Browse entries in the PDBbind-CN Database
HEADER 4INH_COMPLEX COMPND 4INH_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 128 ASP ASP ASP LYS ALA PRO PRO THR LEU TRP SER ARG VAL SEQRES 2 A 128 THR LYS PHE GLY SER GLY TRP GLY PHE TRP VAL SER PRO SEQRES 3 A 128 THR VAL PHE ILE THR THR THR HIS VAL VAL PRO THR GLY SEQRES 4 A 128 VAL LYS GLU PHE PHE GLY GLU PRO LEU SER SER ILE ALA SEQRES 5 A 128 ILE HIS GLN ALA GLY GLU PHE THR GLN PHE ARG PHE SER SEQRES 6 A 128 LYS LYS MET ARG PRO ASP LEU THR GLY MET VAL LEU GLU SEQRES 7 A 128 GLU GLY CYS PRO GLU GLY THR VAL CYS SER VAL LEU ILE SEQRES 8 A 128 LYS ARG ASP SER GLY GLU LEU LEU PRO LEU ALA VAL ARG SEQRES 9 A 128 MET GLY ALA ILE ALA SER MET ARG ILE GLN GLY ARG LEU SEQRES 10 A 128 VAL HIS GLY GLN SER GLY MET LEU LEU THR GLY SEQRES 1 A 44 ASP LEU GLY THR ILE PRO GLY ASP CYS GLY ALA PRO TYR SEQRES 2 A 44 VAL HIS LYS ARG GLY ASN ASP TRP VAL VAL CYS GLY VAL SEQRES 3 A 44 HIS ALA ALA ALA THR LYS SER GLY ASN THR VAL VAL CYS SEQRES 4 A 44 ALA VAL GLN ALA GLY HET PHQ A 361 70 ATOM 1 N ASP A -3 -10.202 55.333 55.517 1.00 71.27 N ATOM 2 CA ASP A -3 -10.260 55.679 56.937 1.00 66.59 C ATOM 3 C ASP A -3 -11.704 56.112 57.238 1.00 65.27 C ATOM 4 O ASP A -3 -12.548 56.031 56.329 1.00 67.84 O ATOM 5 CB ASP A -3 -9.249 56.770 57.247 1.00 65.11 C ATOM 6 CG ASP A -3 -8.573 56.580 58.605 1.00 60.74 C ATOM 7 OD1 ASP A -3 -8.025 55.493 58.866 1.00 48.12 O ATOM 8 OD2 ASP A -3 -8.588 57.534 59.416 1.00 67.68 O ATOM 9 HA ASP A -3 -10.000 54.831 57.571 1.00 0.00 H ATOM 10 HB2 ASP A -3 -8.482 56.766 56.472 1.00 0.00 H ATOM 11 HB3 ASP A -3 -9.762 57.732 57.244 1.00 0.00 H ATOM 12 HN3 ASP A -3 -10.462 56.164 54.948 1.00 0.00 H ATOM 13 HN2 ASP A -3 -10.866 54.557 55.323 1.00 0.00 H ATOM 14 HN1 ASP A -3 -9.236 55.034 55.274 1.00 0.00 H ATOM 15 N ASP A -2 -12.008 56.632 58.436 1.00 55.79 N ATOM 16 CA ASP A -2 -11.066 57.320 59.317 1.00 41.47 C ATOM 17 C ASP A -2 -10.746 56.675 60.673 1.00 34.37 C ATOM 18 O ASP A -2 -10.426 57.395 61.633 1.00 29.17 O ATOM 19 CB ASP A -2 -11.570 58.740 59.570 1.00 43.30 C ATOM 20 CG ASP A -2 -12.918 58.753 60.267 1.00 48.70 C ATOM 21 OD1 ASP A -2 -13.521 57.668 60.385 1.00 36.17 O ATOM 22 OD2 ASP A -2 -13.377 59.833 60.695 1.00 54.02 O ATOM 23 HA ASP A -2 -10.125 57.273 58.769 1.00 0.00 H ATOM 24 HB2 ASP A -2 -10.846 59.264 60.194 1.00 0.00 H ATOM 25 HB3 ASP A -2 -11.664 59.255 58.614 1.00 0.00 H ATOM 26 H ASP A -2 -12.991 56.539 58.764 1.00 0.00 H ATOM 27 N ASP A -1 -10.792 55.349 60.761 1.00 24.56 N ATOM 28 CA ASP A -1 -10.689 54.708 62.064 1.00 20.23 C ATOM 29 C ASP A -1 -9.326 54.104 62.341 1.00 19.17 C ATOM 30 O ASP A -1 -9.148 53.448 63.368 1.00 20.36 O ATOM 31 CB ASP A -1 -11.788 53.662 62.237 1.00 20.25 C ATOM 32 CG ASP A -1 -13.157 54.283 62.241 1.00 28.50 C ATOM 33 OD1 ASP A -1 -13.343 55.346 62.869 1.00 34.01 O ATOM 34 OD2 ASP A -1 -14.059 53.720 61.611 1.00 50.90 O ATOM 35 HA ASP A -1 -10.822 55.499 62.801 1.00 0.00 H ATOM 36 HB2 ASP A -1 -11.727 52.947 61.416 1.00 0.00 H ATOM 37 HB3 ASP A -1 -11.634 53.142 63.182 1.00 0.00 H ATOM 38 H ASP A -1 -10.901 54.772 59.903 1.00 0.00 H ATOM 39 N LYS A 0 -8.396 54.293 61.416 1.00 22.53 N ATOM 40 CA LYS A 0 -6.996 53.940 61.579 1.00 23.97 C ATOM 41 C LYS A 0 -6.637 52.471 61.728 1.00 26.03 C ATOM 42 O LYS A 0 -6.001 51.903 60.876 1.00 27.74 O ATOM 43 CB LYS A 0 -6.395 54.674 62.741 1.00 22.90 C ATOM 44 CG LYS A 0 -4.897 54.469 62.788 1.00 24.96 C ATOM 45 CD LYS A 0 -4.363 55.403 63.824 1.00 19.19 C ATOM 46 CE LYS A 0 -3.895 54.663 64.948 1.00 22.13 C ATOM 47 NZ LYS A 0 -4.913 53.746 65.516 1.00 30.30 N ATOM 48 HA LYS A 0 -6.582 54.237 60.615 1.00 0.00 H ATOM 49 HB2 LYS A 0 -6.608 55.738 62.641 1.00 0.00 H ATOM 50 HB3 LYS A 0 -6.836 54.302 63.666 1.00 0.00 H ATOM 51 HG2 LYS A 0 -4.668 53.438 63.058 1.00 0.00 H ATOM 52 HG3 LYS A 0 -4.457 54.695 61.817 1.00 0.00 H ATOM 53 HD2 LYS A 0 -3.540 55.979 63.402 1.00 0.00 H ATOM 54 HD3 LYS A 0 -5.154 56.082 64.142 1.00 0.00 H ATOM 55 HE2 LYS A 0 -3.593 55.367 65.724 1.00 0.00 H ATOM 56 HE3 LYS A 0 -3.033 54.073 64.638 1.00 0.00 H ATOM 57 HZ1 LYS A 0 -5.739 54.296 65.826 1.00 0.00 H ATOM 58 HZ2 LYS A 0 -5.204 53.061 64.790 1.00 0.00 H ATOM 59 HZ3 LYS A 0 -4.507 53.240 66.329 1.00 0.00 H ATOM 60 H LYS A 0 -8.687 54.722 60.515 1.00 0.00 H ATOM 61 N ALA A 1 -7.019 51.907 62.852 1.00 18.05 N ATOM 62 CA ALA A 1 -6.806 50.490 63.091 1.00 16.96 C ATOM 63 C ALA A 1 -7.770 49.597 62.285 1.00 19.62 C ATOM 64 O ALA A 1 -8.903 49.999 62.027 1.00 17.24 O ATOM 65 CB ALA A 1 -6.982 50.235 64.582 1.00 16.80 C ATOM 66 HA ALA A 1 -5.800 50.231 62.760 1.00 0.00 H ATOM 67 HB1 ALA A 1 -6.254 50.826 65.139 1.00 0.00 H ATOM 68 HB2 ALA A 1 -7.990 50.521 64.882 1.00 0.00 H ATOM 69 HB3 ALA A 1 -6.827 49.176 64.789 1.00 0.00 H ATOM 70 H ALA A 1 -7.482 52.485 63.583 1.00 0.00 H ATOM 71 N PRO A 2 -7.325 48.391 61.892 1.00 17.82 N ATOM 72 CA PRO A 2 -8.187 47.430 61.180 1.00 17.30 C ATOM 73 C PRO A 2 -9.284 46.827 62.077 1.00 15.48 C ATOM 74 O PRO A 2 -9.154 46.848 63.292 1.00 15.65 O ATOM 75 CB PRO A 2 -7.231 46.304 60.786 1.00 22.43 C ATOM 76 CG PRO A 2 -5.868 46.714 61.222 1.00 28.64 C ATOM 77 CD PRO A 2 -6.004 47.826 62.204 1.00 20.37 C ATOM 78 HA PRO A 2 -8.698 47.919 60.351 1.00 0.00 H ATOM 79 HD3 PRO A 2 -5.971 47.451 63.227 1.00 0.00 H ATOM 80 HD2 PRO A 2 -5.218 48.569 62.065 1.00 0.00 H ATOM 81 HG3 PRO A 2 -5.291 47.051 60.361 1.00 0.00 H ATOM 82 HG2 PRO A 2 -5.361 45.870 61.689 1.00 0.00 H ATOM 83 HB2 PRO A 2 -7.520 45.377 61.282 1.00 0.00 H ATOM 84 HB3 PRO A 2 -7.250 46.158 59.706 1.00 0.00 H ATOM 85 N PRO A 3 -10.339 46.274 61.462 1.00 14.90 N ATOM 86 CA PRO A 3 -11.483 45.755 62.226 1.00 14.42 C ATOM 87 C PRO A 3 -11.026 44.734 63.261 1.00 15.40 C ATOM 88 O PRO A 3 -11.510 44.766 64.381 1.00 13.70 O ATOM 89 CB PRO A 3 -12.361 45.082 61.145 1.00 17.23 C ATOM 90 CG PRO A 3 -12.042 45.816 59.908 1.00 19.76 C ATOM 91 CD PRO A 3 -10.568 46.222 60.013 1.00 18.10 C ATOM 92 HA PRO A 3 -12.009 46.531 62.782 1.00 0.00 H ATOM 93 HD3 PRO A 3 -9.923 45.481 59.541 1.00 0.00 H ATOM 94 HD2 PRO A 3 -10.396 47.196 59.554 1.00 0.00 H ATOM 95 HG3 PRO A 3 -12.672 46.701 