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  48 LYS NZ  :NH3+   -156:sc=   0.335   (180deg=0)
USER  MOD Set 1.2: A  53 SER OG  :   rot -160:sc=   0.667
USER  MOD Set 1.3: A  68 SER OG  :   rot   79:sc=    0.37
USER  MOD Set 2.1: A  50 ASN     :      amide:sc=   -3.11! C(o=-1.9!,f=-3.6!)
USER  MOD Set 2.2: A  72 SER OG  :   rot  -22:sc=     1.2
USER  MOD Single : A  27 CYS SG  :   rot   43:sc= -0.0314
USER  MOD Single : A  31 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  32 LYS NZ  :NH3+    166:sc= -0.0982   (180deg=-0.392)
USER  MOD Single : A  41 GLN     :      amide:sc=  -0.528! C(o=-0.53!,f=-4.4!)
USER  MOD Single : A  49 ASN     :      amide:sc=       0  X(o=0,f=-0.34)
USER  MOD Single : A  54 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  55 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  56 LYS NZ  :NH3+   -175:sc=       0   (180deg=-0.044)
USER  MOD Single : A  57 SER OG  :   rot  180:sc=  -0.122
USER  MOD Single : A  61 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  63 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A  65 CYS SG  :   rot  180:sc=   0.101
USER  MOD Single : A  70 CYS SG  :   rot  180:sc=       0
USER  MOD Single : A  73 LYS NZ  :NH3+   -163:sc= -0.0454   (180deg=-0.322)
USER  MOD Single : A  77 THR OG1 :   rot  180:sc=       0
USER  MOD Single : A  79 HIS     :FLIP no HD1:sc=   -1.02  F(o=-3.6!,f=-1)
USER  MOD Single : A  84 CYS SG  :   rot  180:sc=       0
USER  MOD Single : A  89 SER OG  :   rot  180:sc=-0.000202
USER  MOD Single : A  91 ASN     :FLIP  amide:sc=   -1.52  F(o=-3.1!,f=-1.5)
USER  MOD Single : A  93 SER OG  :   rot  180:sc=       0
USER  MOD Single : A  96 TYR OH  :   rot  180:sc=       0
USER  MOD Single : A 100 GLN     :      amide:sc=       0  X(o=0,f=0)
USER  MOD Single : A 106 GLN     :      amide:sc=       0  X(o=0,f=-0.34)
USER  MOD Single : A 107 GLN     :      amide:sc=  -0.017  X(o=-0.017,f=0)
USER  MOD Single : A 114 GLN     :      amide:sc=   0.626  K(o=0.63,f=-0.59)
USER  MOD Single : A 115 HIS     :     no HD1:sc=      -1! C(o=-1!,f=-6.6!)
USER  MOD Single : A 116 LYS NZ  :NH3+   -118:sc=   0.927   (180deg=-0.0727)
USER  MOD Single : A 117 THR OG1 :   rot   45:sc=    0.75
USER  MOD -----------------------------------------------------------------
ATOM     19  N   GLU A  25       3.869  -1.166  -1.935  1.00 24.31           N
ATOM     20  CA  GLU A  25       5.016  -2.041  -2.146  1.00 51.33           C
ATOM     21  C   GLU A  25       6.081  -1.321  -2.969  1.00 43.05           C
ATOM     22  O   GLU A  25       7.232  -1.201  -2.552  1.00 75.23           O
ATOM     23  CB  GLU A  25       4.586  -3.327  -2.858  1.00 53.02           C
ATOM     24  CG  GLU A  25       3.239  -3.875  -2.399  1.00 14.03           C
ATOM     25  CD  GLU A  25       3.178  -4.166  -0.913  1.00 41.34           C
ATOM     26  OE1 GLU A  25       3.637  -5.248  -0.501  1.00 15.01           O
ATOM     27  OE2 GLU A  25       2.636  -3.334  -0.159  1.00 41.05           O
ATOM      0  HA  GLU A  25       5.434  -2.304  -1.174  1.00 51.33           H   new
ATOM      0  HB2 GLU A  25       4.542  -3.138  -3.931  1.00 53.02           H   new
ATOM      0  HB3 GLU A  25       5.349  -4.089  -2.700  1.00 53.02           H   new
ATOM      0  HG2 GLU A  25       2.459  -3.158  -2.653  1.00 14.03           H   new
ATOM      0  HG3 GLU A  25       3.022  -4.790  -2.949  1.00 14.03           H   new
ATOM     34  N   ARG A  26       5.679  -0.831  -4.132  1.00 61.24           N
ATOM     35  CA  ARG A  26       6.578  -0.096  -5.013  1.00 24.35           C
ATOM     36  C   ARG A  26       6.024   1.297  -5.281  1.00 72.14           C
ATOM     37  O   ARG A  26       4.824   1.459  -5.495  1.00  2.23           O
ATOM     38  CB  ARG A  26       6.758  -0.836  -6.346  1.00 13.43           C
ATOM     39  CG  ARG A  26       7.586  -0.061  -7.363  1.00 12.24           C
ATOM     40  CD  ARG A  26       9.078  -0.332  -7.221  1.00  4.51           C
ATOM     41  NE  ARG A  26       9.881   0.863  -7.484  1.00 11.44           N
ATOM     42  CZ  ARG A  26      10.535   1.102  -8.621  1.00  2.00           C
ATOM     43  NH1 ARG A  26      10.472   0.239  -9.633  1.00 54.21           N
ATOM     44  NH2 ARG A  26      11.255   2.210  -8.744  1.00 23.11           N
ATOM      0  H   ARG A  26       4.729  -0.930  -4.491  1.00 61.24           H   new
ATOM      0  HA  ARG A  26       7.547  -0.016  -4.520  1.00 24.35           H   new
ATOM      0  HB2 ARG A  26       7.235  -1.798  -6.157  1.00 13.43           H   new
ATOM      0  HB3 ARG A  26       5.777  -1.045  -6.772  1.00 13.43           H   new
ATOM      0  HG2 ARG A  26       7.265  -0.329  -8.370  1.00 12.24           H   new
ATOM      0  HG3 ARG A  26       7.400   1.006  -7.242  1.00 12.24           H   new
ATOM      0  HD2 ARG A  26       9.286  -0.694  -6.214  1.00  4.51           H   new
ATOM      0  HD3 ARG A  26       9.370  -1.124  -7.911  1.00  4.51           H   new
ATOM      0  HE  ARG A  26       9.945   1.563  -6.745  1.00 11.44           H   new
ATOM      0 HH11 ARG A  26       9.920  -0.614  -9.542  1.00 54.21           H   new
ATOM      0 HH12 ARG A  26      10.976   0.431 -10.499  1.00 54.21           H   new
ATOM      0 HH21 ARG A  26      11.306   2.874  -7.971  1.00 23.11           H   new
ATOM      0 HH22 ARG A  26      11.757   2.398  -9.612  1.00 23.11           H   new
ATOM     58  N   CYS A  27       6.896   2.290  -5.255  1.00  2.13           N
ATOM     59  CA  CYS A  27       6.524   3.648  -5.614  1.00 24.23           C
ATOM     60  C   CYS A  27       7.707   4.352  -6.269  1.00 72.53           C
ATOM     61  O   CYS A  27       8.710   4.647  -5.617  1.00 13.23           O
ATOM     62  CB  CYS A  27       6.043   4.416  -4.379  1.00 62.23           C
ATOM     63  SG  CYS A  27       7.138   4.291  -2.946  1.00 31.21           S
ATOM      0  H   CYS A  27       7.874   2.180  -4.987  1.00  2.13           H   new
ATOM      0  HA  CYS A  27       5.701   3.615  -6.328  1.00 24.23           H   new
ATOM      0  HB2 CYS A  27       5.928   5.467  -4.642  1.00 62.23           H   new
ATOM      0  HB3 CYS A  27       5.056   4.048  -4.099  1.00 62.23           H   new
ATOM      0  HG  CYS A  27       8.373   4.417  -3.331  1.00 31.21           H   new
ATOM     69  N   GLY A  28       7.608   4.588  -7.568  1.00 62.11           N
ATOM     70  CA  GLY A  28       8.700   5.216  -8.285  1.00 35.11           C
ATOM     71  C   GLY A  28       8.305   5.630  -9.683  1.00 61.32           C
ATOM     72  O   GLY A  28       7.216   5.303 -10.140  1.00  2.45           O
ATOM      0  H   GLY A  28       6.794   4.357  -8.138  1.00 62.11           H   new
ATOM      0  HA2 GLY A  28       9.039   6.092  -7.731  1.00 35.11           H   new
ATOM      0  HA3 GLY A  28       9.542   4.526  -8.337  1.00 35.11           H   new
ATOM     76  N   VAL A  29       9.183   6.346 -10.365  1.00  2.13           N
ATOM     77  CA  VAL A  29       8.892   6.807 -11.714  1.00 35.32           C
ATOM     78  C   VAL A  29       9.330   5.801 -12.767  1.00 44.52           C
ATOM     79  O   VAL A  29      10.275   5.033 -12.570  1.00 54.14           O
ATOM     80  CB  VAL A  29       9.545   8.171 -12.021  1.00 11.30           C
ATOM     81  CG1 VAL A  29       8.680   9.306 -11.498  1.00  5.52           C
ATOM     82  CG2 VAL A  29      10.946   8.245 -11.432  1.00 63.44           C
ATOM      0  H   VAL A  29      10.099   6.620 -10.010  1.00  2.13           H   new
ATOM      0  HA  VAL A  29       7.809   6.919 -11.757  1.00 35.32           H   new
ATOM      0  HB  VAL A  29       9.628   8.274 -13.103  1.00 11.30           H   new
ATOM      0 HG11 VAL A  29       9.156  10.260 -11.724  1.00  5.52           H   new
ATOM      0 HG12 VAL A  29       7.701   9.267 -11.976  1.00  5.52           H   new
ATOM      0 HG13 VAL A  29       8.561   9.206 -10.419  1.00  5.52           H   new
ATOM      0 HG21 VAL A  29      11.386   9.215 -11.661  1.00 63.44           H   new
ATOM      0 HG22 VAL A  29      10.893   8.117 -10.351  1.00 63.44           H   new
ATOM      0 HG23 VAL A  29      11.563   7.456 -11.861  1.00 63.44           H   new
ATOM     92  N   LEU A  30       8.615   5.807 -13.876  1.00  3.41           N
ATOM     93  CA  LEU A  30       8.937   4.973 -15.016  1.00  2.54           C
ATOM     94  C   LEU A  30       9.072   5.841 -16.259  1.00 41.24           C
ATOM     95  O   LEU A  30       8.147   6.581 -16.611  1.00 64.31           O
ATOM     96  CB  LEU A  30       7.847   3.919 -15.223  1.00  5.32           C
ATOM     97  CG  LEU A  30       8.067   2.973 -16.405  1.00 45.24           C
ATOM     98  CD1 LEU A  30       9.309   2.120 -16.188  1.00  0.21           C
ATOM     99  CD2 LEU A  30       6.844   2.094 -16.613  1.00 41.35           C
ATOM      0  H   LEU A  30       7.791   6.393 -14.011  1.00  3.41           H   new
ATOM      0  HA  LEU A  30       9.882   4.462 -14.832  1.00  2.54           H   new
ATOM      0  HB2 LEU A  30       7.763   3.324 -14.314  1.00  5.32           H   new
ATOM      0  HB3 LEU A  30       6.893   4.429 -15.360  1.00  5.32           H   new
ATOM      0  HG  LEU A  30       8.220   3.573 -17.302  1.00 45.24           H   new
ATOM      0 HD11 LEU A  30       9.447   1.455 -17.040  1.00  0.21           H   new
ATOM      0 HD12 LEU A  30      10.181   2.766 -16.087  1.00  0.21           H   new
ATOM      0 HD13 LEU A  30       9.190   1.528 -15.281  1.00  0.21           H   new
ATOM      0 HD21 LEU A  30       7.015   1.426 -17.457  1.00 41.35           H   new
ATOM      0 HD22 LEU A  30       6.663   1.504 -15.715  1.00 41.35           H   new
ATOM      0 HD23 LEU A  30       5.976   2.721 -16.816  1.00 41.35           H   new
ATOM    111  N   SER A  31      10.227   5.767 -16.904  1.00 12.25           N
ATOM    112  CA  SER A  31      10.476   6.535 -18.111  1.00 13.33           C
ATOM    113  C   SER A  31      10.004   5.766 -19.343  1.00 60.33           C
ATOM    114  O   SER A  31      10.634   4.793 -19.765  1.00 22.13           O
ATOM    115  CB  SER A  31      11.965   6.861 -18.231  1.00 21.20           C
ATOM    116  OG  SER A  31      12.437   7.532 -17.073  1.00 62.33           O
ATOM      0  H   SER A  31      11.008   5.180 -16.609  1.00 12.25           H   new
ATOM      0  HA  SER A  31       9.915   7.467 -18.049  1.00 13.33           H   new
ATOM      0  HB2 SER A  31      12.531   5.941 -18.378  1.00 21.20           H   new
ATOM      0  HB3 SER A  31      12.134   7.483 -19.110  1.00 21.20           H   new
ATOM      0  HG  SER A  31      13.392   7.727 -17.175  1.00 62.33           H   new
ATOM    122  N   LYS A  32       8.882   6.195 -19.899  1.00 62.33           N
ATOM    123  CA  LYS A  32       8.337   5.582 -21.098  1.00 61.13           C
ATOM    124  C   LYS A  32       7.977   6.662 -22.104  1.00  0.42           C
ATOM    125  O   LYS A  32       7.243   7.595 -21.783  1.00 43.54           O
ATOM    126  CB  LYS A  32       7.107   4.732 -20.751  1.00 14.14           C
ATOM    127  CG  LYS A  32       6.412   4.120 -21.961  1.00  2.44           C
ATOM    128  CD  LYS A  32       7.377   3.326 -22.829  1.00 62.44           C
ATOM    129  CE  LYS A  32       6.677   2.700 -24.024  1.00  4.13           C
ATOM    130  NZ  LYS A  32       5.831   3.679 -24.759  1.00  3.20           N
ATOM      0  H   LYS A  32       8.328   6.971 -19.535  1.00 62.33           H   new
ATOM      0  HA  LYS A  32       9.088   4.926 -21.539  1.00 61.13           H   new
ATOM      0  HB2 LYS A  32       7.411   3.931 -20.076  1.00 14.14           H   new
ATOM      0  HB3 LYS A  32       6.392   5.351 -20.209  1.00 14.14           H   new
ATOM      0  HG2 LYS A  32       5.606   3.468 -21.625  1.00  2.44           H   new
ATOM      0  HG3 LYS A  32       5.956   4.911 -22.556  1.00  2.44           H   new
ATOM      0  HD2 LYS A  32       8.175   3.981 -23.178  1.00 62.44           H   new
ATOM      0  HD3 LYS A  32       7.845   2.544 -22.231  1.00 62.44           H   new
ATOM      0  HE2 LYS A  32       7.422   2.285 -24.703  1.00  4.13           H   new
ATOM      0  HE3 LYS A  32       6.057   1.870 -23.685  1.00  4.13           H   new
ATOM      0  HZ1 LYS A  32       5.567   3.284 -25.684  1.00  3.20           H   new
ATOM      0  HZ2 LYS A  32       4.971   3.877 -24.208  1.00  3.20           H   new
ATOM      0  HZ3 LYS A  32       6.363   4.561 -24.899  1.00  3.20           H   new
ATOM    285  N   GLN A  41       8.070  10.227 -21.239  1.00  0.34           N
ATOM    286  CA  GLN A  41       7.411  10.809 -20.090  1.00 52.42           C
ATOM    287  C   GLN A  41       7.731   9.989 -18.857  1.00 44.31           C
ATOM    288  O   GLN A  41       7.907   8.769 -18.934  1.00 31.54           O
ATOM    289  CB  GLN A  41       5.896  10.900 -20.287  1.00 51.44           C
ATOM    290  CG  GLN A  41       5.195   9.554 -20.344  1.00 40.54           C
ATOM    291  CD  GLN A  41       3.687   9.680 -20.268  1.00 13.44           C
ATOM    292  OE1 GLN A  41       2.958   8.870 -20.832  1.00 11.02           O
ATOM    293  NE2 GLN A  41       3.209  10.687 -19.552  1.00 21.54           N
ATOM      0  HA  GLN A  41       7.783  11.826 -19.965  1.00 52.42           H   new
ATOM      0  HB2 GLN A  41       5.469  11.485 -19.473  1.00 51.44           H   new
ATOM      0  HB3 GLN A  41       5.693  11.443 -21.210  1.00 51.44           H   new
ATOM      0  HG2 GLN A  41       5.467   9.045 -21.269  1.00 40.54           H   new
ATOM      0  HG3 GLN A  41       5.546   8.930 -19.522  1.00 40.54           H   new
ATOM      0 HE21 GLN A  41       3.849  11.339 -19.098  1.00 21.54           H   new
ATOM      0 HE22 GLN A  41       2.201  10.810 -19.454  1.00 21.54           H   new
ATOM    302  N   ASP A  42       7.827  10.666 -17.735  1.00 23.30           N
ATOM    303  CA  ASP A  42       8.100  10.008 -16.472  1.00 34.44           C
ATOM    304  C   ASP A  42       6.819   9.915 -15.660  1.00 61.32           C
ATOM    305  O   ASP A  42       6.269  10.918 -15.209  1.00 42.42           O
ATOM    306  CB  ASP A  42       9.217  10.720 -15.687  1.00 40.22           C
ATOM    307  CG  ASP A  42       8.906  12.162 -15.319  1.00  3.12           C
ATOM    308  OD1 ASP A  42       8.470  12.936 -16.201  1.00 54.31           O
ATOM    309  OD2 ASP A  42       9.146  12.545 -14.154  1.00 72.12           O
ATOM      0  H   ASP A  42       7.720  11.678 -17.669  1.00 23.30           H   new
ATOM      0  HA  ASP A  42       8.461   9.000 -16.676  1.00 34.44           H   new
ATOM      0  HB2 ASP A  42       9.416  10.160 -14.773  1.00 40.22           H   new
ATOM      0  HB3 ASP A  42      10.131  10.698 -16.280  1.00 40.22           H   new
ATOM    314  N   ARG A  43       6.332   8.697 -15.514  1.00 23.12           N
ATOM    315  CA  ARG A  43       5.067   8.455 -14.842  1.00  3.51           C
ATOM    316  C   ARG A  43       5.315   7.810 -13.496  1.00 44.14           C
ATOM    317  O   ARG A  43       6.259   7.039 -13.341  1.00 40.53           O
ATOM    318  CB  ARG A  43       4.161   7.567 -15.702  1.00  0.44           C
ATOM    319  CG  ARG A  43       4.819   6.269 -16.152  1.00 24.11           C
ATOM    320  CD  ARG A  43       3.895   5.441 -17.031  1.00 55.11           C
ATOM    321  NE  ARG A  43       3.554   6.124 -18.279  1.00  3.32           N
ATOM    322  CZ  ARG A  43       2.937   5.537 -19.307  1.00 20.13           C
ATOM    323  NH1 ARG A  43       2.594   4.255 -19.246  1.00  0.43           N
ATOM    324  NH2 ARG A  43       2.656   6.232 -20.401  1.00 14.11           N
ATOM      0  H   ARG A  43       6.796   7.854 -15.854  1.00 23.12           H   new
ATOM      0  HA  ARG A  43       4.563   9.409 -14.690  1.00  3.51           H   new
ATOM      0  HB2 ARG A  43       3.259   7.329 -15.137  1.00  0.44           H   new
ATOM      0  HB3 ARG A  43       3.847   8.128 -16.582  1.00  0.44           H   new
ATOM      0  HG2 ARG A  43       5.734   6.496 -16.699  1.00 24.11           H   new
ATOM      0  HG3 ARG A  43       5.107   5.686 -15.277  1.00 24.11           H   new
ATOM      0  HD2 ARG A  43       4.373   4.488 -17.260  1.00 55.11           H   new
ATOM      0  HD3 ARG A  43       2.981   5.215 -16.482  1.00 55.11           H   new
ATOM      0  HE  ARG A  43       3.803   7.109 -18.369  1.00  3.32           H   new
ATOM      0 HH11 ARG A  43       2.802   3.711 -18.409  1.00  0.43           H   new
ATOM      0 HH12 ARG A  43       2.123   3.815 -20.036  1.00  0.43           H   new
ATOM      0 HH21 ARG A  43       2.911   7.218 -20.459  1.00 14.11           H   new
ATOM      0 HH22 ARG A  43       2.185   5.781 -21.185  1.00 14.11           H   new
ATOM    338  N   TRP A  44       4.473   8.116 -12.528  1.00 74.45           N
ATOM    339  CA  TRP A  44       4.675   7.608 -11.181  1.00 41.22           C
ATOM    340  C   TRP A  44       3.885   6.326 -10.986  1.00 44.44           C
ATOM    341  O   TRP A  44       2.662   6.341 -10.986  1.00 11.40           O
ATOM    342  CB  TRP A  44       4.266   8.654 -10.142  1.00 55.03           C
ATOM    343  CG  TRP A  44       4.550   8.232  -8.733  1.00 65.24           C
ATOM    344  CD1 TRP A  44       3.675   7.669  -7.852  1.00 63.13           C
ATOM    345  CD2 TRP A  44       5.801   8.331  -8.048  1.00  4.05           C
ATOM    346  NE1 TRP A  44       4.302   7.424  -6.657  1.00 42.21           N
ATOM    347  CE2 TRP A  44       5.607   7.819  -6.753  1.00 51.44           C
ATOM    348  CE3 TRP A  44       7.067   8.806  -8.402  1.00 34.14           C
ATOM    349  CZ2 TRP A  44       6.631   7.765  -5.813  1.00 64.21           C
ATOM    350  CZ3 TRP A  44       8.082   8.752  -7.469  1.00 43.13           C
ATOM    351  CH2 TRP A  44       7.860   8.235  -6.187  1.00  3.44           C
ATOM      0  H   TRP A  44       3.650   8.707 -12.645  1.00 74.45           H   new
ATOM      0  HA  TRP A  44       5.735   7.392 -11.045  1.00 41.22           H   new
ATOM      0  HB2 TRP A  44       4.793   9.586 -10.348  1.00 55.03           H   new
ATOM      0  HB3 TRP A  44       3.201   8.861 -10.244  1.00 55.03           H   new
ATOM      0  HD1 TRP A  44       2.639   7.448  -8.064  1.00 63.13           H   new
ATOM      0  HE1 TRP A  44       3.866   7.014  -5.831  1.00 42.21           H   new
ATOM      0  HE3 TRP A  44       7.247   9.208  -9.388  1.00 34.14           H   new
ATOM      0  HZ2 TRP A  44       6.462   7.366  -4.824  1.00 64.21           H   new
ATOM      0  HZ3 TRP A  44       9.065   9.115  -7.732  1.00 43.13           H   new
ATOM      0  HH2 TRP A  44       8.675   8.207  -5.479  1.00  3.44           H   new
ATOM    362  N   VAL A  45       4.587   5.222 -10.821  1.00 42.23           N
ATOM    363  CA  VAL A  45       3.945   3.927 -10.709  1.00 74.22           C
ATOM    364  C   VAL A  45       3.963   3.442  -9.267  1.00 53.11           C
ATOM    365  O   VAL A  45       4.942   3.633  -8.533  1.00  2.01           O
ATOM    366  CB  VAL A  45       4.592   2.866 -11.635  1.00  3.43           C
ATOM    367  CG1 VAL A  45       4.546   3.325 -13.084  1.00 12.22           C
ATOM    368  CG2 VAL A  45       6.024   2.557 -11.217  1.00 14.44           C
ATOM      0  H   VAL A  45       5.605   5.196 -10.761  1.00 42.23           H   new
ATOM      0  HA  VAL A  45       2.912   4.057 -11.032  1.00 74.22           H   new
ATOM      0  HB  VAL A  45       4.014   1.947 -11.540  1.00  3.43           H   new
ATOM      0 HG11 VAL A  45       5.005   2.568 -13.720  1.00 12.22           H   new
ATOM      0 HG12 VAL A  45       3.509   3.473 -13.386  1.00 12.22           H   new
ATOM      0 HG13 VAL A  45       5.091   4.263 -13.186  1.00 12.22           H   new
ATOM      0 HG21 VAL A  45       6.446   1.809 -11.889  1.00 14.44           H   new
ATOM      0 HG22 VAL A  45       6.622   3.467 -11.266  1.00 14.44           H   new
ATOM      0 HG23 VAL A  45       6.030   2.173 -10.197  1.00 14.44           H   new
ATOM    378  N   VAL A  46       2.860   2.836  -8.869  1.00 33.33           N
ATOM    379  CA  VAL A  46       2.681   2.341  -7.521  1.00 33.10           C
ATOM    380  C   VAL A  46       2.142   0.914  -7.541  1.00 31.10           C
ATOM    381  O   VAL A  46       1.049   0.656  -8.044  1.00  1.31           O
ATOM    382  CB  VAL A  46       1.717   3.242  -6.720  1.00 62.34           C
ATOM    383  CG1 VAL A  46       1.229   2.534  -5.468  1.00 12.24           C
ATOM    384  CG2 VAL A  46       2.389   4.556  -6.357  1.00  4.23           C
ATOM      0  H   VAL A  46       2.058   2.673  -9.478  1.00 33.33           H   new
ATOM      0  HA  VAL A  46       3.657   2.352  -7.035  1.00 33.10           H   new
ATOM      0  HB  VAL A  46       0.854   3.457  -7.350  1.00 62.34           H   new
ATOM      0 HG11 VAL A  46       0.551   3.189  -4.920  1.00 12.24           H   new
ATOM      0 HG12 VAL A  46       0.704   1.621  -5.748  1.00 12.24           H   new
ATOM      0 HG13 VAL A  46       2.081   2.284  -4.836  1.00 12.24           H   new
ATOM      0 HG21 VAL A  46       1.693   5.177  -5.793  1.00  4.23           H   new
ATOM      0 HG22 VAL A  46       3.272   4.357  -5.750  1.00  4.23           H   new
ATOM      0 HG23 VAL A  46       2.684   5.077  -7.268  1.00  4.23           H   new
ATOM    394  N   LEU A  47       2.924  -0.002  -6.998  1.00 32.25           N
ATOM    395  CA  LEU A  47       2.524  -1.395  -6.884  1.00 24.22           C
ATOM    396  C   LEU A  47       2.119  -1.659  -5.442  1.00 44.02           C
ATOM    397  O   LEU A  47       2.870  -1.334  -4.523  1.00 23.31           O
ATOM    398  CB  LEU A  47       3.696  -2.306  -7.308  1.00 54.23           C
ATOM    399  CG  LEU A  47       3.396  -3.808  -7.496  1.00  5.04           C
ATOM    400  CD1 LEU A  47       3.202  -4.518  -6.165  1.00  0.04           C
ATOM    401  CD2 LEU A  47       2.177  -4.007  -8.378  1.00 13.53           C
ATOM      0  H   LEU A  47       3.852   0.197  -6.624  1.00 32.25           H   new
ATOM      0  HA  LEU A  47       1.679  -1.609  -7.539  1.00 24.22           H   new
ATOM      0  HB2 LEU A  47       4.098  -1.923  -8.246  1.00 54.23           H   new
ATOM      0  HB3 LEU A  47       4.484  -2.211  -6.561  1.00 54.23           H   new
ATOM      0  HG  LEU A  47       4.263  -4.250  -7.986  1.00  5.04           H   new
ATOM      0 HD11 LEU A  47       2.993  -5.573  -6.342  1.00  0.04           H   new
ATOM      0 HD12 LEU A  47       4.108  -4.423  -5.567  1.00  0.04           H   new
ATOM      0 HD13 LEU A  47       2.366  -4.067  -5.631  1.00  0.04           H   new
ATOM      0 HD21 LEU A  47       1.984  -5.073  -8.497  1.00 13.53           H   new
ATOM      0 HD22 LEU A  47       1.312  -3.531  -7.916  1.00 13.53           H   new
ATOM      0 HD23 LEU A  47       2.358  -3.560  -9.355  1.00 13.53           H   new
ATOM    413  N   LYS A  48       0.930  -2.208  -5.242  1.00 24.25           N
ATOM    414  CA  LYS A  48       0.464  -2.564  -3.907  1.00 14.51           C
ATOM    415  C   LYS A  48      -0.815  -3.362  -4.007  1.00  1.00           C
ATOM    416  O   LYS A  48      -1.490  -3.322  -5.034  1.00 53.35           O
ATOM    417  CB  LYS A  48       0.250  -1.332  -3.032  1.00 13.32           C
ATOM    418  CG  LYS A  48      -1.082  -0.659  -3.243  1.00 60.41           C
ATOM    419  CD  LYS A  48      -1.139   0.111  -4.551  1.00 40.23           C
ATOM    420  CE  LYS A  48      -2.515   0.722  -4.766  1.00 13.05           C
ATOM    421  NZ  LYS A  48      -2.571   1.584  -5.980  1.00 33.44           N
ATOM      0  H   LYS A  48       0.267  -2.418  -5.989  1.00 24.25           H   new
ATOM      0  HA  LYS A  48       1.237  -3.170  -3.434  1.00 14.51           H   new
ATOM      0  HB2 LYS A  48       0.338  -1.622  -1.985  1.00 13.32           H   new
ATOM      0  HB3 LYS A  48       1.045  -0.614  -3.232  1.00 13.32           H   new
ATOM      0  HG2 LYS A  48      -1.872  -1.410  -3.232  1.00 60.41           H   new
ATOM      0  HG3 LYS A  48      -1.278   0.022  -2.415  1.00 60.41           H   new
ATOM      0  HD2 LYS A  48      -0.385   0.898  -4.547  1.00 40.23           H   new
ATOM      0  HD3 LYS A  48      -0.900  -0.555  -5.380  1.00 40.23           H   new
ATOM      0  HE2 LYS A  48      -3.253  -0.075  -4.855  1.00 13.05           H   new
ATOM      0  HE3 LYS A  48      -2.788   1.313  -3.892  1.00 13.05           H   new
ATOM      0  HZ1 LYS A  48      -3.341   2.276  -5.879  1.00 33.44           H   new
ATOM      0  HZ2 LYS A  48      -1.667   2.086  -6.092  1.00 33.44           H   new
ATOM      0  HZ3 LYS A  48      -2.744   0.993  -6.818  1.00 33.44           H   new
ATOM    435  N   ASN A  49      -1.160  -4.063  -2.934  1.00 52.44           N
ATOM    436  CA  ASN A  49      -2.218  -5.055  -2.997  1.00  1.44           C
ATOM    437  C   ASN A  49      -1.881  -5.997  -4.143  1.00 23.14           C
ATOM    438  O   ASN A  49      -0.707  -6.230  -4.433  1.00 62.41           O
ATOM    439  CB  ASN A  49      -3.583  -4.387  -3.222  1.00  4.30           C
ATOM    440  CG  ASN A  49      -3.914  -3.352  -2.162  1.00 51.55           C
ATOM    441  OD1 ASN A  49      -3.517  -3.478  -1.004  1.00 41.12           O
ATOM    442  ND2 ASN A  49      -4.629  -2.313  -2.556  1.00 74.12           N
ATOM      0  H   ASN A  49      -0.724  -3.962  -2.017  1.00 52.44           H   new
ATOM      0  HA  ASN A  49      -2.286  -5.603  -2.057  1.00  1.44           H   new
ATOM      0  HB2 ASN A  49      -3.592  -3.912  -4.203  1.00  4.30           H   new
ATOM      0  HB3 ASN A  49      -4.359  -5.152  -3.231  1.00  4.30           H   new
ATOM      0 HD21 ASN A  49      -4.871  -1.578  -1.891  1.00 74.12           H   new
ATOM      0 HD22 ASN A  49      -4.939  -2.245  -3.525  1.00 74.12           H   new
ATOM    449  N   ASN A  50      -2.871  -6.536  -4.805  1.00 14.15           N
ATOM    450  CA  ASN A  50      -2.600  -7.290  -6.010  1.00 41.13           C
ATOM    451  C   ASN A  50      -2.849  -6.401  -7.222  1.00 13.00           C
ATOM    452  O   ASN A  50      -3.270  -6.870  -8.281  1.00 41.22           O
ATOM    453  CB  ASN A  50      -3.468  -8.544  -6.070  1.00 40.34           C
ATOM    454  CG  ASN A  50      -2.922  -9.590  -7.029  1.00 14.03           C
ATOM    455  OD1 ASN A  50      -3.684 -10.336  -7.643  1.00 14.43           O
ATOM    456  ND2 ASN A  50      -1.599  -9.672  -7.152  1.00 33.41           N
ATOM      0  H   ASN A  50      -3.854  -6.472  -4.541  1.00 14.15           H   new
ATOM      0  HA  ASN A  50      -1.558  -7.611  -6.008  1.00 41.13           H   new
ATOM      0  HB2 ASN A  50      -3.544  -8.976  -5.072  1.00 40.34           H   new
ATOM      0  HB3 ASN A  50      -4.477  -8.268  -6.376  1.00 40.34           H   new
ATOM      0 HD21 ASN A  50      -1.187 -10.370  -7.771  1.00 33.41           H   new
ATOM      0 HD22 ASN A  50      -0.998  -9.037  -6.627  1.00 33.41           H   new
ATOM    463  N   ALA A  51      -2.560  -5.110  -7.073  1.00  2.21           N
ATOM    464  CA  ALA A  51      -2.850  -4.153  -8.128  1.00 12.25           C
ATOM    465  C   ALA A  51      -1.656  -3.251  -8.420  1.00 52.22           C
ATOM    466  O   ALA A  51      -0.796  -3.024  -7.565  1.00 71.43           O
ATOM    467  CB  ALA A  51      -4.060  -3.314  -7.758  1.00 52.42           C