59.822 1.00 0.00 H ATOM 96 HG2 PRO A 3 -12.196 45.176 59.039 1.00 0.00 H ATOM 97 HB2 PRO A 3 -12.108 44.026 61.044 1.00 0.00 H ATOM 98 HB3 PRO A 3 -13.419 45.179 61.390 1.00 0.00 H ATOM 99 N THR A 4 -10.072 43.874 62.916 1.00 15.15 N ATOM 100 CA THR A 4 -9.648 42.835 63.865 1.00 15.25 C ATOM 101 C THR A 4 -9.058 43.448 65.144 1.00 13.41 C ATOM 102 O THR A 4 -9.299 42.952 66.241 1.00 13.79 O ATOM 103 CB THR A 4 -8.628 41.872 63.216 1.00 23.40 C ATOM 104 OG1 THR A 4 -9.267 41.211 62.107 1.00 21.82 O ATOM 105 CG2 THR A 4 -8.201 40.807 64.232 1.00 22.27 C ATOM 106 HA THR A 4 -10.537 42.267 64.139 1.00 0.00 H ATOM 107 HB THR A 4 -7.755 42.434 62.885 1.00 0.00 H ATOM 108 HG1 THR A 4 -9.562 41.887 61.447 1.00 0.00 H ATOM 109 HG23 THR A 4 -7.715 41.290 65.080 1.00 0.00 H ATOM 110 HG21 THR A 4 -9.080 40.263 64.577 1.00 0.00 H ATOM 111 HG22 THR A 4 -7.506 40.114 63.759 1.00 0.00 H ATOM 112 H THR A 4 -9.628 43.937 61.978 1.00 0.00 H ATOM 113 N LEU A 5 -8.318 44.547 64.988 1.00 13.61 N ATOM 114 CA LEU A 5 -7.707 45.233 66.129 1.00 12.40 C ATOM 115 C LEU A 5 -8.805 45.863 66.985 1.00 14.26 C ATOM 116 O LEU A 5 -8.801 45.724 68.223 1.00 12.46 O ATOM 117 CB LEU A 5 -6.694 46.289 65.642 1.00 12.88 C ATOM 118 CG LEU A 5 -5.971 47.115 66.719 1.00 14.96 C ATOM 119 CD1 LEU A 5 -5.437 46.223 67.823 1.00 18.95 C ATOM 120 CD2 LEU A 5 -4.842 47.917 66.106 1.00 14.93 C ATOM 121 HA LEU A 5 -7.160 44.515 66.740 1.00 0.00 H ATOM 122 HB2 LEU A 5 -5.933 45.770 65.060 1.00 0.00 H ATOM 123 HB3 LEU A 5 -7.230 46.986 64.998 1.00 0.00 H ATOM 124 HG LEU A 5 -6.696 47.803 67.154 1.00 0.00 H ATOM 125 HD21 LEU A 5 -4.127 47.238 65.641 1.00 0.00 H ATOM 126 HD22 LEU A 5 -5.246 48.593 65.353 1.00 0.00 H ATOM 127 HD23 LEU A 5 -4.344 48.494 66.885 1.00 0.00 H ATOM 128 HD11 LEU A 5 -6.265 45.689 68.289 1.00 0.00 H ATOM 129 HD12 LEU A 5 -4.733 45.506 67.401 1.00 0.00 H ATOM 130 HD13 LEU A 5 -4.931 46.835 68.570 1.00 0.00 H ATOM 131 H LEU A 5 -8.171 44.927 64.031 1.00 0.00 H ATOM 132 N TRP A 6 -9.741 46.547 66.340 1.00 12.89 N ATOM 133 CA TRP A 6 -10.902 47.048 67.084 1.00 13.05 C ATOM 134 C TRP A 6 -11.645 45.931 67.812 1.00 16.07 C ATOM 135 O TRP A 6 -12.156 46.131 68.913 1.00 12.45 O ATOM 136 CB TRP A 6 -11.870 47.792 66.165 1.00 14.07 C ATOM 137 CG TRP A 6 -11.409 49.165 65.803 1.00 14.63 C ATOM 138 CD1 TRP A 6 -10.898 49.570 64.608 1.00 15.17 C ATOM 139 CD2 TRP A 6 -11.396 50.314 66.662 1.00 16.63 C ATOM 140 NE1 TRP A 6 -10.575 50.922 64.666 1.00 16.03 N ATOM 141 CE2 TRP A 6 -10.877 51.391 65.919 1.00 16.89 C ATOM 142 CE3 TRP A 6 -11.788 50.528 67.994 1.00 15.30 C ATOM 143 CZ2 TRP A 6 -10.744 52.681 66.455 1.00 16.80 C ATOM 144 CZ3 TRP A 6 -11.637 51.806 68.530 1.00 15.96 C ATOM 145 CH2 TRP A 6 -11.130 52.861 67.758 1.00 16.72 C ATOM 146 HA TRP A 6 -10.513 47.741 67.830 1.00 0.00 H ATOM 147 HB2 TRP A 6 -11.989 47.215 65.248 1.00 0.00 H ATOM 148 HB3 TRP A 6 -12.833 47.873 66.670 1.00 0.00 H ATOM 149 HE1 TRP A 6 -10.172 51.483 63.889 1.00 0.00 H ATOM 150 HD1 TRP A 6 -10.762 48.930 63.736 1.00 0.00 H ATOM 151 HZ2 TRP A 6 -10.350 53.505 65.860 1.00 0.00 H ATOM 152 HH2 TRP A 6 -11.040 53.851 68.206 1.00 0.00 H ATOM 153 HZ3 TRP A 6 -11.918 51.988 69.567 1.00 0.00 H ATOM 154 HE3 TRP A 6 -12.200 49.716 68.593 1.00 0.00 H ATOM 155 H TRP A 6 -9.653 46.726 65.319 1.00 0.00 H ATOM 156 N SER A 7 -11.728 44.758 67.197 1.00 12.28 N ATOM 157 CA SER A 7 -12.494 43.689 67.824 1.00 12.70 C ATOM 158 C SER A 7 -11.819 43.152 69.092 1.00 13.76 C ATOM 159 O SER A 7 -12.442 42.380 69.844 1.00 15.26 O ATOM 160 CB SER A 7 -12.762 42.535 66.852 1.00 12.01 C ATOM 161 OG SER A 7 -11.628 41.664 66.763 1.00 15.14 O ATOM 162 HA SER A 7 -13.447 44.134 68.110 1.00 0.00 H ATOM 163 HB2 SER A 7 -12.977 42.943 65.864 1.00 0.00 H ATOM 164 HB3 SER A 7 -13.622 41.965 67.203 1.00 0.00 H ATOM 165 HG SER A 7 -10.845 42.176 66.440 1.00 0.00 H ATOM 166 H SER A 7 -11.255 44.605 66.284 1.00 0.00 H ATOM 167 N ARG A 8 -10.582 43.566 69.368 1.00 12.10 N ATOM 168 CA ARG A 8 -9.938 43.161 70.628 1.00 12.89 C ATOM 169 C ARG A 8 -10.443 43.995 71.807 1.00 14.93 C ATOM 170 O ARG A 8 -10.317 43.586 72.950 1.00 13.23 O ATOM 171 CB ARG A 8 -8.427 43.297 70.542 1.00 11.94 C ATOM 172 CG ARG A 8 -7.824 42.415 69.448 1.00 12.76 C ATOM 173 CD ARG A 8 -6.366 42.834 69.220 1.00 11.45 C ATOM 174 NE ARG A 8 -5.702 42.035 68.187 1.00 14.09 N ATOM 175 CZ ARG A 8 -4.927 40.974 68.418 1.00 17.11 C ATOM 176 NH1 ARG A 8 -4.685 40.554 69.668 1.00 15.47 N ATOM 177 NH2 ARG A 8 -4.358 40.344 67.384 1.00 14.93 N ATOM 178 HA ARG A 8 -10.199 42.115 70.791 1.00 0.00 H ATOM 179 HB2 ARG A 8 -8.180 44.337 70.329 1.00 0.00 H ATOM 180 HB3 ARG A 8 -7.994 43.011 71.501 1.00 0.00 H ATOM 181 HG2 ARG A 8 -7.861 41.371 69.758 1.00 0.00 H ATOM 182 HG3 ARG A 8 -8.389 42.539 68.524 1.00 0.00 H ATOM 183 HD2 ARG A 8 -5.819 42.718 70.156 1.00 0.00 H ATOM 184 HD3 ARG A 8 -6.347 43.881 68.917 1.00 0.00 H ATOM 185 HE ARG A 8 -5.846 42.317 67.196 1.00 0.00 H ATOM 186 HH12 ARG A 8 -4.078 39.725 69.830 1.00 0.00 H ATOM 187 HH11 ARG A 8 -5.104 41.057 70.476 1.00 0.00 H ATOM 188 HH22 ARG A 8 -3.752 39.516 67.550 1.00 0.00 H ATOM 189 HH21 ARG A 8 -4.522 40.683 66.414 1.00 0.00 H ATOM 190 H ARG A 8 -10.073 44.174 68.695 1.00 0.00 H ATOM 191 N VAL A 9 -10.998 45.169 71.519 1.00 12.08 N ATOM 192 CA VAL A 9 -11.480 46.065 72.570 1.00 13.42 C ATOM 193 C VAL A 9 -12.838 45.533 73.011 1.00 15.42 C ATOM 194 O VAL A 9 -13.737 45.344 72.188 1.00 14.70 O ATOM 195 CB VAL A 9 -11.610 47.510 72.040 1.00 12.63 C ATOM 196 CG1 VAL A 9 -12.021 48.476 73.159 1.00 16.06 C ATOM 197 CG2 VAL A 9 -10.281 47.958 71.401 1.00 12.75 C ATOM 198 HA VAL A 9 -10.781 46.093 73.406 1.00 0.00 H ATOM 199 HB VAL A 9 -12.393 47.528 71.281 1.00 0.00 H ATOM 200 HG11 VAL A 9 -12.983 48.167 73.569 1.00 0.00 H ATOM 201 HG12 VAL A 9 -11.267 48.460 73.946 1.00 0.00 H ATOM 202 HG13 VAL A 9 -12.104 49.485 72.754 1.00 0.00 H ATOM 203 HG21 VAL A 9 -9.489 47.919 72.149 1.00 0.00 H ATOM 204 HG22 VAL A 9 -10.035 47.292 70.574 1.00 0.00 H ATOM 205 HG23 VAL A 9 -10.383 48.978 71.030 1.00 0.00 H ATOM 206 H VAL A 9 -11.091 45.456 70.524 1.00 0.00 H ATOM 207 N THR A 10 -12.967 