ATOM      0  H   ALA A  51      -2.130  -4.709  -6.239  1.00  2.21           H   new
ATOM      0  HA  ALA A  51      -3.066  -4.719  -9.034  1.00 12.25           H   new
ATOM      0  HB1 ALA A  51      -4.266  -2.601  -8.556  1.00 52.42           H   new
ATOM      0  HB2 ALA A  51      -4.924  -3.963  -7.619  1.00 52.42           H   new
ATOM      0  HB3 ALA A  51      -3.859  -2.774  -6.833  1.00 52.42           H   new
ATOM    473  N   LEU A  52      -1.610  -2.744  -9.637  1.00  2.04           N
ATOM    474  CA  LEU A  52      -0.576  -1.813 -10.039  1.00 32.32           C
ATOM    475  C   LEU A  52      -1.219  -0.575 -10.626  1.00 35.32           C
ATOM    476  O   LEU A  52      -2.118  -0.672 -11.459  1.00  1.24           O
ATOM    477  CB  LEU A  52       0.363  -2.450 -11.060  1.00 21.20           C
ATOM    478  CG  LEU A  52       1.454  -1.529 -11.608  1.00  3.00           C
ATOM    479  CD1 LEU A  52       2.352  -1.015 -10.494  1.00 74.12           C
ATOM    480  CD2 LEU A  52       2.275  -2.258 -12.649  1.00 63.23           C
ATOM      0  H   LEU A  52      -2.284  -2.965 -10.370  1.00  2.04           H   new
ATOM      0  HA  LEU A  52       0.013  -1.541  -9.163  1.00 32.32           H   new
ATOM      0  HB2 LEU A  52       0.839  -3.316 -10.601  1.00 21.20           H   new
ATOM      0  HB3 LEU A  52      -0.232  -2.819 -11.896  1.00 21.20           H   new
ATOM      0  HG  LEU A  52       0.970  -0.670 -12.072  1.00  3.00           H   new
ATOM      0 HD11 LEU A  52       3.117  -0.363 -10.915  1.00 74.12           H   new
ATOM      0 HD12 LEU A  52       1.755  -0.455  -9.774  1.00 74.12           H   new
ATOM      0 HD13 LEU A  52       2.829  -1.858  -9.993  1.00 74.12           H   new
ATOM      0 HD21 LEU A  52       3.049  -1.593 -13.033  1.00 63.23           H   new
ATOM      0 HD22 LEU A  52       2.740  -3.134 -12.197  1.00 63.23           H   new
ATOM      0 HD23 LEU A  52       1.628  -2.572 -13.468  1.00 63.23           H   new
ATOM    492  N   SER A  53      -0.757   0.580 -10.194  1.00  1.24           N
ATOM    493  CA  SER A  53      -1.343   1.835 -10.622  1.00 31.11           C
ATOM    494  C   SER A  53      -0.247   2.795 -11.063  1.00 44.34           C
ATOM    495  O   SER A  53       0.923   2.572 -10.773  1.00 71.45           O
ATOM    496  CB  SER A  53      -2.148   2.451  -9.472  1.00 63.13           C
ATOM    497  OG  SER A  53      -2.961   1.476  -8.833  1.00 62.54           O
ATOM      0  H   SER A  53       0.024   0.677  -9.545  1.00  1.24           H   new
ATOM      0  HA  SER A  53      -2.010   1.649 -11.464  1.00 31.11           H   new
ATOM      0  HB2 SER A  53      -1.467   2.894  -8.745  1.00 63.13           H   new
ATOM      0  HB3 SER A  53      -2.775   3.257  -9.854  1.00 63.13           H   new
ATOM      0  HG  SER A  53      -3.679   1.923  -8.338  1.00 62.54           H   new
ATOM    503  N   TYR A  54      -0.613   3.839 -11.789  1.00  2.41           N
ATOM    504  CA  TYR A  54       0.335   4.893 -12.106  1.00  2.40           C
ATOM    505  C   TYR A  54      -0.380   6.233 -12.198  1.00 34.34           C
ATOM    506  O   TYR A  54      -1.587   6.294 -12.442  1.00  1.04           O
ATOM    507  CB  TYR A  54       1.119   4.584 -13.395  1.00 31.40           C
ATOM    508  CG  TYR A  54       0.493   5.083 -14.680  1.00 33.32           C
ATOM    509  CD1 TYR A  54      -0.408   4.304 -15.389  1.00 53.32           C
ATOM    510  CD2 TYR A  54       0.828   6.329 -15.192  1.00 63.31           C
ATOM    511  CE1 TYR A  54      -0.960   4.752 -16.573  1.00 74.44           C
ATOM    512  CE2 TYR A  54       0.278   6.788 -16.370  1.00 73.34           C
ATOM    513  CZ  TYR A  54      -0.615   5.995 -17.060  1.00 63.43           C
ATOM    514  OH  TYR A  54      -1.163   6.447 -18.238  1.00 11.22           O
ATOM      0  H   TYR A  54      -1.550   3.978 -12.166  1.00  2.41           H   new
ATOM      0  HA  TYR A  54       1.065   4.947 -11.298  1.00  2.40           H   new
ATOM      0  HB2 TYR A  54       2.115   5.018 -13.305  1.00 31.40           H   new
ATOM      0  HB3 TYR A  54       1.247   3.504 -13.470  1.00 31.40           H   new
ATOM      0  HD1 TYR A  54      -0.683   3.331 -15.009  1.00 53.32           H   new
ATOM      0  HD2 TYR A  54       1.532   6.950 -14.658  1.00 63.31           H   new
ATOM      0  HE1 TYR A  54      -1.659   4.132 -17.115  1.00 74.44           H   new
ATOM      0  HE2 TYR A  54       0.545   7.763 -16.750  1.00 73.34           H   new
ATOM      0  HH  TYR A  54      -0.816   7.341 -18.439  1.00 11.22           H   new
ATOM    524  N   TYR A  55       0.376   7.294 -11.986  1.00 74.22           N
ATOM    525  CA  TYR A  55      -0.150   8.640 -11.928  1.00  0.04           C
ATOM    526  C   TYR A  55       0.704   9.541 -12.803  1.00 75.15           C
ATOM    527  O   TYR A  55       1.780   9.135 -13.252  1.00  4.24           O
ATOM    528  CB  TYR A  55      -0.127   9.150 -10.483  1.00  3.52           C
ATOM    529  CG  TYR A  55      -0.641   8.144  -9.475  1.00 51.32           C
ATOM    530  CD1 TYR A  55      -1.989   8.077  -9.156  1.00 14.04           C
ATOM    531  CD2 TYR A  55       0.225   7.258  -8.843  1.00 12.02           C
ATOM    532  CE1 TYR A  55      -2.463   7.160  -8.239  1.00 40.24           C
ATOM    533  CE2 TYR A  55      -0.242   6.338  -7.924  1.00  4.22           C
ATOM    534  CZ  TYR A  55      -1.587   6.293  -7.626  1.00  3.54           C
ATOM    535  OH  TYR A  55      -2.058   5.380  -6.711  1.00 74.13           O
ATOM      0  H   TYR A  55       1.385   7.242 -11.848  1.00 74.22           H   new
ATOM      0  HA  TYR A  55      -1.180   8.645 -12.285  1.00  0.04           H   new
ATOM      0  HB2 TYR A  55       0.894   9.425 -10.220  1.00  3.52           H   new
ATOM      0  HB3 TYR A  55      -0.728  10.057 -10.417  1.00  3.52           H   new
ATOM      0  HD1 TYR A  55      -2.681   8.755  -9.634  1.00 14.04           H   new
ATOM      0  HD2 TYR A  55       1.279   7.290  -9.074  1.00 12.02           H   new
ATOM      0  HE1 TYR A  55      -3.516   7.123  -8.004  1.00 40.24           H   new
ATOM      0  HE2 TYR A  55       0.444   5.657  -7.441  1.00  4.22           H   new
ATOM      0  HH  TYR A  55      -1.312   4.842  -6.372  1.00 74.13           H   new
ATOM    545  N   LYS A  56       0.231  10.752 -13.041  1.00 54.41           N
ATOM    546  CA  LYS A  56       0.974  11.714 -13.845  1.00 73.41           C
ATOM    547  C   LYS A  56       2.302  12.072 -13.188  1.00 44.45           C
ATOM    548  O   LYS A  56       3.325  12.179 -13.860  1.00 64.11           O
ATOM    549  CB  LYS A  56       0.148  12.981 -14.067  1.00 40.05           C
ATOM    550  CG  LYS A  56      -1.029  12.797 -15.011  1.00 41.45           C
ATOM    551  CD  LYS A  56      -0.574  12.360 -16.399  1.00 22.11           C
ATOM    552  CE  LYS A  56       0.396  13.357 -17.024  1.00 64.12           C
ATOM    553  NZ  LYS A  56      -0.217  14.697 -17.215  1.00  1.13           N
ATOM      0  H   LYS A  56      -0.663  11.095 -12.690  1.00 54.41           H   new
ATOM      0  HA  LYS A  56       1.180  11.249 -14.809  1.00 73.41           H   new
ATOM      0  HB2 LYS A  56      -0.224  13.333 -13.105  1.00 40.05           H   new
ATOM      0  HB3 LYS A  56       0.798  13.761 -14.462  1.00 40.05           H   new
ATOM      0  HG2 LYS A  56      -1.712  12.053 -14.601  1.00 41.45           H   new
ATOM      0  HG3 LYS A  56      -1.584  13.732 -15.087  1.00 41.45           H   new
ATOM      0  HD2 LYS A  56      -0.096  11.383 -16.333  1.00 22.11           H   new
ATOM      0  HD3 LYS A  56      -1.444  12.246 -17.046  1.00 22.11           H   new
ATOM      0  HE2 LYS A  56       1.277  13.450 -16.389  1.00 64.12           H   new
ATOM      0  HE3 LYS A  56       0.736  12.975 -17.987  1.00 64.12           H   new
ATOM      0  HZ1 LYS A  56       0.450  15.315 -17.719  1.00  1.13           H   new
ATOM      0  HZ2 LYS A  56      -1.090  14.603 -17.772  1.00  1.13           H   new
ATOM      0  HZ3 LYS A  56      -0.441  15.112 -16.288  1.00  1.13           H   new
ATOM    567  N   SER A  57       2.280  12.260 -11.875  1.00 23.22           N
ATOM    568  CA  SER A  57       3.484  12.598 -11.129  1.00 32.31           C
ATOM    569  C   SER A  57       3.360  12.103  -9.688  1.00 43.24           C
ATOM    570  O   SER A  57       2.318  11.561  -9.307  1.00 12.41           O
ATOM    571  CB  SER A  57       3.723  14.110 -11.167  1.00 40.35           C
ATOM    572  OG  SER A  57       3.772  14.585 -12.503  1.00  2.04           O
ATOM      0  H   SER A  57       1.439  12.184 -11.304  1.00 23.22           H   new
ATOM      0  HA  SER A  57       4.340  12.107 -11.591  1.00 32.31           H   new
ATOM      0  HB2 SER A  57       2.927  14.621 -10.625  1.00 40.35           H   new
ATOM      0  HB3 SER A  57       4.658  14.347 -10.659  1.00 40.35           H   new
ATOM      0  HG  SER A  57       3.924  15.553 -12.501  1.00  2.04           H   new
ATOM    578  N   GLU A  58       4.409  12.310  -8.895  1.00 73.52           N
ATOM    579  CA  GLU A  58       4.483  11.761  -7.539  1.00 74.22           C
ATOM    580  C   GLU A  58       3.405  12.331  -6.620  1.00 12.14           C
ATOM    581  O   GLU A  58       2.996  11.676  -5.658  1.00 62.22           O
ATOM    582  CB  GLU A  58       5.857  12.024  -6.925  1.00 71.22           C
ATOM    583  CG  GLU A  58       5.975  11.520  -5.498  1.00  3.24           C
ATOM    584  CD  GLU A  58       7.318  11.839  -4.872  1.00 31.43           C
ATOM    585  OE1 GLU A  58       8.300  11.117  -5.141  1.00 12.20           O
ATOM    586  OE2 GLU A  58       7.402  12.822  -4.108  1.00 42.21           O
ATOM      0  H   GLU A  58       5.225  12.857  -9.169  1.00 73.52           H   new
ATOM      0  HA  GLU A  58       4.316  10.688  -7.630  1.00 74.22           H   new
ATOM      0  HB2 GLU A  58       6.621  11.545  -7.538  1.00 71.22           H   new
ATOM      0  HB3 GLU A  58       6.058  13.095  -6.944  1.00 71.22           H   new
ATOM      0  HG2 GLU A  58       5.183  11.963  -4.894  1.00  3.24           H   new
ATOM      0  HG3 GLU A  58       5.820  10.441  -5.484  1.00  3.24           H   new
ATOM    593  N   ASP A  59       2.959  13.553  -6.900  1.00 75.24           N
ATOM    594  CA  ASP A  59       1.902  14.178  -6.104  1.00 35.42           C
ATOM    595  C   ASP A  59       0.691  13.260  -6.013  1.00 61.32           C
ATOM    596  O   ASP A  59       0.048  13.195  -4.974  1.00 43.05           O
ATOM    597  CB  ASP A  59       1.491  15.521  -6.702  1.00 74.11           C
ATOM    598  CG  ASP A  59       0.387  16.191  -5.909  1.00 22.44           C
ATOM    599  OD1 ASP A  59       0.683  16.750  -4.829  1.00 33.33           O
ATOM    600  OD2 ASP A  59      -0.777  16.164  -6.357  1.00 71.41           O
ATOM      0  H   ASP A  59       3.309  14.128  -7.666  1.00 75.24           H   new
ATOM      0  HA  ASP A  59       2.294  14.350  -5.102  1.00 35.42           H   new
ATOM      0  HB2 ASP A  59       2.359  16.180  -6.740  1.00 74.11           H   new
ATOM      0  HB3 ASP A  59       1.158  15.372  -7.729  1.00 74.11           H   new
ATOM    605  N   GLU A  60       0.457  12.533  -7.117  1.00 62.32           N
ATOM    606  CA  GLU A  60      -0.602  11.528  -7.296  1.00 33.43           C
ATOM    607  C   GLU A  60      -2.040  11.952  -6.921  1.00  2.12           C
ATOM    608  O   GLU A  60      -2.967  11.659  -7.677  1.00 73.53           O
ATOM    609  CB  GLU A  60      -0.200  10.185  -6.656  1.00  4.21           C
ATOM    610  CG  GLU A  60       0.118  10.200  -5.163  1.00 14.03           C
ATOM    611  CD  GLU A  60      -1.120  10.161  -4.284  1.00 24.22           C
ATOM    612  OE1 GLU A  60      -1.980   9.280  -4.500  1.00  5.51           O
ATOM    613  OE2 GLU A  60      -1.230  10.997  -3.360  1.00 53.12           O
ATOM      0  H   GLU A  60       1.032  12.636  -7.953  1.00 62.32           H   new
ATOM      0  HA  GLU A  60      -0.672  11.409  -8.377  1.00 33.43           H   new
ATOM      0  HB2 GLU A  60      -1.009   9.474  -6.824  1.00  4.21           H   new
ATOM      0  HB3 GLU A  60       0.674   9.805  -7.185  1.00  4.21           H   new
ATOM      0  HG2 GLU A  60       0.751   9.345  -4.925  1.00 14.03           H   new
ATOM      0  HG3 GLU A  60       0.692  11.097  -4.930  1.00 14.03           H   new
ATOM    620  N   THR A  61      -2.233  12.641  -5.807  1.00 52.43           N
ATOM    621  CA  THR A  61      -3.566  12.970  -5.312  1.00 60.15           C
ATOM    622  C   THR A  61      -4.417  13.705  -6.354  1.00 75.13           C
ATOM    623  O   THR A  61      -5.532  13.280  -6.657  1.00 25.23           O
ATOM    624  CB  THR A  61      -3.496  13.788  -3.997  1.00 35.11           C
ATOM    625  OG1 THR A  61      -4.802  14.240  -3.614  1.00 34.10           O
ATOM    626  CG2 THR A  61      -2.562  14.977  -4.124  1.00  2.35           C
ATOM      0  H   THR A  61      -1.474  12.988  -5.220  1.00 52.43           H   new
ATOM      0  HA  THR A  61      -4.057  12.019  -5.104  1.00 60.15           H   new
ATOM      0  HB  THR A  61      -3.102  13.126  -3.226  1.00 35.11           H   new
ATOM      0  HG1 THR A  61      -4.739  14.753  -2.781  1.00 34.10           H   new
ATOM      0 HG21 THR A  61      -2.540  15.525  -3.182  1.00  2.35           H   new
ATOM      0 HG22 THR A  61      -1.558  14.627  -4.364  1.00  2.35           H   new
ATOM      0 HG23 THR A  61      -2.916  15.635  -4.918  1.00  2.35           H   new
ATOM    634  N   GLU A  62      -3.895  14.781  -6.928  1.00 55.02           N