45.284 74.313 1.00 12.29 N ATOM 208 CA THR A 10 -14.019 44.421 74.841 1.00 13.61 C ATOM 209 C THR A 10 -14.691 45.056 76.054 1.00 12.15 C ATOM 210 O THR A 10 -14.013 45.476 77.000 1.00 14.49 O ATOM 211 CB THR A 10 -13.381 43.101 75.315 1.00 14.80 C ATOM 212 OG1 THR A 10 -12.764 42.455 74.192 1.00 15.81 O ATOM 213 CG2 THR A 10 -14.442 42.173 75.922 1.00 14.62 C ATOM 214 HA THR A 10 -14.756 44.261 74.054 1.00 0.00 H ATOM 215 HB THR A 10 -12.637 43.319 76.081 1.00 0.00 H ATOM 216 HG1 THR A 10 -13.450 42.268 73.503 1.00 0.00 H ATOM 217 HG23 THR A 10 -14.909 42.666 76.775 1.00 0.00 H ATOM 218 HG21 THR A 10 -15.199 41.949 75.171 1.00 0.00 H ATOM 219 HG22 THR A 10 -13.969 41.248 76.250 1.00 0.00 H ATOM 220 H THR A 10 -12.295 45.720 74.976 1.00 0.00 H ATOM 221 N LYS A 11 -16.016 45.158 76.036 1.00 13.84 N ATOM 222 CA LYS A 11 -16.700 45.744 77.181 1.00 16.13 C ATOM 223 C LYS A 11 -16.404 44.862 78.390 1.00 18.62 C ATOM 224 O LYS A 11 -16.468 43.639 78.281 1.00 18.59 O ATOM 225 CB LYS A 11 -18.202 45.817 76.919 1.00 13.49 C ATOM 226 CG LYS A 11 -18.960 46.593 78.007 1.00 18.94 C ATOM 227 CD LYS A 11 -18.559 48.066 77.941 1.00 20.46 C ATOM 228 CE LYS A 11 -19.176 48.909 79.060 1.00 26.04 C ATOM 229 NZ LYS A 11 -18.421 48.883 80.349 1.00 22.87 N ATOM 230 HA LYS A 11 -16.351 46.761 77.361 1.00 0.00 H ATOM 231 HB2 LYS A 11 -18.365 46.311 75.961 1.00 0.00 H ATOM 232 HB3 LYS A 11 -18.598 44.802 76.875 1.00 0.00 H ATOM 233 HG2 LYS A 11 -20.033 46.499 77.842 1.00 0.00 H ATOM 234 HG3 LYS A 11 -18.707 46.189 78.987 1.00 0.00 H ATOM 235 HD2 LYS A 11 -17.474 48.134 78.014 1.00 0.00 H ATOM 236 HD3 LYS A 11 -18.883 48.471 76.982 1.00 0.00 H ATOM 237 HE2 LYS A 11 -20.184 48.538 79.249 1.00 0.00 H ATOM 238 HE3 LYS A 11 -19.228 49.942 78.718 1.00 0.00 H ATOM 239 HZ1 LYS A 11 -18.371 47.905 80.700 1.00 0.00 H ATOM 240 HZ2 LYS A 11 -17.459 49.246 80.193 1.00 0.00 H ATOM 241 HZ3 LYS A 11 -18.909 49.479 81.047 1.00 0.00 H ATOM 242 H LYS A 11 -16.558 44.823 75.214 1.00 0.00 H ATOM 243 N PHE A 12 -16.072 45.467 79.528 1.00 16.00 N ATOM 244 CA PHE A 12 -15.676 44.695 80.721 1.00 15.05 C ATOM 245 C PHE A 12 -15.904 45.513 81.972 1.00 16.95 C ATOM 246 O PHE A 12 -15.332 46.592 82.101 1.00 19.19 O ATOM 247 CB PHE A 12 -14.175 44.342 80.652 1.00 14.99 C ATOM 248 CG PHE A 12 -13.725 43.322 81.686 1.00 14.26 C ATOM 249 CD1 PHE A 12 -14.218 42.024 81.651 1.00 19.13 C ATOM 250 CD2 PHE A 12 -12.779 43.651 82.654 1.00 19.02 C ATOM 251 CE1 PHE A 12 -13.806 41.084 82.572 1.00 17.22 C ATOM 252 CE2 PHE A 12 -12.347 42.712 83.575 1.00 19.61 C ATOM 253 CZ PHE A 12 -12.864 41.420 83.536 1.00 16.88 C ATOM 254 HA PHE A 12 -16.278 43.786 80.749 1.00 0.00 H ATOM 255 HB2 PHE A 12 -13.963 43.940 79.661 1.00 0.00 H ATOM 256 HB3 PHE A 12 -13.601 45.257 80.802 1.00 0.00 H ATOM 257 HD2 PHE A 12 -12.373 44.662 82.687 1.00 0.00 H ATOM 258 HE2 PHE A 12 -11.606 42.983 84.327 1.00 0.00 H ATOM 259 HZ PHE A 12 -12.531 40.675 84.259 1.00 0.00 H ATOM 260 HE1 PHE A 12 -14.220 40.076 82.544 1.00 0.00 H ATOM 261 HD1 PHE A 12 -14.941 41.744 80.885 1.00 0.00 H ATOM 262 H PHE A 12 -16.092 46.506 79.577 1.00 0.00 H ATOM 263 N GLY A 13 -16.708 45.005 82.906 1.00 17.29 N ATOM 264 CA GLY A 13 -16.924 45.728 84.155 1.00 21.16 C ATOM 265 C GLY A 13 -17.391 47.145 83.899 1.00 20.02 C ATOM 266 O GLY A 13 -18.256 47.361 83.082 1.00 17.63 O ATOM 267 HA3 GLY A 13 -15.989 45.758 84.714 1.00 0.00 H ATOM 268 HA2 GLY A 13 -17.680 45.206 84.741 1.00 0.00 H ATOM 269 H GLY A 13 -17.181 44.093 82.745 1.00 0.00 H ATOM 270 N SER A 14 -16.800 48.104 84.603 1.00 19.92 N ATOM 271 CA SER A 14 -17.156 49.506 84.430 1.00 24.97 C ATOM 272 C SER A 14 -16.223 50.191 83.435 1.00 24.90 C ATOM 273 O SER A 14 -15.813 51.333 83.642 1.00 19.35 O ATOM 274 CB SER A 14 -17.121 50.238 85.773 1.00 24.22 C ATOM 275 OG SER A 14 -15.799 50.319 86.276 1.00 25.50 O ATOM 276 HA SER A 14 -18.170 49.547 84.032 1.00 0.00 H ATOM 277 HB2 SER A 14 -17.742 49.699 86.489 1.00 0.00 H ATOM 278 HB3 SER A 14 -17.514 51.246 85.640 1.00 0.00 H ATOM 279 HG SER A 14 -15.232 50.812 85.632 1.00 0.00 H ATOM 280 H SER A 14 -16.066 47.848 85.294 1.00 0.00 H ATOM 281 N GLY A 15 -15.891 49.488 82.357 1.00 13.51 N ATOM 282 CA GLY A 15 -15.008 50.033 81.343 1.00 13.45 C ATOM 283 C GLY A 15 -14.798 49.120 80.150 1.00 15.83 C ATOM 284 O GLY A 15 -15.749 48.743 79.465 1.00 16.98 O ATOM 285 HA3 GLY A 15 -14.038 50.227 81.801 1.00 0.00 H ATOM 286 HA2 GLY A 15 -15.434 50.971 80.986 1.00 0.00 H ATOM 287 H GLY A 15 -16.272 48.528 82.238 1.00 0.00 H ATOM 288 N TRP A 16 -13.540 48.769 79.901 1.00 11.86 N ATOM 289 CA TRP A 16 -13.172 47.943 78.748 1.00 11.49 C ATOM 290 C TRP A 16 -11.909 47.147 79.098 1.00 13.80 C ATOM 291 O TRP A 16 -11.234 47.442 80.088 1.00 14.78 O ATOM 292 CB TRP A 16 -12.911 48.858 77.542 1.00 11.98 C ATOM 293 CG TRP A 16 -14.098 49.719 77.247 1.00 13.06 C ATOM 294 CD1 TRP A 16 -14.393 50.929 77.829 1.00 16.79 C ATOM 295 CD2 TRP A 16 -15.158 49.440 76.349 1.00 16.00 C ATOM 296 NE1 TRP A 16 -15.584 51.409 77.344 1.00 15.64 N ATOM 297 CE2 TRP A 16 -16.076 50.512 76.420 1.00 15.47 C ATOM 298 CE3 TRP A 16 -15.433 48.377 75.469 1.00 14.66 C ATOM 299 CZ2 TRP A 16 -17.241 50.570 75.648 1.00 16.84 C ATOM 300 CZ3 TRP A 16 -16.606 48.423 74.702 1.00 16.40 C ATOM 301 CH2 TRP A 16 -17.480 49.514 74.790 1.00 17.34 C ATOM 302 HA TRP A 16 -13.976 47.250 78.499 1.00 0.00 H ATOM 303 HB2 TRP A 16 -12.054 49.496 77.759 1.00 0.00 H ATOM 304 HB3 TRP A 16 -12.693 48.242 76.669 1.00 0.00 H ATOM 305 HE1 TRP A 16 -16.039 52.300 77.626 1.00 0.00 H ATOM 306 HD1 TRP A 16 -13.771 51.434 78.568 1.00 0.00 H ATOM 307 HZ2 TRP A 16 -17.930 51.411 75.720 1.00 0.00 H ATOM 308 HH2 TRP A 16 -18.373 49.530 74.165 1.00 0.00 H ATOM 309 HZ3 TRP A 16 -16.841 47.599 74.028 1.00 0.00 H ATOM 310 HE3 TRP A 16 -14.747 47.534 75.385 1.00 0.00 H ATOM 311 H TRP A 16 -12.791 49.092 80.547 1.00 0.00 H ATOM 312 N GLY A 17 -11.599 46.146 78.278 1.00 15.60 N ATOM 313 CA GLY A 17 -10.316 45.477 78.335 1.00 14.37 C ATOM 314 C GLY A 17 -9.901 45.169 76.913 1.00 15.38 C ATOM 315 O GLY A 17 -10.628 45.508 75.958 1.00 13.98 O ATOM 316 HA3 GLY A 17 -10.403 44.553 78.906 1.00 0.00 H ATOM 317 HA2 GLY A 17 -9.578 46.126 78.806 1.00 0.00 H ATOM 318 H GLY A 17 -12.299 45.835 77.575 1.00 0.00 H ATOM 319 N PHE A 18 -8.763 44.490 76.772 1.00 12.15 N ATOM 320 CA PHE A 18 -8.149 44.276 75.469 1.00 14.57 C ATOM 321 C PHE A 18 -7.535 42.894 75.362 1.00 12.85 C ATOM 322 O PHE A 18 -6.725 42.512 76.207 1.00 14.42 O ATOM 323 CB PHE A 18 -7.069 45.342 75.276 1.00 15.97 C ATOM 324 CG PHE A 18 -6.429 45.332 73.919 1.00 13.35 C ATOM 325 CD1 PHE A 18 -7.093 45.865 72.822 1.00 17.53 C ATOM 326 CD2 PHE A 18 -5.153 44.816 73.749 1.00 15.69 C ATOM 327 CE1 PHE A 18 -6.491 45.877 71.578 1.00 13.84 C ATOM 328 CE2 PHE A 18 -4.545 44.807 72.510 1.00 14.73 C ATOM 329 CZ PHE A 18 -5.208 45.360 71.420 1.00 16.58 C ATOM 330 HA PHE A 18 -8.913 44.351 74.695 1.00 0.00 H ATOM 331 HB2 PHE A 18 -7.523 46.321 75.433 1.00 0.00 H ATOM 332 HB3 PHE A 18 -6.291 45.180 76.022 1.00 0.00 H ATOM 333 HD2 PHE A 18 -4.621 44.410 74.609 1.00 0.00 H ATOM 334 HE2 PHE A 18 -3.554 44.370 72.387 1.00 0.00 H ATOM 335 HZ PHE A 18 -4.724 45.389 70.444 1.00 0.00 H ATOM 336 HE1 PHE A 18 -7.021 46.291 70.720 1.00 0.00 H ATOM 337 HD1 PHE A 18 -8.095 46.276 72.943 1.00 0.00 H ATOM 338 H PHE A 18 -8.299 44.101 77.618 1.00 0.00 H ATOM 339 N TRP A 19 -7.929 42.153 74.327 1.00 11.95 N ATOM 340 CA TRP A 19 -7.327 40.851 74.042 1.00 14.39 C ATOM 341 C TRP A 19 -5.996 41.034 73.318 1.00 17.14 C ATOM 342 O TRP A 19 -5.953 41.371 72.141 1.00 14.91 O ATOM 343 CB TRP A 19 -8.254 39.955 73.194 1.00 14.56 C ATOM 344 CG TRP A 19 -9.448 39.488 73.965 1.00 10.96 C ATOM 345 CD1 TRP A 19 -10.703 40.007 73.926 1.00 10.72 C ATOM 346 CD2 TRP A 19 -9.470 38.449 74.951 1.00 12.52 C ATOM 347 NE1 TRP A 19 -11.522 39.326 74.804 1.00 13.47 N ATOM 348 CE2 TRP A 19 -10.781 38.372 75.453 1.00 15.12 C ATOM 349 CE3 TRP A 19 -8.498 37.586 75.472 1.00 15.64 C ATOM 350 CZ2 TRP A 19 -11.167 37.460 76.431 1.00 15.16 C ATOM 351 CZ3 TRP A 19 -8.886 36.669 76.428 1.00 14.96 C ATOM 352 CH2 TRP A 19 -10.195 36.622 76.912 1.00 12.68 C ATOM 353 HA TRP A 19 -7.165 40.355 74.999 1.00 0.00 H ATOM 354 HB2 TRP A 19 -8.595 40.522 72.328 1.00 0.00 H ATOM 355 HB3 TRP A 19 -7.690 39.085 72.858 1.00 0.00 H ATOM 356 HE1 TRP A 19 -12.536 39.507 74.950 1.00 0.00 H ATOM 357 HD1 TRP A 19 -11.017 40.838 73.295 1.00 0.00 H ATOM 358 HZ2 TRP A 19 -12.193 37.414 76.797 1.00 0.00 H ATOM 359 HH2 TRP A 19 -10.450 35.902 77.690 1.00 0.00 H ATOM 360 HZ3 TRP A 19 -8.151 35.963 76.815 1.00 0.00 H ATOM 361 HE3 TRP A 19 -7.464 37.637 75.132 1.00 0.00 H ATOM 362 H TRP A 19 -8.684 42.509 73.706 1.00 0.00 H ATOM 363 N VAL A 20 -4.912 40.767 74.036 1.00 12.78 N ATOM 364 CA VAL A 20 -3.562 40.844 73.487 1.00 11.89 C ATOM 365 C VAL A 20 -3.303 39.611 72.625 1.00 13.72 C ATOM 366 O VAL A 20 -2.523 39.642 71.661 1.00 15.82 O ATOM 367 CB VAL A 20 -2.535 40.860 74.646 1.00 14.35 C ATOM 368 CG1 VAL A 20 -1.093 40.874 74.131 1.00 15.59 C ATOM 369 CG2 VAL A 20 -2.800 42.051 75.579 1.00 17.23 C ATOM 370 HA VAL A 20 -3.464 41.751 72.890 1.00 0.00 H ATOM 371 HB VAL A 20 -2.661 39.938 75.214 1.00 0.00 H ATOM 372 HG11 VAL A 20 -0.915 39.983 73.529 1.00 0.00 H ATOM 373 HG12 VAL A 20 -0.935 41.764 73.522 1.00 0.00 H ATOM 374 HG13 VAL A 20 -0.406 40.885 74.977 1.00 0.00 H ATOM 375 HG21 VAL A 20 -2.714 42.979 75.014 1.00 0.00 H ATOM 376 HG22 VAL A 20 -3.804 41.969 75.995 1.00 0.00 H ATOM 377 HG23 VAL A 20 -2.069 42.047 76.388 1.00 0.00 H ATOM 378 H VAL A 20 -5.030 40.491 75.032 1.00 0.00 H ATOM 379 N SER A 21 -3.944 38.508 72.988 1.00 13.24 N ATOM 380 CA SER A 21 -3.815 37.258 72.239 1.00 15.32 C ATOM 381 C SER A 21 -5.041 36.398 72.532 1.00 15.22 C ATOM 382 O SER A 21 -5.951 36.836 73.228 1.00 16.60 O ATOM 383 CB SER A 21 -2.548 36.522 72.672 1.00 21.00 C ATOM 384 OG SER A 21 -2.732 35.992 73.976 1.00 22.56 O ATOM 385 HA SER A 21 -3.748 37.464 71.171 1.00 0.00 H ATOM 386 HB2 SER A 21 -1.708 37.216 72.677 1.00 0.00 H ATOM 387 HB3 SER A 21 -2.343 35.710 71.975 1.00 0.00 H ATOM 388 HG SER A 21 -1.911 35.515 74.256 1.00 0.00 H ATOM 389 H SER A 21 -4.556 38.532 73.829 1.00 0.00 H ATOM 390 N PRO A 22 -5.083 35.167 71.989 1.00 15.78 N ATOM 391 CA PRO A 22 -6.265 34.355 72.290 1.00 15.46 C ATOM 392 C PRO A 22 -6.438 34.054 73.779 1.00 19.22 C ATOM 393 O PRO A 22 -7.556 33.784 74.212 1.00 19.75 O ATOM 394 CB PRO A 22 -6.015 33.072 71.484 1.00 18.11 C ATOM 395 CG PRO A 22 -5.103 33.522 70.350 1.00 15.35 C ATOM 396 CD PRO A 22 -4.191 34.517 71.010 1.00 16.37 C ATOM 397 HA PRO A 22 -7.189 34.871 72.027 1.00 0.00 H ATOM 398 HD3 PRO A 22 -3.357 34.020 71.506 1.00 0.00 H ATOM 399 HD2 PRO A 22 -3.806 35.238 70.289 1.00 0.00 H ATOM 400 HG3 PRO A 22 -5.677 33.989 69.550 1.00 0.00 H ATOM 401 HG2 PRO A 22 -4.538 32.682 69.947 1.00 0.00 H ATOM 402 HB2 PRO A 22 -5.526 32.317 72.099 1.00 0.00 H ATOM 403 HB3 PRO A 22 -6.950 32.671 71.094 1.00 0.00 H ATOM 404 N THR A 23 -5.360 34.125 74.556 1.00 19.52 N ATOM 405 CA THR A 23 -5.442 33.790 75.978 1.00 17.69 C ATOM 406 C THR A 23 -5.178 34.920 76.962 1.00 20.63 C ATOM 407 O THR A 23 -5.440 34.761 78.161 1.00 21.42 O ATOM 408 CB THR A 23 -4.440 32.682 76.338 1.00 16.32 C ATOM 409 OG1 THR A 23 -3.119 33.083 75.935 1.00 21.00 O ATOM 410 CG2 THR A 23 -4.819 31.368 75.647 1.00 18.69 C ATOM 411 HA THR A 23 -6.485 33.493 76.085 1.00 0.00 H ATOM 412 HB THR A 23 -4.461 32.523 77.416 1.00 0.00 H ATOM 413 HG1 THR A 23 -2.474 32.369 76.167 1.00 0.00 H ATOM 414 HG23 THR A 23 -5.821 31.071 75.958 1.00 0.00 H ATOM 415 HG21 THR A 23 -4.799 31.508 74.566 1.00 0.00 H ATOM 416 HG22 THR A 23 -4.106 30.593 75.927 1.00 0.00 H ATOM 417 H THR A 23 -4.450 34.422 74.149 1.00 0.00 H ATOM 418 N VAL A 24 -4.638 36.035 76.482 1.00 17.55 N ATOM 419 CA VAL A 24 -4.238 37.115 77.378 1.00 15.40 C ATOM 420 C VAL A 24 -5.124 38.348 77.236 1.00 17.58 C ATOM 421 O VAL A 24 -5.269 38.886 76.137 1.00 16.25 O ATOM 422 CB VAL A 24 -2.790 37.532 77.128 1.00 16.32 C ATOM 423 CG1 VAL A 24 -2.414 38.698 78.018 1.00 15.30 C ATOM 424 CG2 VAL A 24 -1.849 36.339 77.373 1.00 17.31 C ATOM 425 HA VAL A 24 -4.346 36.719 78.388 1.00 0.00 H ATOM 426 HB VAL A 24 -2.689 37.849 76.090 1.00 0.00 H ATOM 427 HG11 VAL A 24 -3.069 