ATOM    635  CA  GLU A  62      -4.672  15.556  -7.890  1.00  0.25           C
ATOM    636  C   GLU A  62      -4.457  15.046  -9.309  1.00 11.11           C
ATOM    637  O   GLU A  62      -4.989  15.606 -10.268  1.00 11.24           O
ATOM    638  CB  GLU A  62      -4.320  17.040  -7.826  1.00 31.30           C
ATOM    639  CG  GLU A  62      -2.932  17.371  -8.343  1.00 52.43           C
ATOM    640  CD  GLU A  62      -2.765  18.848  -8.606  1.00 72.43           C
ATOM    641  OE1 GLU A  62      -2.381  19.584  -7.677  1.00 53.34           O
ATOM    642  OE2 GLU A  62      -3.041  19.283  -9.743  1.00 40.11           O
ATOM      0  H   GLU A  62      -2.955  15.133  -6.750  1.00 55.02           H   new
ATOM      0  HA  GLU A  62      -5.721  15.433  -7.622  1.00  0.25           H   new
ATOM      0  HB2 GLU A  62      -5.054  17.602  -8.403  1.00 31.30           H   new
ATOM      0  HB3 GLU A  62      -4.401  17.377  -6.793  1.00 31.30           H   new
ATOM      0  HG2 GLU A  62      -2.187  17.045  -7.617  1.00 52.43           H   new
ATOM      0  HG3 GLU A  62      -2.745  16.816  -9.262  1.00 52.43           H   new
ATOM    649  N   TYR A  63      -3.673  13.993  -9.445  1.00 25.44           N
ATOM    650  CA  TYR A  63      -3.397  13.431 -10.754  1.00 63.54           C
ATOM    651  C   TYR A  63      -4.275  12.220 -11.014  1.00 42.15           C
ATOM    652  O   TYR A  63      -4.631  11.938 -12.157  1.00 54.03           O
ATOM    653  CB  TYR A  63      -1.918  13.070 -10.882  1.00 40.12           C
ATOM    654  CG  TYR A  63      -1.012  14.279 -10.892  1.00 12.50           C
ATOM    655  CD1 TYR A  63      -1.196  15.299 -11.818  1.00 52.21           C
ATOM    656  CD2 TYR A  63       0.029  14.403  -9.985  1.00 42.32           C
ATOM    657  CE1 TYR A  63      -0.369  16.405 -11.839  1.00 51.15           C
ATOM    658  CE2 TYR A  63       0.860  15.508  -9.998  1.00  2.15           C
ATOM    659  CZ  TYR A  63       0.658  16.504 -10.928  1.00 51.02           C
ATOM    660  OH  TYR A  63       1.487  17.603 -10.950  1.00 61.24           O
ATOM      0  H   TYR A  63      -3.218  13.511  -8.669  1.00 25.44           H   new
ATOM      0  HA  TYR A  63      -3.629  14.184 -11.507  1.00 63.54           H   new
ATOM      0  HB2 TYR A  63      -1.636  12.419 -10.055  1.00 40.12           H   new
ATOM      0  HB3 TYR A  63      -1.767  12.502 -11.800  1.00 40.12           H   new
ATOM      0  HD1 TYR A  63      -2.001  15.225 -12.535  1.00 52.21           H   new
ATOM      0  HD2 TYR A  63       0.194  13.623  -9.256  1.00 42.32           H   new
ATOM      0  HE1 TYR A  63      -0.527  17.188 -12.566  1.00 51.15           H   new
ATOM      0  HE2 TYR A  63       1.664  15.590  -9.282  1.00  2.15           H   new
ATOM      0  HH  TYR A  63       2.159  17.520 -10.242  1.00 61.24           H   new
ATOM    670  N   GLY A  64      -4.618  11.512  -9.944  1.00 43.23           N
ATOM    671  CA  GLY A  64      -5.497  10.367 -10.054  1.00 63.34           C
ATOM    672  C   GLY A  64      -4.807   9.163 -10.663  1.00 40.24           C
ATOM    673  O   GLY A  64      -3.816   9.303 -11.387  1.00 44.44           O
ATOM      0  H   GLY A  64      -4.299  11.714  -8.996  1.00 43.23           H   new
ATOM      0  HA2 GLY A  64      -5.873  10.105  -9.065  1.00 63.34           H   new
ATOM      0  HA3 GLY A  64      -6.361  10.633 -10.663  1.00 63.34           H   new
ATOM    677  N   CYS A  65      -5.310   7.975 -10.359  1.00 35.10           N
ATOM    678  CA  CYS A  65      -4.785   6.761 -10.953  1.00 52.31           C
ATOM    679  C   CYS A  65      -5.102   6.730 -12.443  1.00 44.21           C
ATOM    680  O   CYS A  65      -6.233   6.470 -12.855  1.00 71.23           O
ATOM    681  CB  CYS A  65      -5.340   5.525 -10.236  1.00 21.51           C
ATOM    682  SG  CYS A  65      -7.111   5.605  -9.870  1.00 53.34           S
ATOM      0  H   CYS A  65      -6.079   7.829  -9.705  1.00 35.10           H   new
ATOM      0  HA  CYS A  65      -3.701   6.749 -10.836  1.00 52.31           H   new
ATOM      0  HB2 CYS A  65      -5.148   4.646 -10.852  1.00 21.51           H   new
ATOM      0  HB3 CYS A  65      -4.794   5.386  -9.303  1.00 21.51           H   new
ATOM      0  HG  CYS A  65      -7.479   4.514  -9.267  1.00 53.34           H   new
ATOM    688  N   ARG A  66      -4.091   7.029 -13.239  1.00  2.45           N
ATOM    689  CA  ARG A  66      -4.236   7.138 -14.681  1.00 72.12           C
ATOM    690  C   ARG A  66      -4.286   5.764 -15.322  1.00 43.14           C
ATOM    691  O   ARG A  66      -4.748   5.600 -16.449  1.00 40.42           O
ATOM    692  CB  ARG A  66      -3.082   7.961 -15.241  1.00 12.21           C
ATOM    693  CG  ARG A  66      -3.145   9.407 -14.800  1.00 20.40           C
ATOM    694  CD  ARG A  66      -4.416  10.050 -15.327  1.00 15.10           C
ATOM    695  NE  ARG A  66      -4.589  11.425 -14.880  1.00 40.03           N
ATOM    696  CZ  ARG A  66      -4.992  12.407 -15.678  1.00 51.52           C
ATOM    697  NH1 ARG A  66      -5.243  12.160 -16.960  1.00 74.13           N
ATOM    698  NH2 ARG A  66      -5.173  13.626 -15.194  1.00 64.24           N
ATOM      0  H   ARG A  66      -3.144   7.204 -12.904  1.00  2.45           H   new
ATOM      0  HA  ARG A  66      -5.175   7.640 -14.912  1.00 72.12           H   new
ATOM      0  HB2 ARG A  66      -2.137   7.525 -14.918  1.00 12.21           H   new
ATOM      0  HB3 ARG A  66      -3.099   7.914 -16.330  1.00 12.21           H   new
ATOM      0  HG2 ARG A  66      -3.121   9.466 -13.712  1.00 20.40           H   new
ATOM      0  HG3 ARG A  66      -2.273   9.948 -15.168  1.00 20.40           H   new
ATOM      0  HD2 ARG A  66      -4.402  10.028 -16.417  1.00 15.10           H   new
ATOM      0  HD3 ARG A  66      -5.274   9.460 -15.007  1.00 15.10           H   new
ATOM      0  HE  ARG A  66      -4.390  11.645 -13.904  1.00 40.03           H   new
ATOM      0 HH11 ARG A  66      -5.126  11.217 -17.330  1.00 74.13           H   new
ATOM      0 HH12 ARG A  66      -5.553  12.914 -17.573  1.00 74.13           H   new
ATOM      0 HH21 ARG A  66      -5.003  13.813 -14.206  1.00 64.24           H   new
ATOM      0 HH22 ARG A  66      -5.483  14.378 -15.809  1.00 64.24           H   new
ATOM    712  N   GLY A  67      -3.803   4.789 -14.584  1.00 62.32           N
ATOM    713  CA  GLY A  67      -3.870   3.417 -15.011  1.00 12.02           C
ATOM    714  C   GLY A  67      -3.766   2.500 -13.826  1.00 25.22           C
ATOM    715  O   GLY A  67      -2.884   2.675 -12.989  1.00  3.41           O
ATOM      0  H   GLY A  67      -3.356   4.928 -13.678  1.00 62.32           H   new
ATOM      0  HA2 GLY A  67      -4.807   3.238 -15.538  1.00 12.02           H   new
ATOM      0  HA3 GLY A  67      -3.064   3.207 -15.714  1.00 12.02           H   new
ATOM    719  N   SER A  68      -4.683   1.562 -13.725  1.00  3.24           N
ATOM    720  CA  SER A  68      -4.682   0.624 -12.619  1.00 25.40           C
ATOM    721  C   SER A  68      -5.083  -0.755 -13.117  1.00 61.44           C
ATOM    722  O   SER A  68      -6.129  -0.921 -13.747  1.00 52.34           O
ATOM    723  CB  SER A  68      -5.629   1.101 -11.512  1.00 73.21           C
ATOM    724  OG  SER A  68      -5.401   0.398 -10.300  1.00 51.45           O
ATOM      0  H   SER A  68      -5.440   1.427 -14.395  1.00  3.24           H   new
ATOM      0  HA  SER A  68      -3.677   0.566 -12.200  1.00 25.40           H   new
ATOM      0  HB2 SER A  68      -5.490   2.169 -11.347  1.00 73.21           H   new
ATOM      0  HB3 SER A  68      -6.662   0.959 -11.828  1.00 73.21           H   new
ATOM      0  HG  SER A  68      -4.610   0.765  -9.852  1.00 51.45           H   new
ATOM    730  N   ILE A  69      -4.238  -1.735 -12.857  1.00 41.44           N
ATOM    731  CA  ILE A  69      -4.464  -3.081 -13.347  1.00  4.10           C
ATOM    732  C   ILE A  69      -4.401  -4.098 -12.218  1.00 22.51           C
ATOM    733  O   ILE A  69      -3.739  -3.876 -11.205  1.00  5.40           O
ATOM    734  CB  ILE A  69      -3.434  -3.464 -14.429  1.00  1.01           C
ATOM    735  CG1 ILE A  69      -2.001  -3.281 -13.911  1.00 44.23           C
ATOM    736  CG2 ILE A  69      -3.665  -2.645 -15.691  1.00  3.31           C
ATOM    737  CD1 ILE A  69      -0.941  -3.779 -14.872  1.00 35.24           C
ATOM      0  H   ILE A  69      -3.386  -1.623 -12.307  1.00 41.44           H   new
ATOM      0  HA  ILE A  69      -5.462  -3.094 -13.784  1.00  4.10           H   new
ATOM      0  HB  ILE A  69      -3.567  -4.518 -14.673  1.00  1.01           H   new
ATOM      0 HG12 ILE A  69      -1.829  -2.224 -13.709  1.00 44.23           H   new
ATOM      0 HG13 ILE A  69      -1.896  -3.808 -12.963  1.00 44.23           H   new
ATOM      0 HG21 ILE A  69      -2.931  -2.926 -16.446  1.00  3.31           H   new
ATOM      0 HG22 ILE A  69      -4.668  -2.837 -16.071  1.00  3.31           H   new
ATOM      0 HG23 ILE A  69      -3.561  -1.585 -15.461  1.00  3.31           H   new
ATOM      0 HD11 ILE A  69       0.047  -3.617 -14.440  1.00 35.24           H   new
ATOM      0 HD12 ILE A  69      -1.087  -4.843 -15.055  1.00 35.24           H   new
ATOM      0 HD13 ILE A  69      -1.019  -3.235 -15.813  1.00 35.24           H   new
ATOM    749  N   CYS A  70      -5.088  -5.215 -12.405  1.00  5.01           N
ATOM    750  CA  CYS A  70      -5.099  -6.281 -11.419  1.00  0.43           C
ATOM    751  C   CYS A  70      -4.104  -7.366 -11.812  1.00  2.02           C
ATOM    752  O   CYS A  70      -4.192  -7.937 -12.900  1.00 43.14           O
ATOM    753  CB  CYS A  70      -6.504  -6.867 -11.295  1.00 75.42           C
ATOM    754  SG  CYS A  70      -7.770  -5.650 -10.865  1.00  3.52           S
ATOM      0  H   CYS A  70      -5.648  -5.406 -13.236  1.00  5.01           H   new
ATOM      0  HA  CYS A  70      -4.806  -5.872 -10.452  1.00  0.43           H   new
ATOM      0  HB2 CYS A  70      -6.774  -7.340 -12.239  1.00 75.42           H   new
ATOM      0  HB3 CYS A  70      -6.495  -7.650 -10.537  1.00 75.42           H   new
ATOM      0  HG  CYS A  70      -8.927  -6.237 -10.784  1.00  3.52           H   new
ATOM    760  N   LEU A  71      -3.173  -7.657 -10.914  1.00 51.43           N
ATOM    761  CA  LEU A  71      -2.093  -8.604 -11.187  1.00 73.23           C
ATOM    762  C   LEU A  71      -2.578 -10.049 -11.144  1.00 41.35           C
ATOM    763  O   LEU A  71      -1.799 -10.978 -11.345  1.00 44.12           O
ATOM    764  CB  LEU A  71      -0.950  -8.409 -10.186  1.00 53.01           C
ATOM    765  CG  LEU A  71       0.064  -7.311 -10.536  1.00 31.31           C
ATOM    766  CD1 LEU A  71       0.681  -7.564 -11.902  1.00 52.03           C
ATOM    767  CD2 LEU A  71      -0.588  -5.939 -10.495  1.00 74.14           C
ATOM      0  H   LEU A  71      -3.142  -7.248  -9.980  1.00 51.43           H   new
ATOM      0  HA  LEU A  71      -1.732  -8.403 -12.196  1.00 73.23           H   new
ATOM      0  HB2 LEU A  71      -1.381  -8.182  -9.211  1.00 53.01           H   new
ATOM      0  HB3 LEU A  71      -0.415  -9.353 -10.086  1.00 53.01           H   new
ATOM      0  HG  LEU A  71       0.857  -7.336  -9.789  1.00 31.31           H   new
ATOM      0 HD11 LEU A  71       1.397  -6.774 -12.130  1.00 52.03           H   new
ATOM      0 HD12 LEU A  71       1.192  -8.527 -11.898  1.00 52.03           H   new
ATOM      0 HD13 LEU A  71      -0.103  -7.573 -12.659  1.00 52.03           H   new
ATOM      0 HD21 LEU A  71       0.150  -5.178 -10.746  1.00 74.14           H   new
ATOM      0 HD22 LEU A  71      -1.406  -5.903 -11.215  1.00 74.14           H   new
ATOM      0 HD23 LEU A  71      -0.977  -5.751  -9.494  1.00 74.14           H   new
ATOM    779  N   SER A  72      -3.863 -10.231 -10.887  1.00  0.35           N
ATOM    780  CA  SER A  72      -4.454 -11.557 -10.855  1.00 42.12           C
ATOM    781  C   SER A  72      -4.477 -12.169 -12.257  1.00 72.14           C
ATOM    782  O   SER A  72      -4.254 -13.367 -12.427  1.00  1.02           O
ATOM    783  CB  SER A  72      -5.870 -11.476 -10.288  1.00  2.43           C
ATOM    784  OG  SER A  72      -5.887 -10.729  -9.081  1.00 73.13           O
ATOM      0  H   SER A  72      -4.518  -9.473 -10.697  1.00  0.35           H   new
ATOM      0  HA  SER A  72      -3.849 -12.197 -10.213  1.00 42.12           H   new
ATOM      0  HB2 SER A  72      -6.533 -11.011 -11.018  1.00  2.43           H   new
ATOM      0  HB3 SER A  72      -6.251 -12.481 -10.105  1.00  2.43           H   new
ATOM      0  HG  SER A  72      -4.990 -10.726  -8.686  1.00 73.13           H   new
ATOM    790  N   LYS A  73      -4.737 -11.334 -13.258  1.00 12.34           N
ATOM    791  CA  LYS A  73      -4.802 -11.792 -14.640  1.00 73.51           C
ATOM    792  C   LYS A  73      -3.731 -11.120 -15.493  1.00 63.14           C
ATOM    793  O   LYS A  73      -3.786 -11.165 -16.721  1.00 42.01           O
ATOM    794  CB  LYS A  73      -6.184 -11.500 -15.221  1.00 64.35           C
ATOM    795  CG  LYS A  73      -6.587 -10.039 -15.119  1.00  1.14           C
ATOM    796  CD  LYS A  73      -7.829  -9.870 -14.266  1.00  3.11           C
ATOM    797  CE  LYS A  73      -9.064 -10.447 -14.951  1.00 42.01           C
ATOM    798  NZ  LYS A  73      -9.374  -9.735 -16.222  1.00 51.52           N
ATOM      0  H   LYS A  73      -4.906 -10.335 -13.137  1.00 12.34           H   new
ATOM      0  HA  LYS A  73      -4.622 -12.867 -14.650  1.00 73.51           H   new
ATOM      0  HB2 LYS A  73      -6.200 -11.801 -16.268  1.00 64.35           H   new