39.543 77.804 1.00 0.00 H ATOM 428 HG12 VAL A 24 -2.524 38.407 79.062 1.00 0.00 H ATOM 429 HG13 VAL A 24 -1.379 38.981 77.826 1.00 0.00 H ATOM 430 HG21 VAL A 24 -1.953 36.002 78.404 1.00 0.00 H ATOM 431 HG22 VAL A 24 -2.111 35.526 76.696 1.00 0.00 H ATOM 432 HG23 VAL A 24 -0.819 36.647 77.192 1.00 0.00 H ATOM 433 H VAL A 24 -4.499 36.139 75.457 1.00 0.00 H ATOM 434 N PHE A 25 -5.690 38.800 78.357 1.00 16.41 N ATOM 435 CA PHE A 25 -6.633 39.931 78.363 1.00 17.33 C ATOM 436 C PHE A 25 -6.093 40.954 79.341 1.00 16.96 C ATOM 437 O PHE A 25 -5.706 40.594 80.461 1.00 17.42 O ATOM 438 CB PHE A 25 -8.003 39.425 78.851 1.00 16.02 C ATOM 439 CG PHE A 25 -9.108 40.452 78.800 1.00 15.48 C ATOM 440 CD1 PHE A 25 -9.654 40.837 77.589 1.00 13.01 C ATOM 441 CD2 PHE A 25 -9.651 40.982 79.971 1.00 17.49 C ATOM 442 CE1 PHE A 25 -10.701 41.780 77.529 1.00 17.89 C ATOM 443 CE2 PHE A 25 -10.692 41.910 79.922 1.00 16.68 C ATOM 444 CZ PHE A 25 -11.225 42.294 78.712 1.00 17.36 C ATOM 445 HA PHE A 25 -6.744 40.367 77.370 1.00 0.00 H ATOM 446 HB2 PHE A 25 -8.295 38.580 78.228 1.00 0.00 H ATOM 447 HB3 PHE A 25 -7.895 39.093 79.884 1.00 0.00 H ATOM 448 HD2 PHE A 25 -9.257 40.667 80.937 1.00 0.00 H ATOM 449 HE2 PHE A 25 -11.085 42.333 80.846 1.00 0.00 H ATOM 450 HZ PHE A 25 -12.056 42.999 78.680 1.00 0.00 H ATOM 451 HE1 PHE A 25 -11.096 42.103 76.566 1.00 0.00 H ATOM 452 HD1 PHE A 25 -9.269 40.404 76.666 1.00 0.00 H ATOM 453 H PHE A 25 -5.457 38.337 79.258 1.00 0.00 H ATOM 454 N ILE A 26 -6.054 42.222 78.944 1.00 12.55 N ATOM 455 CA ILE A 26 -5.568 43.255 79.859 1.00 13.19 C ATOM 456 C ILE A 26 -6.617 44.333 80.102 1.00 13.06 C ATOM 457 O ILE A 26 -7.454 44.596 79.232 1.00 15.75 O ATOM 458 CB ILE A 26 -4.239 43.916 79.369 1.00 17.14 C ATOM 459 CG1 ILE A 26 -4.426 44.609 78.008 1.00 13.76 C ATOM 460 CG2 ILE A 26 -3.128 42.887 79.293 1.00 17.37 C ATOM 461 CD1 ILE A 26 -3.184 45.389 77.558 1.00 13.38 C ATOM 462 HA ILE A 26 -5.362 42.743 80.799 1.00 0.00 H ATOM 463 HB ILE A 26 -3.959 44.678 80.096 1.00 0.00 H ATOM 464 HG12 ILE A 26 -4.650 43.850 77.259 1.00 0.00 H ATOM 465 HG13 ILE A 26 -5.264 45.302 78.083 1.00 0.00 H ATOM 466 HD11 ILE A 26 -2.954 46.159 78.294 1.00 0.00 H ATOM 467 HD12 ILE A 26 -2.340 44.705 77.469 1.00 0.00 H ATOM 468 HD13 ILE A 26 -3.379 45.855 76.592 1.00 0.00 H ATOM 469 HG21 ILE A 26 -2.966 42.456 80.281 1.00 0.00 H ATOM 470 HG22 ILE A 26 -3.411 42.100 78.594 1.00 0.00 H ATOM 471 HG23 ILE A 26 -2.212 43.368 78.950 1.00 0.00 H ATOM 472 H ILE A 26 -6.368 42.479 77.986 1.00 0.00 H ATOM 473 N THR A 27 -6.567 44.960 81.277 1.00 13.88 N ATOM 474 CA THR A 27 -7.517 46.006 81.598 1.00 15.68 C ATOM 475 C THR A 27 -6.958 46.815 82.759 1.00 16.93 C ATOM 476 O THR A 27 -5.857 46.534 83.245 1.00 15.52 O ATOM 477 CB THR A 27 -8.908 45.404 81.918 1.00 18.40 C ATOM 478 OG1 THR A 27 -9.875 46.444 82.127 1.00 16.89 O ATOM 479 CG2 THR A 27 -8.821 44.522 83.177 1.00 21.89 C ATOM 480 HA THR A 27 -7.660 46.667 80.743 1.00 0.00 H ATOM 481 HB THR A 27 -9.223 44.798 81.069 1.00 0.00 H ATOM 482 HG1 THR A 27 -9.946 46.997 81.309 1.00 0.00 H ATOM 483 HG23 THR A 27 -8.086 43.733 83.016 1.00 0.00 H ATOM 484 HG21 THR A 27 -8.519 45.134 84.027 1.00 0.00 H ATOM 485 HG22 THR A 27 -9.796 44.077 83.376 1.00 0.00 H ATOM 486 H THR A 27 -5.839 44.696 81.971 1.00 0.00 H ATOM 487 N THR A 28 -7.716 47.825 83.181 1.00 14.35 N ATOM 488 CA THR A 28 -7.326 48.681 84.291 1.00 16.68 C ATOM 489 C THR A 28 -7.960 48.119 85.577 1.00 19.93 C ATOM 490 O THR A 28 -9.155 47.805 85.615 1.00 18.14 O ATOM 491 CB THR A 28 -7.787 50.131 84.021 1.00 19.05 C ATOM 492 OG1 THR A 28 -7.216 50.568 82.781 1.00 20.24 O ATOM 493 CG2 THR A 28 -7.297 51.069 85.106 1.00 21.63 C ATOM 494 HA THR A 28 -6.242 48.698 84.405 1.00 0.00 H ATOM 495 HB THR A 28 -8.877 50.147 83.994 1.00 0.00 H ATOM 496 HG1 THR A 28 -7.504 51.497 82.596 1.00 0.00 H ATOM 497 HG23 THR A 28 -7.715 50.763 86.065 1.00 0.00 H ATOM 498 HG21 THR A 28 -6.209 51.031 85.153 1.00 0.00 H ATOM 499 HG22 THR A 28 -7.616 52.086 84.877 1.00 0.00 H ATOM 500 H THR A 28 -8.620 48.009 82.700 1.00 0.00 H ATOM 501 N THR A 29 -7.173 48.008 86.644 1.00 19.39 N ATOM 502 CA THR A 29 -7.636 47.274 87.815 1.00 18.88 C ATOM 503 C THR A 29 -8.970 47.754 88.364 1.00 19.19 C ATOM 504 O THR A 29 -9.820 46.940 88.697 1.00 19.94 O ATOM 505 CB THR A 29 -6.573 47.252 88.922 1.00 19.75 C ATOM 506 OG1 THR A 29 -5.357 46.736 88.369 1.00 21.90 O ATOM 507 CG2 THR A 29 -7.018 46.350 90.081 1.00 18.51 C ATOM 508 HA THR A 29 -7.804 46.256 87.462 1.00 0.00 H ATOM 509 HB THR A 29 -6.429 48.263 89.303 1.00 0.00 H ATOM 510 HG1 THR A 29 -4.659 46.715 89.071 1.00 0.00 H ATOM 511 HG23 THR A 29 -7.944 46.738 90.507 1.00 0.00 H ATOM 512 HG21 THR A 29 -7.183 45.338 89.710 1.00 0.00 H ATOM 513 HG22 THR A 29 -6.243 46.336 90.847 1.00 0.00 H ATOM 514 H THR A 29 -6.229 48.444 86.642 1.00 0.00 H ATOM 515 N HIS A 30 -9.164 49.063 88.450 1.00 17.34 N ATOM 516 CA HIS A 30 -10.380 49.565 89.078 1.00 21.39 C ATOM 517 C HIS A 30 -11.675 49.292 88.294 1.00 20.22 C ATOM 518 O HIS A 30 -12.756 49.467 88.852 1.00 21.08 O ATOM 519 CB HIS A 30 -10.263 51.048 89.472 1.00 20.09 C ATOM 520 CG HIS A 30 -10.326 52.004 88.320 1.00 20.74 C ATOM 521 ND1 HIS A 30 -9.197 52.427 87.647 1.00 20.37 N ATOM 522 CD2 HIS A 30 -11.369 52.648 87.749 1.00 21.09 C ATOM 523 CE1 HIS A 30 -9.549 53.278 86.697 1.00 21.26 C ATOM 524 NE2 HIS A 30 -10.860 53.421 86.729 1.00 24.30 N ATOM 525 HA HIS A 30 -10.471 48.976 89.991 1.00 0.00 H ATOM 526 HB2 HIS A 30 -11.078 51.284 90.156 1.00 0.00 H ATOM 527 HB3 HIS A 30 -9.310 51.191 89.982 1.00 0.00 H ATOM 528 HD2 HIS A 30 -12.416 52.570 88.041 1.00 0.00 H ATOM 529 HE1 HIS A 30 -8.870 53.777 86.005 1.00 0.00 H ATOM 530 H HIS A 30 -8.456 49.725 88.073 1.00 0.00 H ATOM 531 N VAL A 31 -11.591 48.851 87.035 1.00 19.75 N ATOM 532 CA VAL A 31 -12.819 48.525 86.303 1.00 19.09 C ATOM 533 C VAL A 31 -13.187 47.049 86.446 1.00 20.89 C ATOM 534 O VAL A 31 -14.299 46.653 86.085 1.00 22.54 O ATOM 535 CB VAL A 31 -12.784 48.903 84.801 1.00 26.84 C ATOM 536 CG1 VAL A 31 -12.220 50.301 84.603 1.00 23.56 C ATOM 537 CG2 VAL A 31 -12.048 47.852 83.979 1.00 23.70 C ATOM 538 HA VAL A 31 -13.586 49.144 86.769 1.00 0.00 H ATOM 539 HB VAL A 31 -13.809 48.921 84.431 1.00 0.00 H ATOM 540 HG11 VAL A 31 -12.845 51.022 85.131 1.00 0.00 H ATOM 541 HG12 VAL A 31 -11.205 50.341 84.998 1.00 0.00 H ATOM 542 HG13 VAL A 31 -12.207 50.539 83.539 1.00 0.00 H ATOM 543 HG21 VAL A 31 -11.022 47.765 84.338 1.00 0.00 H ATOM 544 HG22 VAL A 31 -12.554 46.892 84.083 1.00 0.00 H ATOM 545 HG23 VAL A 31 -12.043 48.150 82.931 1.00 0.00 H ATOM 546 H VAL A 31 -10.663 48.740 86.579 1.00 0.00 H ATOM 547 N VAL A 32 -12.264 46.245 86.972 1.00 17.04 N ATOM 548 CA VAL A 32 -12.522 44.806 87.083 1.00 17.84 C ATOM 549 C VAL A 32 -13.647 44.495 88.075 1.00 20.34 C ATOM 550 O VAL A 32 -13.617 44.950 89.220 1.00 19.62 O ATOM 551 CB VAL A 32 -11.280 44.033 87.527 1.00 17.36 C ATOM 552 CG1 VAL A 32 -11.620 42.562 87.628 1.00 18.87 C ATOM 553 CG2 VAL A 32 -10.116 44.247 86.550 1.00 22.78 C ATOM 554 HA VAL A 32 -12.817 44.489 86.082 1.00 0.00 H ATOM 555 HB VAL A 32 -10.964 44.404 88.502 1.00 0.00 H ATOM 556 HG11 VAL A 32 -12.418 42.424 88.358 1.00 0.00 H ATOM 557 HG12 VAL A 32 -11.949 42.199 86.654 1.00 0.00 H ATOM 558 HG13 VAL A 32 -10.737 42.007 87.944 1.00 0.00 H ATOM 559 HG21 VAL A 32 -10.407 43.900 85.559 1.00 0.00 H ATOM 560 HG22 VAL A 32 -9.870 45.308 86.507 1.00 0.00 H ATOM 561 HG23 VAL A 32 -9.247 43.685 86.893 1.00 0.00 H ATOM 562 H VAL A 32 -11.360 46.638 87.304 1.00 0.00 H ATOM 563 N PRO A 33 -14.638 43.695 87.650 1.00 17.40 N ATOM 564 CA PRO A 33 -15.706 43.332 88.599 1.00 20.20 C ATOM 565 C PRO A 33 -15.171 42.573 89.819 1.00 21.45 C ATOM 566 O PRO A 33 -14.260 41.749 89.673 1.00 25.08 O ATOM 567 CB PRO A 33 -16.607 42.403 87.774 1.00 25.85 C ATOM 568 CG PRO A 33 -16.355 42.783 86.352 1.00 24.56 C ATOM 569 CD PRO A 33 -14.908 43.215 86.282 1.00 20.56 C ATOM 570 HA PRO A 33 -16.208 44.214 88.997 1.00 0.00 H ATOM 571 HD3 PRO A 33 -14.260 42.376 86.026 1.00 0.00 H ATOM 572 HD2 PRO A 33 -14.772 44.013 85.552 1.00 0.00 H ATOM 573 HG3 PRO A 33 -17.009 43.604 86.058 1.00 0.00 H ATOM 574 HG2 PRO A 33 -16.527 41.930 85.696 1.00 0.00 H ATOM 575 HB2 PRO A 33 -16.341 41.360 87.945 1.00 0.00 H ATOM 576 HB3 PRO A 33 -17.655 42.557 88.032 1.00 0.00 H ATOM 577 N THR A 34 -15.697 42.845 91.015 1.00 21.34 N ATOM 578 CA THR A 34 -15.257 42.083 92.178 1.00 17.87 C ATOM 579 C THR A 34 -16.368 41.160 92.659 1.00 22.14 C ATOM 580 O THR A 34 -17.525 41.325 92.298 1.00 22.02 O ATOM 581 CB THR A 34 -14.838 42.983 93.368 1.00 22.74 C ATOM 582 OG1 THR A 34 -15.960 43.765 93.815 1.00 23.93 O ATOM 583 CG2 THR A 34 -13.679 43.907 92.986 1.00 24.78 C ATOM 584 HA THR A 34 -14.386 41.515 91.850 1.00 0.00 H ATOM 585 HB THR A 34 -14.503 42.334 94.177 1.00 0.00 H ATOM 586 HG1 THR A 34 -15.681 44.336 94.575 1.00 0.00 H ATOM 587 HG23 THR A 34 -12.834 43.307 92.649 1.00 0.00 H ATOM 588 HG21 THR A 34 -13.996 44.573 92.184 1.00 0.00 H ATOM 589 HG22 THR A 34 -13.384 44.496 93.854 1.00 0.00 H ATOM 590 H THR A 34 -16.413 43.592 91.117 1.00 0.00 H ATOM 591 N GLY A 35 -16.001 40.189 93.486 1.00 22.75 N ATOM 592 CA GLY A 35 -16.952 39.260 94.061 1.00 22.79 C ATOM 593 C GLY A 35 -17.512 38.259 93.069 1.00 24.90 C ATOM 594 O GLY A 35 -18.600 37.727 93.290 1.00 25.62 O ATOM 595 HA3 GLY A 35 -17.782 39.832 94.477 1.00 0.00 H ATOM 596 HA2 GLY A 35 -16.455 38.710 94.860 1.00 0.00 H ATOM 597 H GLY A 35 -14.995 40.092 93.730 1.00 0.00 H ATOM 598 N VAL A 36 -16.786 38.004 91.984 1.00 21.31 N ATOM 599 CA VAL A 36 -17.259 37.044 90.990 1.00 22.41 C ATOM 600 C VAL A 36 -16.427 35.769 91.028 1.00 24.15 C ATOM 601 O VAL A 36 -15.315 35.767 91.550 1.00 26.84 O ATOM 602 CB VAL A 36 -17.259 37.625 89.562 1.00 27.02 C ATOM 603 CG1 VAL A 36 -18.210 38.817 89.479 1.00 28.53 C ATOM 604 CG2 VAL A 36 -15.840 38.007 89.120 1.00 25.30 C ATOM 605 HA VAL A 36 -18.291 36.810 91.252 1.00 0.00 H ATOM 606 HB VAL A 36 -17.614 36.857 88.875 1.00 0.00 H ATOM 607 HG11 VAL A 36 -19.219 38.493 89.734 1.00 0.00 H ATOM 608 HG12 VAL A 36 -17.887 39.588 90.179 1.00 0.00 H ATOM 609 HG13 VAL A 36 -18.201 39.218 88.465 1.00 0.00 H ATOM 610 HG21 VAL A 36 -15.438 38.757 89.802 1.00 0.00 H ATOM 611 HG22 VAL A 36 -15.205 37.121 89.136 1.00 0.00 H ATOM 612 HG23 VAL A 36 -15.873 38.414 88.109 1.00 0.00 H ATOM 613 H VAL A 36 -15.878 38.490 91.843 1.00 0.00 H ATOM 614 N LYS A 37 -16.972 34.691 90.472 1.00 23.31 N ATOM 615 CA LYS A 37 -16.315 33.388 90.492 1.00 25.14 C ATOM 616 C LYS A 37 -15.737 33.053 89.161 1.00 23.62 C ATOM 617 O LYS A 37 -15.026 32.064 89.022 1.00 27.45 O ATOM 618 CB LYS A 37 -17.319 32.290 90.761 1.00 36.86 C ATOM 619 CG LYS A 37 -18.114 32.465 92.008 1.00 44.07 C ATOM 620 CD LYS A 37 -19.096 31.338 92.075 1.00 48.47 C ATOM 621 CE LYS A 37 -20.143 31.633 93.105 1.00 48.68 C ATOM 622 NZ LYS A 37 -20.698 30.364 93.594 1.00 49.80 N ATOM 623 HA LYS A 37 -15.547 33.450 91.263 1.00 0.00 H ATOM 624 HB2 LYS A 37 -18.011 32.249 89.920 1.00 0.00 H ATOM 625 HB3 LYS A 37 -16.779 31.346 90.832 1.00 0.00 H ATOM 626 HG2 LYS A 37 -17.456 32.438 92.877 1.00 0.00 H ATOM 627 HG3 LYS A 37 -18.642 33.418 91.983 1.00 0.00 H ATOM 628 HD2 LYS A 37 -19.571 31.214 91.102 1.00 0.00 H ATOM 629 HD3 LYS A 37 -18.574 30.419 92.343 1.00 0.00 H ATOM 630 HE2 LYS A 37 -20.937 32.233 92.659 1.00 0.00 H ATOM 631 HE3 LYS A 37 -19.697 32.182 93.934 1.00 0.00 H ATOM 632 HZ1 LYS A 37 -21.122 29.843 92.800 1.00 0.00 H ATOM 633 HZ2 LYS A 37 -19.938 29.795 94.017 1.00 0.00 H ATOM 634 HZ3 LYS A 37 -21.426 30.559 94.310 1.00 0.00 H ATOM 635 H LYS A 37 -17.898 34.779 90.007 1.00 0.00 H ATOM 636 N GLU A 38 -16.062 33.851 88.161 1.00 24.05 N ATOM 637 CA GLU A 38 -15.588 33.539 86.827 1.00 24.23 C ATOM 638 C GLU A 38 -15.455 34.825 86.047 1.00 22.56 C ATOM 639 O GLU A 38 -16.073 35.826 86.397 1.00 23.79 O ATOM 640 CB GLU A 38 -16.594 32.632 86.128 1.00 30.01 C ATOM 641 CG GLU A 38 -17.930 33.326 85.963 1.00 38.32 C ATOM 642 CD GLU A 38 -18.943 32.494 85.224 1.00 54.21 C ATOM 643 OE1 GLU A 38 -18.762 31.255 85.135 1.00 56.15 O ATOM 644 OE2 GLU A 38 -19.929 33.086 84.732 1.00 58.47 O ATOM 645 HA GLU A 38 -14.624 33.033 86.886 1.00 0.00 H ATOM 646 HB2 GLU A 38 -16.208 32.363 85.145 