ATOM      0  HB3 LYS A  73      -6.924 -12.110 -14.703  1.00 64.35           H   new
ATOM      0  HG2 LYS A  73      -5.767  -9.462 -14.691  1.00  1.14           H   new
ATOM      0  HG3 LYS A  73      -6.771  -9.639 -16.116  1.00  1.14           H   new
ATOM      0  HD2 LYS A  73      -7.681 -10.363 -13.305  1.00  3.11           H   new
ATOM      0  HD3 LYS A  73      -7.988  -8.812 -14.060  1.00  3.11           H   new
ATOM      0  HE2 LYS A  73      -8.905 -11.505 -15.157  1.00 42.01           H   new
ATOM      0  HE3 LYS A  73      -9.919 -10.378 -14.278  1.00 42.01           H   new
ATOM      0  HZ1 LYS A  73     -10.351  -9.945 -16.508  1.00 51.52           H   new
ATOM      0  HZ2 LYS A  73      -9.268  -8.710 -16.081  1.00 51.52           H   new
ATOM      0  HZ3 LYS A  73      -8.720 -10.052 -16.966  1.00 51.52           H   new
ATOM    812  N   ALA A  74      -2.759 -10.502 -14.842  1.00  0.10           N
ATOM    813  CA  ALA A  74      -1.705  -9.805 -15.556  1.00 34.32           C
ATOM    814  C   ALA A  74      -0.538 -10.738 -15.838  1.00 55.12           C
ATOM    815  O   ALA A  74       0.003 -11.369 -14.929  1.00 45.02           O
ATOM    816  CB  ALA A  74      -1.243  -8.591 -14.772  1.00 61.33           C
ATOM      0  H   ALA A  74      -2.679 -10.469 -13.826  1.00  0.10           H   new
ATOM      0  HA  ALA A  74      -2.106  -9.464 -16.511  1.00 34.32           H   new
ATOM      0  HB1 ALA A  74      -0.453  -8.081 -15.323  1.00 61.33           H   new
ATOM      0  HB2 ALA A  74      -2.082  -7.910 -14.628  1.00 61.33           H   new
ATOM      0  HB3 ALA A  74      -0.862  -8.908 -13.801  1.00 61.33           H   new
ATOM    822  N   VAL A  75      -0.163 -10.828 -17.101  1.00 72.21           N
ATOM    823  CA  VAL A  75       0.931 -11.686 -17.514  1.00 12.15           C
ATOM    824  C   VAL A  75       2.251 -10.928 -17.460  1.00 22.23           C
ATOM    825  O   VAL A  75       2.443  -9.933 -18.170  1.00 31.32           O
ATOM    826  CB  VAL A  75       0.719 -12.233 -18.942  1.00  4.04           C
ATOM    827  CG1 VAL A  75       1.834 -13.200 -19.319  1.00 22.21           C
ATOM    828  CG2 VAL A  75      -0.639 -12.911 -19.062  1.00  2.24           C
ATOM      0  H   VAL A  75      -0.604 -10.313 -17.863  1.00 72.21           H   new
ATOM      0  HA  VAL A  75       0.960 -12.527 -16.822  1.00 12.15           H   new
ATOM      0  HB  VAL A  75       0.745 -11.392 -19.635  1.00  4.04           H   new
ATOM      0 HG11 VAL A  75       1.665 -13.574 -20.329  1.00 22.21           H   new
ATOM      0 HG12 VAL A  75       2.793 -12.683 -19.279  1.00 22.21           H   new
ATOM      0 HG13 VAL A  75       1.843 -14.036 -18.620  1.00 22.21           H   new
ATOM      0 HG21 VAL A  75      -0.768 -13.289 -20.076  1.00  2.24           H   new
ATOM      0 HG22 VAL A  75      -0.696 -13.739 -18.356  1.00  2.24           H   new
ATOM      0 HG23 VAL A  75      -1.426 -12.190 -18.840  1.00  2.24           H   new
ATOM    838  N   ILE A  76       3.145 -11.389 -16.601  1.00 41.52           N
ATOM    839  CA  ILE A  76       4.471 -10.806 -16.486  1.00 42.51           C
ATOM    840  C   ILE A  76       5.387 -11.383 -17.557  1.00 62.24           C
ATOM    841  O   ILE A  76       5.859 -12.512 -17.441  1.00 74.33           O
ATOM    842  CB  ILE A  76       5.093 -11.073 -15.101  1.00 53.52           C
ATOM    843  CG1 ILE A  76       4.138 -10.633 -13.990  1.00 31.21           C
ATOM    844  CG2 ILE A  76       6.429 -10.351 -14.971  1.00  0.50           C
ATOM    845  CD1 ILE A  76       4.622 -10.996 -12.602  1.00 41.14           C
ATOM      0  H   ILE A  76       2.974 -12.171 -15.969  1.00 41.52           H   new
ATOM      0  HA  ILE A  76       4.367  -9.729 -16.617  1.00 42.51           H   new
ATOM      0  HB  ILE A  76       5.266 -12.144 -15.001  1.00 53.52           H   new
ATOM      0 HG12 ILE A  76       3.999  -9.553 -14.047  1.00 31.21           H   new
ATOM      0 HG13 ILE A  76       3.163 -11.090 -14.158  1.00 31.21           H   new
ATOM      0 HG21 ILE A  76       6.856 -10.549 -13.988  1.00  0.50           H   new
ATOM      0 HG22 ILE A  76       7.112 -10.708 -15.742  1.00  0.50           H   new
ATOM      0 HG23 ILE A  76       6.276  -9.278 -15.091  1.00  0.50           H   new
ATOM      0 HD11 ILE A  76       3.897 -10.655 -11.863  1.00 41.14           H   new
ATOM      0 HD12 ILE A  76       4.734 -12.078 -12.527  1.00 41.14           H   new
ATOM      0 HD13 ILE A  76       5.583 -10.518 -12.415  1.00 41.14           H   new
ATOM    857  N   THR A  77       5.606 -10.623 -18.609  1.00 32.23           N
ATOM    858  CA  THR A  77       6.464 -11.053 -19.694  1.00 54.03           C
ATOM    859  C   THR A  77       7.820 -10.357 -19.605  1.00 43.54           C
ATOM    860  O   THR A  77       7.940  -9.174 -19.913  1.00  0.40           O
ATOM    861  CB  THR A  77       5.808 -10.745 -21.052  1.00 42.11           C
ATOM    862  OG1 THR A  77       4.472 -11.265 -21.063  1.00 32.31           O
ATOM    863  CG2 THR A  77       6.602 -11.353 -22.197  1.00 12.41           C
ATOM      0  H   THR A  77       5.198  -9.697 -18.737  1.00 32.23           H   new
ATOM      0  HA  THR A  77       6.611 -12.130 -19.609  1.00 54.03           H   new
ATOM      0  HB  THR A  77       5.789  -9.664 -21.188  1.00 42.11           H   new
ATOM      0  HG1 THR A  77       4.052 -11.069 -21.926  1.00 32.31           H   new
ATOM      0 HG21 THR A  77       6.114 -11.118 -23.143  1.00 12.41           H   new
ATOM      0 HG22 THR A  77       7.612 -10.942 -22.198  1.00 12.41           H   new
ATOM      0 HG23 THR A  77       6.650 -12.435 -22.072  1.00 12.41           H   new
ATOM    871  N   PRO A  78       8.856 -11.073 -19.152  1.00 40.11           N
ATOM    872  CA  PRO A  78      10.196 -10.503 -19.004  1.00 21.41           C
ATOM    873  C   PRO A  78      10.793 -10.100 -20.349  1.00 73.45           C
ATOM    874  O   PRO A  78      10.589 -10.777 -21.358  1.00 62.23           O
ATOM    875  CB  PRO A  78      11.005 -11.638 -18.368  1.00 12.23           C
ATOM    876  CG  PRO A  78      10.259 -12.882 -18.705  1.00 53.54           C
ATOM    877  CD  PRO A  78       8.810 -12.492 -18.762  1.00 42.14           C
ATOM      0  HA  PRO A  78      10.192  -9.591 -18.407  1.00 21.41           H   new
ATOM      0  HB2 PRO A  78      12.020 -11.668 -18.763  1.00 12.23           H   new
ATOM      0  HB3 PRO A  78      11.087 -11.507 -17.289  1.00 12.23           H   new
ATOM      0  HG2 PRO A  78      10.591 -13.290 -19.660  1.00 53.54           H   new
ATOM      0  HG3 PRO A  78      10.426 -13.653 -17.953  1.00 53.54           H   new
ATOM      0  HD2 PRO A  78       8.261 -13.091 -19.488  1.00 42.14           H   new
ATOM      0  HD3 PRO A  78       8.318 -12.629 -17.799  1.00 42.14           H   new
ATOM    885  N   HIS A  79      11.501  -8.981 -20.368  1.00 73.12           N
ATOM    886  CA  HIS A  79      12.185  -8.544 -21.573  1.00 32.11           C
ATOM    887  C   HIS A  79      13.462  -9.366 -21.738  1.00 21.35           C
ATOM    888  O   HIS A  79      14.087  -9.753 -20.751  1.00 15.34           O
ATOM    889  CB  HIS A  79      12.490  -7.044 -21.486  1.00 72.11           C
ATOM    890  CG  HIS A  79      12.750  -6.379 -22.807  1.00 33.43           C
ATOM    891  ND1 HIS A  79      13.897  -6.210 -23.503  1.00 22.41           N   flip
ATOM    892  CD2 HIS A  79      11.767  -5.751 -23.541  1.00 24.53           C   flip
ATOM    893  CE1 HIS A  79      13.594  -5.486 -24.629  1.00 24.14           C   flip
ATOM    894  NE2 HIS A  79      12.302  -5.225 -24.628  1.00 22.40           N   flip
ATOM      0  H   HIS A  79      11.616  -8.362 -19.566  1.00 73.12           H   new
ATOM      0  HA  HIS A  79      11.552  -8.701 -22.446  1.00 32.11           H   new
ATOM      0  HB2 HIS A  79      11.651  -6.544 -21.002  1.00 72.11           H   new
ATOM      0  HB3 HIS A  79      13.360  -6.900 -20.845  1.00 72.11           H   new
ATOM      0  HD2 HIS A  79      10.723  -5.697 -23.270  1.00 24.53           H   new
ATOM      0  HE1 HIS A  79      14.297  -5.181 -25.390  1.00 24.14           H   new
ATOM      0  HE2 HIS A  79      11.799  -4.704 -25.347  1.00 22.40           H   new
ATOM    903  N   ASP A  80      13.835  -9.651 -22.973  1.00 24.33           N
ATOM    904  CA  ASP A  80      14.970 -10.528 -23.238  1.00 15.41           C
ATOM    905  C   ASP A  80      16.274  -9.753 -23.168  1.00 13.01           C
ATOM    906  O   ASP A  80      17.190 -10.127 -22.434  1.00 71.11           O
ATOM    907  CB  ASP A  80      14.832 -11.201 -24.607  1.00 42.34           C
ATOM    908  CG  ASP A  80      13.579 -12.051 -24.718  1.00  4.53           C
ATOM    909  OD1 ASP A  80      13.595 -13.215 -24.262  1.00 63.42           O
ATOM    910  OD2 ASP A  80      12.573 -11.559 -25.275  1.00 63.22           O
ATOM      0  H   ASP A  80      13.373  -9.291 -23.808  1.00 24.33           H   new
ATOM      0  HA  ASP A  80      14.981 -11.302 -22.471  1.00 15.41           H   new
ATOM      0  HB2 ASP A  80      14.817 -10.436 -25.383  1.00 42.34           H   new
ATOM      0  HB3 ASP A  80      15.707 -11.825 -24.791  1.00 42.34           H   new
ATOM    915  N   PHE A  81      16.357  -8.674 -23.939  1.00 40.53           N
ATOM    916  CA  PHE A  81      17.526  -7.805 -23.918  1.00 11.44           C
ATOM    917  C   PHE A  81      17.723  -7.210 -22.525  1.00 42.25           C
ATOM    918  O   PHE A  81      18.845  -7.132 -22.019  1.00 14.33           O
ATOM    919  CB  PHE A  81      17.373  -6.694 -24.961  1.00 44.55           C
ATOM    920  CG  PHE A  81      18.574  -5.801 -25.085  1.00 40.03           C
ATOM    921  CD1 PHE A  81      19.685  -6.212 -25.803  1.00 44.11           C
ATOM    922  CD2 PHE A  81      18.589  -4.549 -24.491  1.00 43.01           C
ATOM    923  CE1 PHE A  81      20.789  -5.393 -25.927  1.00  1.03           C
ATOM    924  CE2 PHE A  81      19.691  -3.726 -24.610  1.00  2.20           C
ATOM    925  CZ  PHE A  81      20.792  -4.148 -25.330  1.00 12.12           C
ATOM      0  H   PHE A  81      15.626  -8.381 -24.587  1.00 40.53           H   new
ATOM      0  HA  PHE A  81      18.408  -8.396 -24.165  1.00 11.44           H   new
ATOM      0  HB2 PHE A  81      17.168  -7.147 -25.931  1.00 44.55           H   new
ATOM      0  HB3 PHE A  81      16.506  -6.086 -24.704  1.00 44.55           H   new
ATOM      0  HD1 PHE A  81      19.687  -7.185 -26.271  1.00 44.11           H   new
ATOM      0  HD2 PHE A  81      17.730  -4.214 -23.929  1.00 43.01           H   new
ATOM      0  HE1 PHE A  81      21.649  -5.725 -26.490  1.00  1.03           H   new
ATOM      0  HE2 PHE A  81      19.692  -2.753 -24.141  1.00  2.20           H   new
ATOM      0  HZ  PHE A  81      21.654  -3.505 -25.426  1.00 12.12           H   new
ATOM    935  N   ASP A  82      16.622  -6.819 -21.898  1.00 34.52           N
ATOM    936  CA  ASP A  82      16.678  -6.243 -20.562  1.00 21.55           C
ATOM    937  C   ASP A  82      16.161  -7.229 -19.547  1.00 63.12           C
ATOM    938  O   ASP A  82      14.958  -7.448 -19.448  1.00 55.43           O
ATOM    939  CB  ASP A  82      15.833  -4.983 -20.436  1.00 14.40           C
ATOM    940  CG  ASP A  82      16.250  -3.870 -21.359  1.00 74.41           C
ATOM    941  OD1 ASP A  82      17.320  -3.278 -21.134  1.00  3.01           O
ATOM    942  OD2 ASP A  82      15.480  -3.559 -22.289  1.00 13.30           O
ATOM      0  H   ASP A  82      15.683  -6.890 -22.291  1.00 34.52           H   new
ATOM      0  HA  ASP A  82      17.724  -5.995 -20.382  1.00 21.55           H   new
ATOM      0  HB2 ASP A  82      14.792  -5.235 -20.635  1.00 14.40           H   new
ATOM      0  HB3 ASP A  82      15.883  -4.626 -19.407  1.00 14.40           H   new
ATOM    947  N   GLU A  83      17.060  -7.795 -18.775  1.00 61.43           N
ATOM    948  CA  GLU A  83      16.677  -8.748 -17.748  1.00 74.11           C
ATOM    949  C   GLU A  83      15.950  -8.038 -16.611  1.00 42.33           C
ATOM    950  O   GLU A  83      15.193  -8.652 -15.861  1.00 65.12           O
ATOM    951  CB  GLU A  83      17.908  -9.479 -17.221  1.00 53.01           C
ATOM    952  CG  GLU A  83      18.671 -10.225 -18.300  1.00 52.02           C
ATOM    953  CD  GLU A  83      19.829 -11.015 -17.741  1.00 65.21           C
ATOM    954  OE1 GLU A  83      20.920 -10.436 -17.571  1.00 64.24           O
ATOM    955  OE2 GLU A  83      19.650 -12.218 -17.461  1.00 34.53           O
ATOM      0  H   GLU A  83      18.062  -7.615 -18.835  1.00 61.43           H   new
ATOM      0  HA  GLU A  83      16.000  -9.481 -18.186  1.00 74.11           H   new
ATOM      0  HB2 GLU A  83      18.574  -8.759 -16.747  1.00 53.01           H   new
ATOM      0  HB3 GLU A  83      17.600 -10.185 -16.449  1.00 53.01           H   new
ATOM      0  HG2 GLU A  83      17.992 -10.900 -18.821  1.00 52.02           H   new
ATOM      0  HG3 GLU A  83      19.042  -9.513 -19.038  1.00 52.02           H   new
ATOM    962  N   CYS A  84      16.181  -6.740 -16.499  1.00 53.14           N
ATOM    963  CA  CYS A  84      15.557  -5.940 -15.459  1.00 63.23           C
ATOM    964  C   CYS A  84      14.191  -5.423 -15.904  1.00 60.24           C
ATOM    965  O   CYS A  84      13.418  -4.922 -15.089  1.00 21.43           O
ATOM    966  CB  CYS A  84      16.461  -4.763 -15.090  1.00 33.12           C
ATOM    967  SG  CYS A  84      18.116  -5.246 -14.545  1.00  0.01           S
ATOM      0  H   CYS A  84      16.799  -6.216 -17.119  1.00 53.14           H   new