1.00 0.00 H ATOM 647 HB3 GLU A 38 -16.733 31.729 86.722 1.00 0.00 H ATOM 648 HG2 GLU A 38 -18.326 33.556 86.952 1.00 0.00 H ATOM 649 HG3 GLU A 38 -17.773 34.253 85.411 1.00 0.00 H ATOM 650 H GLU A 38 -16.650 34.692 88.328 1.00 0.00 H ATOM 651 N PHE A 39 -14.628 34.791 85.007 1.00 18.02 N ATOM 652 CA PHE A 39 -14.602 35.837 84.006 1.00 16.96 C ATOM 653 C PHE A 39 -14.832 35.204 82.633 1.00 24.98 C ATOM 654 O PHE A 39 -14.265 34.155 82.324 1.00 24.51 O ATOM 655 CB PHE A 39 -13.260 36.570 84.030 1.00 20.33 C ATOM 656 CG PHE A 39 -13.075 37.413 85.247 1.00 24.85 C ATOM 657 CD1 PHE A 39 -13.872 38.528 85.448 1.00 28.76 C ATOM 658 CD2 PHE A 39 -12.142 37.077 86.203 1.00 27.57 C ATOM 659 CE1 PHE A 39 -13.730 39.304 86.567 1.00 25.49 C ATOM 660 CE2 PHE A 39 -11.994 37.862 87.351 1.00 33.58 C ATOM 661 CZ PHE A 39 -12.792 38.973 87.525 1.00 30.12 C ATOM 662 HA PHE A 39 -15.386 36.564 84.217 1.00 0.00 H ATOM 663 HB2 PHE A 39 -12.460 35.831 83.995 1.00 0.00 H ATOM 664 HB3 PHE A 39 -13.199 37.211 83.151 1.00 0.00 H ATOM 665 HD2 PHE A 39 -11.516 36.195 86.064 1.00 0.00 H ATOM 666 HE2 PHE A 39 -11.252 37.597 88.104 1.00 0.00 H ATOM 667 HZ PHE A 39 -12.683 39.589 88.417 1.00 0.00 H ATOM 668 HE1 PHE A 39 -14.358 40.184 86.702 1.00 0.00 H ATOM 669 HD1 PHE A 39 -14.624 38.792 84.704 1.00 0.00 H ATOM 670 H PHE A 39 -13.977 33.986 84.909 1.00 0.00 H ATOM 671 N PHE A 40 -15.667 35.838 81.820 1.00 21.11 N ATOM 672 CA PHE A 40 -16.020 35.290 80.504 1.00 21.04 C ATOM 673 C PHE A 40 -16.392 33.801 80.562 1.00 25.22 C ATOM 674 O PHE A 40 -16.087 33.027 79.641 1.00 27.63 O ATOM 675 CB PHE A 40 -14.887 35.536 79.494 1.00 21.35 C ATOM 676 CG PHE A 40 -14.555 37.002 79.286 1.00 25.00 C ATOM 677 CD1 PHE A 40 -15.469 37.859 78.702 1.00 22.46 C ATOM 678 CD2 PHE A 40 -13.333 37.518 79.682 1.00 23.84 C ATOM 679 CE1 PHE A 40 -15.169 39.199 78.510 1.00 24.62 C ATOM 680 CE2 PHE A 40 -13.033 38.857 79.507 1.00 23.55 C ATOM 681 CZ PHE A 40 -13.946 39.695 78.914 1.00 26.01 C ATOM 682 HA PHE A 40 -16.912 35.819 80.168 1.00 0.00 H ATOM 683 HB2 PHE A 40 -13.991 35.029 79.853 1.00 0.00 H ATOM 684 HB3 PHE A 40 -15.184 35.112 78.535 1.00 0.00 H ATOM 685 HD2 PHE A 40 -12.595 36.859 80.139 1.00 0.00 H ATOM 686 HE2 PHE A 40 -12.071 39.248 79.840 1.00 0.00 H ATOM 687 HZ PHE A 40 -13.705 40.747 78.763 1.00 0.00 H ATOM 688 HE1 PHE A 40 -15.898 39.860 78.041 1.00 0.00 H ATOM 689 HD1 PHE A 40 -16.440 37.476 78.388 1.00 0.00 H ATOM 690 H PHE A 40 -16.081 36.743 82.121 1.00 0.00 H ATOM 691 N GLY A 41 -17.085 33.411 81.631 1.00 25.56 N ATOM 692 CA GLY A 41 -17.545 32.042 81.795 1.00 27.38 C ATOM 693 C GLY A 41 -16.508 31.056 82.311 1.00 29.38 C ATOM 694 O GLY A 41 -16.818 29.895 82.542 1.00 32.30 O ATOM 695 HA3 GLY A 41 -17.892 31.686 80.825 1.00 0.00 H ATOM 696 HA2 GLY A 41 -18.379 32.050 82.497 1.00 0.00 H ATOM 697 H GLY A 41 -17.304 34.108 82.371 1.00 0.00 H ATOM 698 N GLU A 42 -15.278 31.511 82.499 1.00 24.09 N ATOM 699 CA GLU A 42 -14.201 30.647 82.981 1.00 21.42 C ATOM 700 C GLU A 42 -13.972 30.840 84.478 1.00 23.16 C ATOM 701 O GLU A 42 -13.919 31.968 84.945 1.00 22.87 O ATOM 702 CB GLU A 42 -12.913 30.957 82.201 1.00 21.28 C ATOM 703 CG GLU A 42 -12.989 30.581 80.742 1.00 25.94 C ATOM 704 CD GLU A 42 -13.021 29.075 80.562 1.00 37.60 C ATOM 705 OE1 GLU A 42 -12.056 28.412 81.023 1.00 31.87 O ATOM 706 OE2 GLU A 42 -14.012 28.561 79.985 1.00 39.05 O ATOM 707 HA GLU A 42 -14.485 29.607 82.819 1.00 0.00 H ATOM 708 HB2 GLU A 42 -12.715 32.026 82.272 1.00 0.00 H ATOM 709 HB3 GLU A 42 -12.091 30.405 82.658 1.00 0.00 H ATOM 710 HG2 GLU A 42 -13.894 31.010 80.311 1.00 0.00 H ATOM 711 HG3 GLU A 42 -12.117 30.982 80.226 1.00 0.00 H ATOM 712 H GLU A 42 -15.073 32.511 82.298 1.00 0.00 H ATOM 713 N PRO A 43 -13.854 29.732 85.239 1.00 22.40 N ATOM 714 CA PRO A 43 -13.618 29.852 86.684 1.00 24.78 C ATOM 715 C PRO A 43 -12.240 30.434 86.974 1.00 24.88 C ATOM 716 O PRO A 43 -11.320 30.238 86.173 1.00 25.75 O ATOM 717 CB PRO A 43 -13.715 28.403 87.177 1.00 27.62 C ATOM 718 CG PRO A 43 -13.320 27.591 85.962 1.00 27.26 C ATOM 719 CD PRO A 43 -13.920 28.325 84.801 1.00 24.36 C ATOM 720 HA PRO A 43 -14.325 30.522 87.174 1.00 0.00 H ATOM 721 HD3 PRO A 43 -13.338 28.168 83.893 1.00 0.00 H ATOM 722 HD2 PRO A 43 -14.951 28.014 84.629 1.00 0.00 H ATOM 723 HG3 PRO A 43 -13.723 26.580 86.028 1.00 0.00 H ATOM 724 HG2 PRO A 43 -12.235 27.543 85.868 1.00 0.00 H ATOM 725 HB2 PRO A 43 -13.029 28.226 88.005 1.00 0.00 H ATOM 726 HB3 PRO A 43 -14.731 28.165 87.492 1.00 0.00 H ATOM 727 N LEU A 44 -12.108 31.138 88.096 1.00 28.07 N ATOM 728 CA LEU A 44 -10.837 31.746 88.474 1.00 29.53 C ATOM 729 C LEU A 44 -9.689 30.743 88.468 1.00 31.10 C ATOM 730 O LEU A 44 -8.550 31.099 88.156 1.00 32.23 O ATOM 731 CB LEU A 44 -10.927 32.400 89.849 1.00 32.73 C ATOM 732 CG LEU A 44 -12.050 33.419 90.035 1.00 35.01 C ATOM 733 CD1 LEU A 44 -12.091 33.911 91.485 1.00 41.21 C ATOM 734 CD2 LEU A 44 -11.908 34.573 89.061 1.00 35.33 C ATOM 735 HA LEU A 44 -10.628 32.507 87.722 1.00 0.00 H ATOM 736 HB2 LEU A 44 -11.069 31.609 90.586 1.00 0.00 H ATOM 737 HB3 LEU A 44 -9.981 32.907 90.040 1.00 0.00 H ATOM 738 HG LEU A 44 -12.999 32.928 89.819 1.00 0.00 H ATOM 739 HD21 LEU A 44 -10.953 35.072 89.227 1.00 0.00 H ATOM 740 HD22 LEU A 44 -11.948 34.192 88.040 1.00 0.00 H ATOM 741 HD23 LEU A 44 -12.721 35.281 89.218 1.00 0.00 H ATOM 742 HD11 LEU A 44 -12.265 33.065 92.150 1.00 0.00 H ATOM 743 HD12 LEU A 44 -11.140 34.381 91.735 1.00 0.00 H ATOM 744 HD13 LEU A 44 -12.897 34.636 91.599 1.00 0.00 H ATOM 745 H LEU A 44 -12.932 31.258 88.719 1.00 0.00 H ATOM 746 N SER A 45 -9.981 29.493 88.807 1.00 29.74 N ATOM 747 CA SER A 45 -8.914 28.507 88.896 1.00 31.62 C ATOM 748 C SER A 45 -8.344 28.187 87.522 1.00 33.18 C ATOM 749 O SER A 45 -7.357 27.473 87.413 1.00 35.13 O ATOM 750 CB SER A 45 -9.397 27.230 89.578 1.00 33.51 C ATOM 751 OG SER A 45 -10.340 26.570 88.754 1.00 39.27 O ATOM 752 HA SER A 45 -8.121 28.942 89.504 1.00 0.00 H ATOM 753 HB2 SER A 45 -9.863 27.483 90.530 1.00 0.00 H ATOM 754 HB3 SER A 45 -8.547 26.571 89.755 1.00 0.00 H ATOM 755 HG SER A 45 -9.916 26.339 87.890 1.00 0.00 H ATOM 