ATOM      0  HA  CYS A  84      15.413  -6.576 -14.585  1.00 63.23           H   new
ATOM      0  HB2 CYS A  84      16.552  -4.104 -15.954  1.00 33.12           H   new
ATOM      0  HB3 CYS A  84      15.983  -4.186 -14.298  1.00 33.12           H   new
ATOM      0  HG  CYS A  84      18.806  -4.182 -14.258  1.00  0.01           H   new
ATOM    973  N   ARG A  85      13.889  -5.545 -17.192  1.00 41.32           N
ATOM    974  CA  ARG A  85      12.645  -5.006 -17.721  1.00  0.40           C
ATOM    975  C   ARG A  85      11.572  -6.086 -17.765  1.00  4.25           C
ATOM    976  O   ARG A  85      11.836  -7.226 -18.150  1.00 53.11           O
ATOM    977  CB  ARG A  85      12.849  -4.415 -19.118  1.00 31.52           C
ATOM    978  CG  ARG A  85      11.681  -3.561 -19.582  1.00 71.24           C
ATOM    979  CD  ARG A  85      11.769  -3.205 -21.060  1.00 63.23           C
ATOM    980  NE  ARG A  85      13.024  -2.538 -21.422  1.00 14.10           N
ATOM    981  CZ  ARG A  85      13.143  -1.223 -21.622  1.00 43.01           C
ATOM    982  NH1 ARG A  85      12.123  -0.407 -21.370  1.00 23.54           N
ATOM    983  NH2 ARG A  85      14.295  -0.729 -22.059  1.00  0.12           N
ATOM      0  H   ARG A  85      14.482  -6.007 -17.881  1.00 41.32           H   new
ATOM      0  HA  ARG A  85      12.318  -4.207 -17.055  1.00  0.40           H   new
ATOM      0  HB2 ARG A  85      13.756  -3.811 -19.121  1.00 31.52           H   new
ATOM      0  HB3 ARG A  85      13.003  -5.226 -19.830  1.00 31.52           H   new
ATOM      0  HG2 ARG A  85      10.749  -4.094 -19.395  1.00 71.24           H   new
ATOM      0  HG3 ARG A  85      11.648  -2.645 -18.992  1.00 71.24           H   new
ATOM      0  HD2 ARG A  85      11.665  -4.114 -21.652  1.00 63.23           H   new
ATOM      0  HD3 ARG A  85      10.933  -2.557 -21.321  1.00 63.23           H   new
ATOM      0  HE  ARG A  85      13.859  -3.115 -21.528  1.00 14.10           H   new
ATOM      0 HH11 ARG A  85      11.242  -0.785 -21.021  1.00 23.54           H   new
ATOM      0 HH12 ARG A  85      12.222   0.596 -21.525  1.00 23.54           H   new
ATOM      0 HH21 ARG A  85      15.082  -1.353 -22.240  1.00  0.12           H   new
ATOM      0 HH22 ARG A  85      14.394   0.274 -22.214  1.00  0.12           H   new
ATOM    997  N   PHE A  86      10.363  -5.715 -17.382  1.00 32.50           N
ATOM    998  CA  PHE A  86       9.255  -6.653 -17.309  1.00  2.31           C
ATOM    999  C   PHE A  86       8.001  -6.038 -17.918  1.00 61.54           C
ATOM   1000  O   PHE A  86       7.516  -5.004 -17.461  1.00  0.20           O
ATOM   1001  CB  PHE A  86       8.993  -7.064 -15.856  1.00  4.24           C
ATOM   1002  CG  PHE A  86      10.097  -7.885 -15.249  1.00 14.01           C
ATOM   1003  CD1 PHE A  86      10.127  -9.259 -15.418  1.00 11.23           C
ATOM   1004  CD2 PHE A  86      11.103  -7.283 -14.511  1.00 61.53           C
ATOM   1005  CE1 PHE A  86      11.141 -10.018 -14.863  1.00 41.41           C
ATOM   1006  CE2 PHE A  86      12.119  -8.036 -13.954  1.00 12.40           C
ATOM   1007  CZ  PHE A  86      12.137  -9.406 -14.130  1.00 14.10           C
ATOM      0  H   PHE A  86      10.122  -4.761 -17.114  1.00 32.50           H   new
ATOM      0  HA  PHE A  86       9.520  -7.544 -17.878  1.00  2.31           H   new
ATOM      0  HB2 PHE A  86       8.848  -6.166 -15.255  1.00  4.24           H   new
ATOM      0  HB3 PHE A  86       8.064  -7.632 -15.811  1.00  4.24           H   new
ATOM      0  HD1 PHE A  86       9.349  -9.744 -15.990  1.00 11.23           H   new
ATOM      0  HD2 PHE A  86      11.093  -6.212 -14.369  1.00 61.53           H   new
ATOM      0  HE1 PHE A  86      11.153 -11.089 -15.003  1.00 41.41           H   new
ATOM      0  HE2 PHE A  86      12.898  -7.554 -13.382  1.00 12.40           H   new
ATOM      0  HZ  PHE A  86      12.929  -9.997 -13.695  1.00 14.10           H   new
ATOM   1017  N   ASP A  87       7.499  -6.678 -18.957  1.00 34.11           N
ATOM   1018  CA  ASP A  87       6.319  -6.212 -19.665  1.00 11.02           C
ATOM   1019  C   ASP A  87       5.072  -6.811 -19.036  1.00 12.53           C
ATOM   1020  O   ASP A  87       4.903  -8.027 -18.996  1.00 25.51           O
ATOM   1021  CB  ASP A  87       6.416  -6.615 -21.130  1.00  1.00           C
ATOM   1022  CG  ASP A  87       5.283  -6.095 -21.982  1.00 64.45           C
ATOM   1023  OD1 ASP A  87       4.238  -6.774 -22.078  1.00 44.44           O
ATOM   1024  OD2 ASP A  87       5.459  -5.029 -22.604  1.00 34.21           O
ATOM      0  H   ASP A  87       7.898  -7.537 -19.335  1.00 34.11           H   new
ATOM      0  HA  ASP A  87       6.258  -5.126 -19.597  1.00 11.02           H   new
ATOM      0  HB2 ASP A  87       7.360  -6.251 -21.536  1.00  1.00           H   new
ATOM      0  HB3 ASP A  87       6.439  -7.703 -21.197  1.00  1.00           H   new
ATOM   1029  N   ILE A  88       4.218  -5.955 -18.530  1.00 14.24           N
ATOM   1030  CA  ILE A  88       3.023  -6.393 -17.822  1.00  1.42           C
ATOM   1031  C   ILE A  88       1.799  -6.251 -18.709  1.00 52.33           C
ATOM   1032  O   ILE A  88       1.314  -5.146 -18.930  1.00 22.21           O
ATOM   1033  CB  ILE A  88       2.781  -5.580 -16.532  1.00  4.10           C
ATOM   1034  CG1 ILE A  88       4.055  -5.510 -15.683  1.00 54.13           C
ATOM   1035  CG2 ILE A  88       1.633  -6.194 -15.741  1.00 33.24           C
ATOM   1036  CD1 ILE A  88       4.663  -6.862 -15.401  1.00 21.24           C
ATOM      0  H   ILE A  88       4.323  -4.942 -18.592  1.00 14.24           H   new
ATOM      0  HA  ILE A  88       3.185  -7.438 -17.556  1.00  1.42           H   new
ATOM      0  HB  ILE A  88       2.511  -4.560 -16.806  1.00  4.10           H   new
ATOM      0 HG12 ILE A  88       4.790  -4.889 -16.195  1.00 54.13           H   new
ATOM      0 HG13 ILE A  88       3.826  -5.019 -14.737  1.00 54.13           H   new
ATOM      0 HG21 ILE A  88       1.467  -5.616 -14.832  1.00 33.24           H   new
ATOM      0 HG22 ILE A  88       0.727  -6.184 -16.347  1.00 33.24           H   new
ATOM      0 HG23 ILE A  88       1.882  -7.222 -15.477  1.00 33.24           H   new
ATOM      0 HD11 ILE A  88       5.561  -6.738 -14.796  1.00 21.24           H   new
ATOM      0 HD12 ILE A  88       3.944  -7.479 -14.862  1.00 21.24           H   new
ATOM      0 HD13 ILE A  88       4.923  -7.347 -16.342  1.00 21.24           H   new
ATOM   1048  N   SER A  89       1.294  -7.356 -19.213  1.00  2.31           N
ATOM   1049  CA  SER A  89       0.153  -7.302 -20.103  1.00 44.53           C
ATOM   1050  C   SER A  89      -1.094  -7.870 -19.431  1.00 74.11           C
ATOM   1051  O   SER A  89      -1.088  -8.984 -18.908  1.00 40.34           O
ATOM   1052  CB  SER A  89       0.479  -8.034 -21.401  1.00 20.40           C
ATOM   1053  OG  SER A  89       0.980  -9.336 -21.150  1.00 33.55           O
ATOM      0  H   SER A  89       1.650  -8.293 -19.025  1.00  2.31           H   new
ATOM      0  HA  SER A  89      -0.063  -6.261 -20.342  1.00 44.53           H   new
ATOM      0  HB2 SER A  89      -0.417  -8.100 -22.018  1.00 20.40           H   new
ATOM      0  HB3 SER A  89       1.214  -7.463 -21.968  1.00 20.40           H   new
ATOM      0  HG  SER A  89       1.178  -9.780 -22.001  1.00 33.55           H   new
ATOM   1059  N   VAL A  90      -2.158  -7.079 -19.429  1.00 51.13           N
ATOM   1060  CA  VAL A  90      -3.397  -7.456 -18.766  1.00  2.12           C
ATOM   1061  C   VAL A  90      -4.606  -6.882 -19.511  1.00 43.02           C
ATOM   1062  O   VAL A  90      -4.770  -5.662 -19.607  1.00 72.43           O
ATOM   1063  CB  VAL A  90      -3.389  -6.979 -17.296  1.00  4.33           C
ATOM   1064  CG1 VAL A  90      -3.101  -5.494 -17.213  1.00 23.43           C
ATOM   1065  CG2 VAL A  90      -4.694  -7.313 -16.594  1.00 65.31           C
ATOM      0  H   VAL A  90      -2.187  -6.166 -19.883  1.00 51.13           H   new
ATOM      0  HA  VAL A  90      -3.475  -8.543 -18.776  1.00  2.12           H   new
ATOM      0  HB  VAL A  90      -2.591  -7.514 -16.782  1.00  4.33           H   new
ATOM      0 HG11 VAL A  90      -3.100  -5.181 -16.169  1.00 23.43           H   new
ATOM      0 HG12 VAL A  90      -2.126  -5.287 -17.654  1.00 23.43           H   new
ATOM      0 HG13 VAL A  90      -3.869  -4.943 -17.756  1.00 23.43           H   new
ATOM      0 HG21 VAL A  90      -4.652  -6.963 -15.563  1.00 65.31           H   new
ATOM      0 HG22 VAL A  90      -5.520  -6.824 -17.110  1.00 65.31           H   new
ATOM      0 HG23 VAL A  90      -4.847  -8.392 -16.605  1.00 65.31           H   new
ATOM   1075  N   ASN A  91      -5.440  -7.779 -20.036  1.00 44.31           N
ATOM   1076  CA  ASN A  91      -6.600  -7.418 -20.871  1.00 24.51           C
ATOM   1077  C   ASN A  91      -6.152  -6.740 -22.161  1.00 31.10           C
ATOM   1078  O   ASN A  91      -6.141  -7.344 -23.233  1.00  0.23           O
ATOM   1079  CB  ASN A  91      -7.580  -6.477 -20.147  1.00 21.14           C
ATOM   1080  CG  ASN A  91      -8.166  -7.051 -18.874  1.00 51.33           C
ATOM   1081  OD1 ASN A  91      -7.593  -6.678 -17.743  1.00 61.12           O   flip
ATOM   1082  ND2 ASN A  91      -9.147  -7.793 -18.905  1.00  5.50           N   flip
ATOM      0  H   ASN A  91      -5.335  -8.784 -19.897  1.00 44.31           H   new
ATOM      0  HA  ASN A  91      -7.113  -8.354 -21.091  1.00 24.51           H   new
ATOM      0  HB2 ASN A  91      -7.064  -5.547 -19.909  1.00 21.14           H   new
ATOM      0  HB3 ASN A  91      -8.394  -6.225 -20.827  1.00 21.14           H   new
ATOM      0 HD21 ASN A  91      -9.559  -8.057 -19.800  1.00  5.50           H   new
ATOM      0 HD22 ASN A  91      -9.548  -8.144 -18.036  1.00  5.50           H   new
ATOM   1089  N   ASP A  92      -5.766  -5.483 -22.025  1.00 25.31           N
ATOM   1090  CA  ASP A  92      -5.363  -4.649 -23.146  1.00 24.20           C
ATOM   1091  C   ASP A  92      -4.118  -3.853 -22.778  1.00  0.30           C
ATOM   1092  O   ASP A  92      -3.290  -3.533 -23.633  1.00 72.25           O
ATOM   1093  CB  ASP A  92      -6.504  -3.690 -23.506  1.00 25.40           C
ATOM   1094  CG  ASP A  92      -6.113  -2.648 -24.536  1.00 32.33           C
ATOM   1095  OD1 ASP A  92      -5.595  -1.580 -24.142  1.00 53.25           O
ATOM   1096  OD2 ASP A  92      -6.352  -2.879 -25.741  1.00  1.20           O
ATOM      0  H   ASP A  92      -5.723  -5.007 -21.124  1.00 25.31           H   new
ATOM      0  HA  ASP A  92      -5.138  -5.283 -24.004  1.00 24.20           H   new
ATOM      0  HB2 ASP A  92      -7.347  -4.267 -23.886  1.00 25.40           H   new
ATOM      0  HB3 ASP A  92      -6.844  -3.186 -22.601  1.00 25.40           H   new
ATOM   1101  N   SER A  93      -3.976  -3.577 -21.488  1.00 12.54           N
ATOM   1102  CA  SER A  93      -2.933  -2.699 -20.998  1.00 35.43           C
ATOM   1103  C   SER A  93      -1.586  -3.399 -21.010  1.00 24.35           C
ATOM   1104  O   SER A  93      -1.473  -4.556 -20.601  1.00 42.11           O
ATOM   1105  CB  SER A  93      -3.269  -2.246 -19.582  1.00  0.30           C
ATOM   1106  OG  SER A  93      -4.556  -1.651 -19.530  1.00  2.02           O
ATOM      0  H   SER A  93      -4.580  -3.956 -20.759  1.00 12.54           H   new
ATOM      0  HA  SER A  93      -2.873  -1.831 -21.655  1.00 35.43           H   new
ATOM      0  HB2 SER A  93      -3.231  -3.099 -18.905  1.00  0.30           H   new
ATOM      0  HB3 SER A  93      -2.520  -1.533 -19.237  1.00  0.30           H   new
ATOM      0  HG  SER A  93      -4.750  -1.370 -18.611  1.00  2.02           H   new
ATOM   1112  N   VAL A  94      -0.579  -2.691 -21.492  1.00 32.55           N
ATOM   1113  CA  VAL A  94       0.774  -3.209 -21.543  1.00 64.24           C
ATOM   1114  C   VAL A  94       1.713  -2.271 -20.800  1.00 52.11           C
ATOM   1115  O   VAL A  94       1.877  -1.109 -21.174  1.00 52.02           O
ATOM   1116  CB  VAL A  94       1.252  -3.374 -23.000  1.00 52.43           C
ATOM   1117  CG1 VAL A  94       2.675  -3.898 -23.045  1.00 44.44           C
ATOM   1118  CG2 VAL A  94       0.321  -4.296 -23.771  1.00 44.43           C
ATOM      0  H   VAL A  94      -0.677  -1.744 -21.858  1.00 32.55           H   new
ATOM      0  HA  VAL A  94       0.781  -4.189 -21.067  1.00 64.24           H   new
ATOM      0  HB  VAL A  94       1.234  -2.393 -23.474  1.00 52.43           H   new
ATOM      0 HG11 VAL A  94       2.990  -4.006 -24.083  1.00 44.44           H   new
ATOM      0 HG12 VAL A  94       3.337  -3.197 -22.536  1.00 44.44           H   new
ATOM      0 HG13 VAL A  94       2.722  -4.867 -22.549  1.00 44.44           H   new
ATOM      0 HG21 VAL A  94       0.677  -4.398 -24.796  1.00 44.43           H   new
ATOM      0 HG22 VAL A  94       0.302  -5.276 -23.294  1.00 44.43           H   new
ATOM      0 HG23 VAL A  94      -0.685  -3.876 -23.776  1.00 44.43           H   new
ATOM   1128  N   TRP A  95       2.316  -2.777 -19.740  1.00 51.45           N
ATOM   1129  CA  TRP A  95       3.160  -1.961 -18.886  1.00 12.00           C
ATOM   1130  C   TRP A  95       4.618  -2.354 -19.040  1.00 61.22           C
ATOM   1131  O   TRP A  95       5.054  -3.365 -18.499  1.00 60.41           O
ATOM   1132  CB  TRP A  95       2.744  -2.107 -17.420  1.00 72.43           C
ATOM   1133  CG  TRP A  95       1.406  -1.508 -17.096  1.00 51.23           C
ATOM   1134  CD1 TRP A  95       0.210  -1.771 -17.703  1.00 32.42           C
ATOM   1135  CD2 TRP A  95       1.127  -0.557 -16.063  1.00 63.23           C
ATOM   1136  NE1 TRP A  95      -0.788  -1.032 -17.117  1.00 72.44           N
ATOM   1137  CE2 TRP A  95      -0.252  -0.285 -16.106  1.00  3.54           C
ATOM   1138  CE3 TRP A  95       1.910   0.092 -15.105  1.00  1.34           C
ATOM   1139  CZ2 TRP A  95      -0.865   0.605 -15.230  1.00 23.13           C
ATOM   1140  CZ3 TRP A  95       1.300   0.975 -14.235  1.00 45.35           C
ATOM   1141  CH2 TRP A  95      -0.076   1.222 -14.303  1.00 51.02           C
ATOM      0  H   TRP A  95       2.237  -3.751 -19.449  1.00 51.45           H   new
ATOM      0  HA  TRP A  95       3.038  -0.921 -19.190  1.00 12.00           H   new
ATOM      0  HB2 TRP A  95       2.727  -3.166 -17.163  1.00 72.43           H   new
ATOM      0  HB3 TRP A  95       3.501  -1.638 -16.791  1.00 72.43           H   new
ATOM      0  HD1 TRP A  95       0.070  -2.459 -18.523  1.00 32.42           H   new
ATOM      0  HE1 TRP A  95      -1.770  -1.039 -17.392  1.00 72.44           H   new
ATOM      0  HE3 TRP A  95       2.972  -0.093 -15.046  1.00  1.34           H   new
ATOM      0  HZ2 TRP A  95      -1.926   0.800 -15.282  1.00 23.13           H   new
ATOM      0  HZ3 TRP A  95       1.895   1.483 -13.490  1.00 45.35           H   new
ATOM      0  HH2 TRP A  95      -0.523   1.916 -13.607  1.00 51.02           H   new
ATOM   1152  N   TYR A  96       5.366  -1.563 -19.792  1.00 55.04           N
ATOM   1153  CA  TYR A  96       6.795  -1.796 -19.936  1.00 12.23           C
ATOM   1154  C   TYR A  96       7.510  -1.333 -18.672  1.00 64.32           C
ATOM   1155  O   TYR A  96       8.056  -0.231 -18.624  1.00 12.43           O
ATOM   1156  CB  TYR A  96       7.358  -1.051 -21.151  1.00 51.51           C
ATOM   1157  CG  TYR A  96       6.584  -1.267 -22.435  1.00 24.54           C
ATOM   1158  CD1 TYR A  96       5.496  -0.464 -22.749  1.00 21.40           C
ATOM   1159  CD2 TYR A  96       6.951  -2.257 -23.339  1.00 74.34           C
ATOM   1160  CE1 TYR A  96       4.793  -0.640 -23.923  1.00 51.04           C
ATOM   1161  CE2 TYR A  96       6.248  -2.440 -24.518  1.00 22.12           C
ATOM   1162  CZ  TYR A  96       5.170  -1.628 -24.803  1.00 23.12           C
ATOM   1163  OH  TYR A  96       4.471  -1.797 -25.977  1.00  3.20           O
ATOM      0  H   TYR A  96       5.011  -0.759 -20.309  1.00 55.04           H   new
ATOM      0  HA  TYR A  96       6.959  -2.863 -20.088  1.00 12.23           H   new
ATOM      0  HB2 TYR A  96       7.379   0.016 -20.929  1.00 51.51           H   new
ATOM      0  HB3 TYR A  96       8.390  -1.364 -21.307  1.00 51.51           H   new
ATOM      0  HD1 TYR A  96       5.194   0.313 -22.062  1.00 21.40           H   new
ATOM      0  HD2 TYR A  96       7.796  -2.892 -23.119  1.00 74.34           H   new
ATOM      0  HE1 TYR A  96       3.950  -0.005 -24.150  1.00 51.04           H   new
ATOM      0  HE2 TYR A  96       6.542  -3.215 -25.211  1.00 22.12           H   new
ATOM      0  HH  TYR A  96       4.864  -2.535 -26.488  1.00  3.20           H   new
ATOM   1173  N   LEU A  97       7.476  -2.165 -17.645  1.00  0.40           N
ATOM   1174  CA  LEU A  97       7.999  -1.800 -16.341  1.00  1.00           C
ATOM   1175  C   LEU A  97       9.443  -2.264 -16.218  1.00 25.33           C
ATOM   1176  O   LEU A  97       9.932  -3.009 -17.066  1.00 42.34           O
ATOM   1177  CB  LEU A  97       7.130  -2.430 -15.248  1.00 44.14           C
ATOM   1178  CG  LEU A  97       7.396  -1.946 -13.822  1.00 12.42           C
ATOM   1179  CD1 LEU A  97       7.179  -0.444 -13.713  1.00 32.51           C
ATOM   1180  CD2 LEU A  97       6.500  -2.683 -12.840  1.00 54.02           C
ATOM      0  H   LEU A  97       7.087  -3.107 -17.691  1.00  0.40           H   new
ATOM      0  HA  LEU A  97       7.975  -0.717 -16.225  1.00  1.00           H   new
ATOM      0  HB2 LEU A  97       6.084  -2.238 -15.487  1.00 44.14           H   new
ATOM      0  HB3 LEU A  97       7.271  -3.510 -15.277  1.00 44.14           H   new
ATOM      0  HG  LEU A  97       8.436  -2.159 -13.575  1.00 12.42           H   new
ATOM      0 HD11 LEU A  97       7.374  -0.122 -12.690  1.00 32.51           H   new
ATOM      0 HD12 LEU A  97       7.858   0.072 -14.392  1.00 32.51           H   new
ATOM      0 HD13 LEU A  97       6.149  -0.205 -13.979  1.00 32.51           H   new
ATOM      0 HD21 LEU A  97       6.700  -2.329 -11.829  1.00 54.02           H   new
ATOM      0 HD22 LEU A  97       5.456  -2.497 -13.090  1.00 54.02           H   new
ATOM      0 HD23 LEU A  97       6.701  -3.753 -12.896  1.00 54.02           H   new
ATOM   1192  N   ARG A  98      10.132  -1.825 -15.179  1.00 21.10           N
ATOM   1193  CA  ARG A  98      11.521  -2.204 -14.996  1.00 55.25           C
ATOM   1194  C   ARG A  98      11.891  -2.172 -13.523  1.00 43.24           C
ATOM   1195  O   ARG A  98      11.417  -1.321 -12.767  1.00 54.54           O
ATOM   1196  CB  ARG A  98      12.446  -1.268 -15.783  1.00 11.32           C
ATOM   1197  CG  ARG A  98      13.735  -1.937 -16.231  1.00 52.44           C
ATOM   1198  CD  ARG A  98      14.764  -0.930 -16.721  1.00  3.50           C
ATOM   1199  NE  ARG A  98      15.342  -0.160 -15.622  1.00 42.43           N
ATOM   1200  CZ  ARG A  98      16.652   0.040 -15.464  1.00 33.15           C
ATOM   1201  NH1 ARG A  98      17.517  -0.502 -16.317  1.00  1.20           N
ATOM   1202  NH2 ARG A  98      17.096   0.775 -14.448  1.00 32.23           N
ATOM      0  H   ARG A  98       9.756  -1.212 -14.456  1.00 21.10           H   new
ATOM      0  HA  ARG A  98      11.646  -3.219 -15.372  1.00 55.25           H   new
ATOM      0  HB2 ARG A  98      11.915  -0.895 -16.659  1.00 11.32           H   new
ATOM      0  HB3 ARG A  98      12.689  -0.404 -15.165  1.00 11.32           H   new
ATOM      0  HG2 ARG A  98      14.154  -2.508 -15.402  1.00 52.44           H   new
ATOM      0  HG3 ARG A  98      13.516  -2.647 -17.028  1.00 52.44           H   new
ATOM      0  HD2 ARG A  98      15.558  -1.453 -17.254  1.00  3.50           H   new
ATOM      0  HD3 ARG A  98      14.296  -0.250 -17.433  1.00  3.50           H   new
ATOM      0  HE  ARG A  98      14.707   0.248 -14.936  1.00 42.43           H   new
ATOM      0 HH11 ARG A  98      17.179  -1.071 -17.093  1.00  1.20           H   new
ATOM      0 HH12 ARG A  98      18.518  -0.348 -16.195  1.00  1.20           H   new
ATOM      0 HH21 ARG A  98      16.435   1.186 -13.789  1.00 32.23           H   new
ATOM      0 HH22 ARG A  98      18.097   0.927 -14.328  1.00 32.23           H   new
ATOM   1216  N   ALA A  99      12.730  -3.112 -13.121  1.00 61.51           N
ATOM   1217  CA  ALA A  99      13.240  -3.148 -11.767  1.00 45.52           C
ATOM   1218  C   ALA A  99      14.331  -2.104 -11.591  1.00 22.12           C
ATOM   1219  O   ALA A  99      14.788  -1.500 -12.564  1.00 14.33           O
ATOM   1220  CB  ALA A  99      13.770  -4.533 -11.434  1.00  1.21           C
ATOM      0  H   ALA A  99      13.072  -3.863 -13.720  1.00 61.51           H   new
ATOM      0  HA  ALA A  99      12.424  -2.920 -11.081  1.00 45.52           H   new
ATOM      0  HB1 ALA A  99      14.149  -4.541 -10.412  1.00  1.21           H   new
ATOM      0  HB2 ALA A  99      12.966  -5.263 -11.529  1.00  1.21           H   new
ATOM      0  HB3 ALA A  99      14.575  -4.790 -12.122  1.00  1.21           H   new
ATOM   1226  N   GLN A 100      14.744  -1.896 -10.354  1.00 34.22           N
ATOM   1227  CA  GLN A 100      15.758  -0.901 -10.049  1.00 73.52           C
ATOM   1228  C   GLN A 100      17.119  -1.561  -9.846  1.00 43.21           C
ATOM   1229  O   GLN A 100      18.161  -0.930 -10.020  1.00 22.11           O
ATOM   1230  CB  GLN A 100      15.341  -0.106  -8.810  1.00 12.44           C
ATOM   1231  CG  GLN A 100      15.155  -0.957  -7.563  1.00 63.53           C
ATOM   1232  CD  GLN A 100      14.425  -0.216  -6.461  1.00 41.45           C
ATOM   1233  OE1 GLN A 100      15.037   0.494  -5.665  1.00 13.14           O
ATOM   1234  NE2 GLN A 100      13.114  -0.396  -6.392  1.00 33.43           N
ATOM      0  H   GLN A 100      14.392  -2.404  -9.542  1.00 34.22           H   new
ATOM      0  HA  GLN A 100      15.848  -0.215 -10.891  1.00 73.52           H   new
ATOM      0  HB2 GLN A 100      16.095   0.655  -8.609  1.00 12.44           H   new
ATOM      0  HB3 GLN A 100      14.409   0.417  -9.023  1.00 12.44           H   new
ATOM      0  HG2 GLN A 100      14.599  -1.858  -7.821  1.00 63.53           H   new
ATOM      0  HG3 GLN A 100      16.130  -1.278  -7.197  1.00 63.53           H   new
ATOM      0 HE21 GLN A 100      12.645  -0.993  -7.073  1.00 33.43           H   new
ATOM      0 HE22 GLN A 100      12.574   0.063  -5.658  1.00 33.43           H   new
ATOM   1299  N   ARG A 105      14.940  -8.108  -8.584  1.00 60.31           N
ATOM   1300  CA  ARG A 105      13.857  -7.858  -9.528  1.00 62.54           C
ATOM   1301  C   ARG A 105      12.601  -8.513  -8.978  1.00 54.13           C
ATOM   1302  O   ARG A 105      11.463  -8.172  -9.338  1.00  3.02           O
ATOM   1303  CB  ARG A 105      14.213  -8.434 -10.901  1.00 54.44           C
ATOM   1304  CG  ARG A 105      15.352  -7.700 -11.587  1.00 43.22           C
ATOM   1305  CD  ARG A 105      15.853  -8.450 -12.807  1.00 24.40           C
ATOM   1306  NE  ARG A 105      16.648  -9.622 -12.440  1.00 32.20           N
ATOM   1307  CZ  ARG A 105      16.883 -10.647 -13.256  1.00 12.32           C
ATOM   1308  NH1 ARG A 105      16.337 -10.683 -14.463  1.00  1.42           N
ATOM   1309  NH2 ARG A 105      17.659 -11.643 -12.857  1.00 13.34           N
ATOM      0  HA  ARG A 105      13.694  -6.787  -9.651  1.00 62.54           H   new
ATOM      0  HB2 ARG A 105      14.484  -9.484 -10.787  1.00 54.44           H   new
ATOM      0  HB3 ARG A 105      13.331  -8.400 -11.541  1.00 54.44           H   new
ATOM      0  HG2 ARG A 105      15.017  -6.706 -11.884  1.00 43.22           H   new
ATOM      0  HG3 ARG A 105      16.172  -7.563 -10.883  1.00 43.22           H   new
ATOM      0  HD2 ARG A 105      15.004  -8.763 -13.414  1.00 24.40           H   new
ATOM      0  HD3 ARG A 105      16.455  -7.781 -13.422  1.00 24.40           H   new
ATOM      0  HE  ARG A 105      17.046  -9.656 -11.502  1.00 32.20           H   new
ATOM      0 HH11 ARG A 105      15.732  -9.922 -14.772  1.00  1.42           H   new
ATOM      0 HH12 ARG A 105      16.522 -11.472 -15.083  1.00  1.42           H   new
ATOM      0 HH21 ARG A 105      18.075 -11.624 -11.926  1.00 13.34           H   new
ATOM      0 HH22 ARG A 105      17.840 -12.429 -13.481  1.00 13.34           H   new
ATOM   1323  N   GLN A 106      12.852  -9.433  -8.046  1.00 14.40           N
ATOM   1324  CA  GLN A 106      11.819 -10.151  -7.316  1.00  1.32           C
ATOM   1325  C   GLN A 106      10.868  -9.205  -6.587  1.00 40.43           C
ATOM   1326  O   GLN A 106       9.936  -9.658  -5.939  1.00 53.03           O
ATOM   1327  CB  GLN A 106      12.461 -11.095  -6.302  1.00 32.20           C
ATOM   1328  CG  GLN A 106      13.295 -10.369  -5.260  1.00  0.23           C
ATOM   1329  CD  GLN A 106      13.768 -11.281  -4.149  1.00 75.41           C
ATOM   1330  OE1 GLN A 106      13.997 -12.469  -4.359  1.00 55.13           O
ATOM   1331  NE2 GLN A 106      13.910 -10.732  -2.955  1.00 22.22           N
ATOM      0  H   GLN A 106      13.798  -9.701  -7.776  1.00 14.40           H   new
ATOM      0  HA  GLN A 106      11.239 -10.716  -8.046  1.00  1.32           H   new
ATOM      0  HB2 GLN A 106      11.680 -11.666  -5.800  1.00 32.20           H   new
ATOM      0  HB3 GLN A 106      13.091 -11.811  -6.829  1.00 32.20           H   new
ATOM      0  HG2 GLN A 106      14.160  -9.916  -5.745  1.00  0.23           H   new
ATOM      0  HG3 GLN A 106      12.707  -9.557  -4.832  1.00  0.23           H   new
ATOM      0 HE21 GLN A 106      13.709  -9.741  -2.822  1.00 22.22           H   new
ATOM      0 HE22 GLN A 106      14.220 -11.300  -2.166  1.00 22.22           H   new
ATOM   1340  N   GLN A 107      11.136  -7.901  -6.656  1.00 20.11           N
ATOM   1341  CA  GLN A 107      10.166  -6.902  -6.228  1.00 73.14           C
ATOM   1342  C   GLN A 107       8.805  -7.273  -6.792  1.00  4.03           C
ATOM   1343  O   GLN A 107       7.831  -7.443  -6.055  1.00 32.53           O
ATOM   1344  CB  GLN A 107      10.559  -5.503  -6.733  1.00 72.23           C
ATOM   1345  CG  GLN A 107      11.854  -4.967  -6.150  1.00 20.22           C
ATOM   1346  CD  GLN A 107      11.703  -4.492  -4.719  1.00 71.31           C
ATOM   1347  OE1 GLN A 107      11.407  -3.322  -4.472  1.00 33.45           O
ATOM   1348  NE2 GLN A 107      11.894  -5.390  -3.768  1.00 41.24           N
ATOM      0  H   GLN A 107      12.014  -7.516  -7.003  1.00 20.11           H   new
ATOM      0  HA  GLN A 107      10.138  -6.879  -5.139  1.00 73.14           H   new
ATOM      0  HB2 GLN A 107      10.649  -5.534  -7.819  1.00 72.23           H   new
ATOM      0  HB3 GLN A 107       9.754  -4.806  -6.500  1.00 72.23           H   new
ATOM      0  HG2 GLN A 107      12.615  -5.746  -6.191  1.00 20.22           H   new
ATOM      0  HG3 GLN A 107      12.210  -4.141  -6.766  1.00 20.22           H   new
ATOM      0 HE21 GLN A 107      12.138  -6.349  -4.014  1.00 41.24           H   new
ATOM      0 HE22 GLN A 107      11.797  -5.124  -2.788  1.00 41.24           H   new
ATOM   1357  N   TRP A 108       8.778  -7.483  -8.103  1.00 62.11           N
ATOM   1358  CA  TRP A 108       7.536  -7.764  -8.802  1.00 22.44           C
ATOM   1359  C   TRP A 108       7.049  -9.157  -8.452  1.00 12.53           C
ATOM   1360  O   TRP A 108       5.906  -9.343  -8.049  1.00 24.33           O
ATOM   1361  CB  TRP A 108       7.739  -7.642 -10.315  1.00 31.20           C
ATOM   1362  CG  TRP A 108       8.551  -6.442 -10.694  1.00 72.24           C
ATOM   1363  CD1 TRP A 108       9.636  -6.413 -11.520  1.00  2.23           C
ATOM   1364  CD2 TRP A 108       8.358  -5.103 -10.236  1.00 11.04           C
ATOM   1365  NE1 TRP A 108      10.133  -5.135 -11.600  1.00 41.55           N
ATOM   1366  CE2 TRP A 108       9.363  -4.313 -10.820  1.00 14.30           C
ATOM   1367  CE3 TRP A 108       7.428  -4.496  -9.386  1.00 23.10           C
ATOM   1368  CZ2 TRP A 108       9.465  -2.946 -10.580  1.00  0.04           C
ATOM   1369  CZ3 TRP A 108       7.531  -3.142  -9.151  1.00 34.52           C
ATOM   1370  CH2 TRP A 108       8.544  -2.382  -9.745  1.00 15.35           C
ATOM      0  H   TRP A 108       9.604  -7.463  -8.701  1.00 62.11           H   new
ATOM      0  HA  TRP A 108       6.785  -7.037  -8.491  1.00 22.44           H   new
ATOM      0  HB2 TRP A 108       8.232  -8.541 -10.685  1.00 31.20           H   new
ATOM      0  HB3 TRP A 108       6.767  -7.587 -10.805  1.00 31.20           H   new
ATOM      0  HD1 TRP A 108      10.045  -7.270 -12.036  1.00  2.23           H   new
ATOM      0  HE1 TRP A 108      10.942  -4.846 -12.150  1.00 41.55           H   new
ATOM      0  HE3 TRP A 108       6.644  -5.077  -8.923  1.00 23.10           H   new
ATOM      0  HZ2 TRP A 108      10.244  -2.354 -11.037  1.00  0.04           H   new
ATOM      0  HZ3 TRP A 108       6.818  -2.660  -8.498  1.00 34.52           H   new
ATOM      0  HH2 TRP A 108       8.599  -1.323  -9.538  1.00 15.35           H   new
ATOM   1381  N   ILE A 109       7.945 -10.123  -8.575  1.00 20.31           N
ATOM   1382  CA  ILE A 109       7.609 -11.519  -8.343  1.00 40.25           C
ATOM   1383  C   ILE A 109       7.041 -11.717  -6.939  1.00 40.14           C
ATOM   1384  O   ILE A 109       5.914 -12.172  -6.775  1.00 22.15           O
ATOM   1385  CB  ILE A 109       8.846 -12.430  -8.508  1.00 61.11           C
ATOM   1386  CG1 ILE A 109       9.646 -12.048  -9.761  1.00 34.53           C
ATOM   1387  CG2 ILE A 109       8.425 -13.892  -8.567  1.00  5.11           C
ATOM   1388  CD1 ILE A 109       8.863 -12.144 -11.053  1.00 61.43           C
ATOM      0  H   ILE A 109       8.918  -9.964  -8.836  1.00 20.31           H   new
ATOM      0  HA  ILE A 109       6.859 -11.792  -9.085  1.00 40.25           H   new
ATOM      0  HB  ILE A 109       9.491 -12.289  -7.640  1.00 61.11           H   new
ATOM      0 HG12 ILE A 109      10.013 -11.028  -9.647  1.00 34.53           H   new
ATOM      0 HG13 ILE A 109      10.520 -12.695  -9.831  1.00 34.53           H   new
ATOM      0 HG21 ILE A 109       9.308 -14.520  -8.683  1.00  5.11           H   new
ATOM      0 HG22 ILE A 109       7.908 -14.159  -7.645  1.00  5.11           H   new
ATOM      0 HG23 ILE A 109       7.757 -14.044  -9.415  1.00  5.11           H   new
ATOM      0 HD11 ILE A 109       9.502 -11.857 -11.888  1.00 61.43           H   new
ATOM      0 HD12 ILE A 109       8.519 -13.169 -11.195  1.00 61.43           H   new
ATOM      0 HD13 ILE A 109       8.003 -11.476 -11.008  1.00 61.43           H   new
ATOM   1400  N   ASP A 110       7.827 -11.340  -5.940  1.00  3.33           N
ATOM   1401  CA  ASP A 110       7.464 -11.535  -4.542  1.00 64.51           C
ATOM   1402  C   ASP A 110       6.219 -10.741  -4.175  1.00 34.50           C
ATOM   1403  O   ASP A 110       5.319 -11.270  -3.526  1.00  3.14           O
ATOM   1404  CB  ASP A 110       8.631 -11.142  -3.631  1.00 11.23           C
ATOM   1405  CG  ASP A 110       8.288 -11.201  -2.154  1.00 34.50           C
ATOM   1406  OD1 ASP A 110       8.201 -12.313  -1.598  1.00 51.31           O
ATOM   1407  OD2 ASP A 110       8.152 -10.129  -1.532  1.00  5.45           O
ATOM      0  H   ASP A 110       8.733 -10.891  -6.075  1.00  3.33           H   new
ATOM      0  HA  ASP A 110       7.241 -12.592  -4.399  1.00 64.51           H   new
ATOM      0  HB2 ASP A 110       9.475 -11.804  -3.827  1.00 11.23           H   new
ATOM      0  HB3 ASP A 110       8.954 -10.131  -3.882  1.00 11.23           H   new
ATOM   1412  N   ALA A 111       6.150  -9.478  -4.597  1.00 34.23           N
ATOM   1413  CA  ALA A 111       4.981  -8.662  -4.297  1.00 22.20           C
ATOM   1414  C   ALA A 111       3.716  -9.306  -4.860  1.00 15.34           C
ATOM   1415  O   ALA A 111       2.764  -9.600  -4.125  1.00 35.41           O
ATOM   1416  CB  ALA A 111       5.152  -7.258  -4.854  1.00 33.23           C
ATOM      0  H   ALA A 111       6.876  -9.008  -5.137  1.00 34.23           H   new
ATOM      0  HA  ALA A 111       4.881  -8.595  -3.214  1.00 22.20           H   new
ATOM      0  HB1 ALA A 111       4.269  -6.664  -4.620  1.00 33.23           H   new
ATOM      0  HB2 ALA A 111       6.031  -6.794  -4.407  1.00 33.23           H   new
ATOM      0  HB3 ALA A 111       5.279  -7.309  -5.935  1.00 33.23           H   new
ATOM   1422  N   ILE A 112       3.722  -9.557  -6.157  1.00  3.42           N
ATOM   1423  CA  ILE A 112       2.547 -10.075  -6.827  1.00 11.02           C
ATOM   1424  C   ILE A 112       2.210 -11.472  -6.340  1.00  5.03           C
ATOM   1425  O   ILE A 112       1.060 -11.749  -6.047  1.00 35.42           O
ATOM   1426  CB  ILE A 112       2.721 -10.085  -8.352  1.00 20.44           C
ATOM   1427  CG1 ILE A 112       3.092  -8.686  -8.849  1.00 34.22           C
ATOM   1428  CG2 ILE A 112       1.443 -10.563  -9.021  1.00 20.15           C
ATOM   1429  CD1 ILE A 112       3.672  -8.675 -10.246  1.00 52.21           C
ATOM      0  H   ILE A 112       4.528  -9.410  -6.765  1.00  3.42           H   new
ATOM      0  HA  ILE A 112       1.722  -9.406  -6.580  1.00 11.02           H   new
ATOM      0  HB  ILE A 112       3.527 -10.771  -8.611  1.00 20.44           H   new
ATOM      0 HG12 ILE A 112       2.204  -8.054  -8.828  1.00 34.22           H   new
ATOM      0 HG13 ILE A 112       3.813  -8.244  -8.161  1.00 34.22           H   new
ATOM      0 HG21 ILE A 112       1.578 -10.566 -10.103  1.00 20.15           H   new
ATOM      0 HG22 ILE A 112       1.210 -11.572  -8.681  1.00 20.15           H   new
ATOM      0 HG23 ILE A 112       0.623  -9.894  -8.759  1.00 20.15           H   new
ATOM      0 HD11 ILE A 112       3.912  -7.651 -10.532  1.00 52.21           H   new
ATOM      0 HD12 ILE A 112       4.579  -9.280 -10.268  1.00 52.21           H   new
ATOM      0 HD13 ILE A 112       2.944  -9.087 -10.945  1.00 52.21           H   new
ATOM   1441  N   GLU A 113       3.203 -12.343  -6.237  1.00 22.10           N
ATOM   1442  CA  GLU A 113       2.968 -13.693  -5.742  1.00 35.53           C
ATOM   1443  C   GLU A 113       2.379 -13.682  -4.339  1.00  1.44           C
ATOM   1444  O   GLU A 113       1.445 -14.417  -4.045  1.00  2.20           O
ATOM   1445  CB  GLU A 113       4.250 -14.521  -5.765  1.00  4.54           C
ATOM   1446  CG  GLU A 113       4.570 -15.092  -7.133  1.00 31.14           C
ATOM   1447  CD  GLU A 113       3.522 -16.092  -7.587  1.00 21.54           C
ATOM   1448  OE1 GLU A 113       2.352 -15.695  -7.774  1.00 43.14           O
ATOM   1449  OE2 GLU A 113       3.854 -17.283  -7.744  1.00 62.11           O
ATOM      0  H   GLU A 113       4.171 -12.143  -6.487  1.00 22.10           H   new
ATOM      0  HA  GLU A 113       2.243 -14.155  -6.412  1.00 35.53           H   new
ATOM      0  HB2 GLU A 113       5.082 -13.899  -5.435  1.00  4.54           H   new
ATOM      0  HB3 GLU A 113       4.159 -15.338  -5.050  1.00  4.54           H   new
ATOM      0  HG2 GLU A 113       4.637 -14.281  -7.858  1.00 31.14           H   new
ATOM      0  HG3 GLU A 113       5.546 -15.576  -7.105  1.00 31.14           H   new
ATOM   1456  N   GLN A 114       2.901 -12.838  -3.478  1.00 11.42           N
ATOM   1457  CA  GLN A 114       2.418 -12.789  -2.110  1.00 63.34           C
ATOM   1458  C   GLN A 114       1.098 -12.029  -2.008  1.00 11.31           C
ATOM   1459  O   GLN A 114       0.405 -12.119  -0.995  1.00  0.45           O
ATOM   1460  CB  GLN A 114       3.480 -12.181  -1.197  1.00 41.21           C
ATOM   1461  CG  GLN A 114       4.459 -13.212  -0.637  1.00 32.21           C
ATOM   1462  CD  GLN A 114       4.929 -14.223  -1.675  1.00 63.42           C
ATOM   1463  OE1 GLN A 114       4.290 -15.258  -1.881  1.00 53.41           O
ATOM   1464  NE2 GLN A 114       6.053 -13.947  -2.315  1.00 54.14           N
ATOM      0  H   GLN A 114       3.652 -12.182  -3.693  1.00 11.42           H   new
ATOM      0  HA  GLN A 114       2.224 -13.810  -1.781  1.00 63.34           H   new
ATOM      0  HB2 GLN A 114       4.037 -11.426  -1.752  1.00 41.21           H   new
ATOM      0  HB3 GLN A 114       2.988 -11.670  -0.369  1.00 41.21           H   new
ATOM      0  HG2 GLN A 114       5.326 -12.694  -0.226  1.00 32.21           H   new
ATOM      0  HG3 GLN A 114       3.984 -13.743   0.188  1.00 32.21           H   new
ATOM      0 HE21 GLN A 114       6.553 -13.080  -2.117  1.00 54.14           H   new
ATOM      0 HE22 GLN A 114       6.420 -14.601  -3.007  1.00 54.14           H   new
ATOM   1473  N   HIS A 115       0.746 -11.278  -3.048  1.00 40.41           N
ATOM   1474  CA  HIS A 115      -0.517 -10.543  -3.036  1.00  1.23           C
ATOM   1475  C   HIS A 115      -1.609 -11.159  -3.913  1.00 64.15           C
ATOM   1476  O   HIS A 115      -2.774 -10.790  -3.783  1.00  4.14           O
ATOM   1477  CB  HIS A 115      -0.292  -9.093  -3.457  1.00 41.01           C
ATOM   1478  CG  HIS A 115       0.417  -8.267  -2.425  1.00 75.22           C
ATOM   1479  ND1 HIS A 115       0.181  -8.386  -1.074  1.00 63.11           N
ATOM   1480  CD2 HIS A 115       1.369  -7.312  -2.554  1.00 15.24           C
ATOM   1481  CE1 HIS A 115       0.950  -7.540  -0.419  1.00 22.30           C
ATOM   1482  NE2 HIS A 115       1.685  -6.879  -1.290  1.00 63.44           N
ATOM      0  H   HIS A 115       1.304 -11.163  -3.894  1.00 40.41           H   new
ATOM      0  HA  HIS A 115      -0.874 -10.596  -2.008  1.00  1.23           H   new
ATOM      0  HB2 HIS A 115       0.286  -9.078  -4.381  1.00 41.01           H   new
ATOM      0  HB3 HIS A 115      -1.256  -8.634  -3.677  1.00 41.01           H   new
ATOM      0  HD2 HIS A 115       1.799  -6.957  -3.479  1.00 15.24           H   new
ATOM      0  HE1 HIS A 115       0.974  -7.410   0.653  1.00 22.30           H   new
ATOM      0  HE2 HIS A 115       2.375  -6.163  -1.063  1.00 63.44           H   new
ATOM   1491  N   LYS A 116      -1.255 -12.074  -4.801  1.00 34.23           N
ATOM   1492  CA  LYS A 116      -2.234 -12.629  -5.733  1.00 11.33           C
ATOM   1493  C   LYS A 116      -3.193 -13.567  -5.019  1.00  0.02           C
ATOM   1494  O   LYS A 116      -2.878 -14.113  -3.958  1.00 74.34           O
ATOM   1495  CB  LYS A 116      -1.548 -13.327  -6.922  1.00 11.45           C
ATOM   1496  CG  LYS A 116      -0.528 -14.384  -6.531  1.00 41.44           C
ATOM   1497  CD  LYS A 116      -1.184 -15.698  -6.135  1.00 43.05           C
ATOM   1498  CE  LYS A 116      -0.358 -16.433  -5.094  1.00 65.14           C
ATOM   1499  NZ  LYS A 116       0.986 -16.812  -5.610  1.00 61.23           N
ATOM      0  H   LYS A 116      -0.311 -12.447  -4.899  1.00 34.23           H   new
ATOM      0  HA  LYS A 116      -2.816 -11.800  -6.136  1.00 11.33           H   new
ATOM      0  HB2 LYS A 116      -2.313 -13.791  -7.545  1.00 11.45           H   new
ATOM      0  HB3 LYS A 116      -1.054 -12.572  -7.534  1.00 11.45           H   new
ATOM      0  HG2 LYS A 116       0.152 -14.556  -7.365  1.00 41.44           H   new
ATOM      0  HG3 LYS A 116       0.074 -14.016  -5.700  1.00 41.44           H   new
ATOM      0  HD2 LYS A 116      -2.182 -15.505  -5.741  1.00 43.05           H   new
ATOM      0  HD3 LYS A 116      -1.306 -16.327  -7.017  1.00 43.05           H   new
ATOM      0  HE2 LYS A 116      -0.243 -15.802  -4.212  1.00 65.14           H   new
ATOM      0  HE3 LYS A 116      -0.890 -17.330  -4.777  1.00 65.14           H   new
ATOM      0  HZ1 LYS A 116       1.081 -17.848  -5.604  1.00 61.23           H   new
ATOM      0  HZ2 LYS A 116       1.096 -16.460  -6.582  1.00 61.23           H   new
ATOM      0  HZ3 LYS A 116       1.721 -16.394  -5.005  1.00 61.23           H   new
ATOM   1513  N   THR A 117      -4.362 -13.746  -5.600  1.00 33.24           N
ATOM   1514  CA  THR A 117      -5.398 -14.549  -4.987  1.00  4.34           C
ATOM   1515  C   THR A 117      -5.906 -15.599  -5.966  1.00  0.23           C
ATOM   1516  O   THR A 117      -6.891 -15.323  -6.683  1.00 33.77           O
ATOM   1517  CB  THR A 117      -6.561 -13.658  -4.502  1.00 34.43           C
ATOM   1518  OG1 THR A 117      -7.072 -12.880  -5.595  1.00 63.25           O
ATOM   1519  CG2 THR A 117      -6.092 -12.729  -3.393  1.00  2.04           C
ATOM   1520  OXT THR A 117      -5.299 -16.683  -6.037  1.00 33.77           O
ATOM      0  H   THR A 117      -4.618 -13.343  -6.501  1.00 33.24           H   new
ATOM      0  HA  THR A 117      -4.971 -15.058  -4.123  1.00  4.34           H   new
ATOM      0  HB  THR A 117      -7.351 -14.302  -4.115  1.00 34.43           H   new
ATOM      0  HG1 THR A 117      -7.178 -13.453  -6.383  1.00 63.25           H   new
ATOM      0 HG21 THR A 117      -6.924 -12.108  -3.063  1.00  2.04           H   new
ATOM      0 HG22 THR A 117      -5.725 -13.320  -2.554  1.00  2.04           H   new
ATOM      0 HG23 THR A 117      -5.290 -12.092  -3.767  1.00  2.04           H   new