756 H SER A 45 -10.964 29.220 89.007 1.00 0.00 H ATOM 757 N SER A 46 -8.959 28.712 86.469 1.00 28.82 N ATOM 758 CA SER A 46 -8.432 28.466 85.132 1.00 30.92 C ATOM 759 C SER A 46 -7.896 29.757 84.521 1.00 27.06 C ATOM 760 O SER A 46 -7.791 29.878 83.301 1.00 25.02 O ATOM 761 CB SER A 46 -9.502 27.874 84.229 1.00 31.13 C ATOM 762 OG SER A 46 -10.445 28.864 83.876 1.00 36.17 O ATOM 763 HA SER A 46 -7.615 27.750 85.221 1.00 0.00 H ATOM 764 HB2 SER A 46 -10.009 27.064 84.754 1.00 0.00 H ATOM 765 HB3 SER A 46 -9.035 27.483 83.325 1.00 0.00 H ATOM 766 HG SER A 46 -10.872 29.219 84.696 1.00 0.00 H ATOM 767 H SER A 46 -9.811 29.295 86.597 1.00 0.00 H ATOM 768 N ILE A 47 -7.561 30.712 85.385 1.00 24.25 N ATOM 769 CA ILE A 47 -7.059 32.013 84.951 1.00 23.37 C ATOM 770 C ILE A 47 -5.931 32.439 85.871 1.00 28.70 C ATOM 771 O ILE A 47 -6.102 32.461 87.088 1.00 29.63 O ATOM 772 CB ILE A 47 -8.137 33.106 85.029 1.00 21.37 C ATOM 773 CG1 ILE A 47 -9.446 32.632 84.403 1.00 22.01 C ATOM 774 CG2 ILE A 47 -7.645 34.387 84.361 1.00 22.08 C ATOM 775 CD1 ILE A 47 -10.628 33.607 84.629 1.00 24.41 C ATOM 776 HA ILE A 47 -6.733 31.903 83.917 1.00 0.00 H ATOM 777 HB ILE A 47 -8.331 33.319 86.080 1.00 0.00 H ATOM 778 HG12 ILE A 47 -9.294 32.517 83.330 1.00 0.00 H ATOM 779 HG13 ILE A 47 -9.707 31.667 84.837 1.00 0.00 H ATOM 780 HD11 ILE A 47 -10.801 33.724 85.699 1.00 0.00 H ATOM 781 HD12 ILE A 47 -10.388 34.575 84.190 1.00 0.00 H ATOM 782 HD13 ILE A 47 -11.524 33.205 84.157 1.00 0.00 H ATOM 783 HG21 ILE A 47 -6.746 34.737 84.868 1.00 0.00 H ATOM 784 HG22 ILE A 47 -7.418 34.185 83.314 1.00 0.00 H ATOM 785 HG23 ILE A 47 -8.421 35.150 84.426 1.00 0.00 H ATOM 786 H ILE A 47 -7.660 30.526 86.403 1.00 0.00 H ATOM 787 N ALA A 48 -4.788 32.786 85.283 1.00 22.69 N ATOM 788 CA ALA A 48 -3.683 33.345 86.042 1.00 25.49 C ATOM 789 C ALA A 48 -3.833 34.850 86.015 1.00 27.59 C ATOM 790 O ALA A 48 -3.780 35.460 84.948 1.00 26.21 O ATOM 791 CB ALA A 48 -2.367 32.931 85.435 1.00 24.83 C ATOM 792 HA ALA A 48 -3.697 32.980 87.069 1.00 0.00 H ATOM 793 HB1 ALA A 48 -2.291 31.844 85.443 1.00 0.00 H ATOM 794 HB2 ALA A 48 -2.312 33.292 84.408 1.00 0.00 H ATOM 795 HB3 ALA A 48 -1.550 33.358 86.016 1.00 0.00 H ATOM 796 H ALA A 48 -4.684 32.654 84.257 1.00 0.00 H ATOM 797 N ILE A 49 -4.024 35.441 87.191 1.00 29.17 N ATOM 798 CA ILE A 49 -4.273 36.872 87.298 1.00 27.07 C ATOM 799 C ILE A 49 -3.111 37.616 87.965 1.00 28.77 C ATOM 800 O ILE A 49 -2.640 37.225 89.031 1.00 30.68 O ATOM 801 CB ILE A 49 -5.578 37.121 88.074 1.00 29.99 C ATOM 802 CG1 ILE A 49 -6.743 36.439 87.360 1.00 27.90 C ATOM 803 CG2 ILE A 49 -5.850 38.609 88.223 1.00 30.86 C ATOM 804 CD1 ILE A 49 -8.022 36.356 88.173 1.00 32.09 C ATOM 805 HA ILE A 49 -4.368 37.264 86.285 1.00 0.00 H ATOM 806 HB ILE A 49 -5.471 36.698 89.073 1.00 0.00 H ATOM 807 HG12 ILE A 49 -6.956 36.996 86.447 1.00 0.00 H ATOM 808 HG13 ILE A 49 -6.437 35.425 87.102 1.00 0.00 H ATOM 809 HD11 ILE A 49 -7.835 35.790 89.085 1.00 0.00 H ATOM 810 HD12 ILE A 49 -8.354 37.362 88.430 1.00 0.00 H ATOM 811 HD13 ILE A 49 -8.793 35.857 87.586 1.00 0.00 H ATOM 812 HG21 ILE A 49 -5.027 39.075 88.765 1.00 0.00 H ATOM 813 HG22 ILE A 49 -5.939 39.061 87.235 1.00 0.00 H ATOM 814 HG23 ILE A 49 -6.778 38.754 88.775 1.00 0.00 H ATOM 815 H ILE A 49 -3.995 34.866 88.057 1.00 0.00 H ATOM 816 N HIS A 50 -2.625 38.677 87.324 1.00 25.30 N ATOM 817 CA HIS A 50 -1.582 39.529 87.909 1.00 26.75 C ATOM 818 C HIS A 50 -2.061 40.967 87.911 1.00 30.90 C ATOM 819 O HIS A 50 -2.443 41.498 86.877 1.00 34.31 O ATOM 820 CB HIS A 50 -0.281 39.457 87.114 1.00 28.78 C ATOM 821 CG HIS A 50 0.385 38.121 87.152 1.00 41.34 C ATOM 822 ND1 HIS A 50 0.128 37.131 86.228 1.00 47.99 N ATOM 823 CD2 HIS A 50 1.312 37.614 87.999 1.00 50.94 C ATOM 824 CE1 HIS A 50 0.861 36.068 86.507 1.00 50.99 C ATOM 825 NE2 HIS A 50 1.589 36.336 87.577 1.00 55.94 N ATOM 826 HA HIS A 50 -1.390 39.174 88.922 1.00 0.00 H ATOM 827 HB2 HIS A 50 -0.501 39.700 86.075 1.00 0.00 H ATOM 828 HB3 HIS A 50 0.410 40.196 87.520 1.00 0.00 H ATOM 829 HD2 HIS A 50 1.755 38.124 88.855 1.00 0.00 H ATOM 830 HE1 HIS A 50 0.865 35.131 85.950 1.00 0.00 H ATOM 831 H HIS A 50 -2.995 38.909 86.380 1.00 0.00 H ATOM 832 N GLN A 51 -2.035 41.607 89.066 1.00 31.77 N ATOM 833 CA GLN A 51 -2.497 42.980 89.182 1.00 31.11 C ATOM 834 C GLN A 51 -1.456 43.789 89.956 1.00 34.76 C ATOM 835 O GLN A 51 -0.900 43.311 90.940 1.00 37.28 O ATOM 836 CB GLN A 51 -3.819 43.039 89.934 1.00 34.60 C ATOM 837 CG GLN A 51 -4.892 42.089 89.423 1.00 42.76 C ATOM 838 CD GLN A 51 -6.242 42.411 90.014 1.00 47.14 C ATOM 839 OE1 GLN A 51 -7.159 42.835 89.305 1.00 39.92 O ATOM 840 NE2 GLN A 51 -6.369 42.232 91.327 1.00 47.84 N ATOM 841 HA GLN A 51 -2.639 43.389 88.182 1.00 0.00 H ATOM 842 HB2 GLN A 51 -3.625 42.799 90.979 1.00 0.00 H ATOM 843 HB3 GLN A 51 -4.205 44.056 89.861 1.00 0.00 H ATOM 844 HG2 GLN A 51 -4.951 42.172 88.338 1.00 0.00 H ATOM 845 HG3 GLN A 51 -4.621 41.069 89.694 1.00 0.00 H ATOM 846 HE22 GLN A 51 -5.567 41.872 91.883 1.00 0.00 H ATOM 847 HE21 GLN A 51 -7.270 42.452 91.797 1.00 0.00 H ATOM 848 H GLN A 51 -1.676 41.118 89.911 1.00 0.00 H ATOM 849 N ALA A 52 -1.196 45.010 89.494 1.00 32.09 N ATOM 850 CA ALA A 52 -0.243 45.913 90.138 1.00 32.72 C ATOM 851 C ALA A 52 -0.302 47.297 89.514 1.00 28.66 C ATOM 852 O ALA A 52 -0.267 47.424 88.299 1.00 27.55 O ATOM 853 CB ALA A 52 1.166 45.364 90.022 1.00 38.41 C ATOM 854 HA ALA A 52 -0.514 45.991 91.191 1.00 0.00 H ATOM 855 HB1 ALA A 52 1.216 44.389 90.507 1.00 0.00 H ATOM 856 HB2 ALA A 52 1.429 45.261 88.969 1.00 0.00 H ATOM 857 HB3 ALA A 52 1.862 46.048 90.507 1.00 0.00 H ATOM 858 H ALA A 52 -1.691 45.335 88.639 1.00 0.00 H ATOM 859 N GLY A 53 -0.368 48.335 90.342 1.00 27.33 N ATOM 860 CA GLY A 53 -0.282 49.702 89.843 1.00 25.89 C ATOM 861 C GLY A 53 -1.358 50.076 88.828 1.00 27.96 C ATOM 862 O GLY A 53 -1.114 50.880 87.919 1.00 24.72 O ATOM 863 HA3 GLY A 53 0.692 49.831 89.370 1.00 0.00 H ATOM 864 HA2 GLY A 53 -0.365 50.380 90.692 1.00 0.00 H ATOM 865 H GLY A 53 -0.483 48.169 91.362 1.00 0.00 H ATOM 866 N GLU A 54 -2.548 49.502 89.019 1.00 25.66 N ATOM 867 CA GLU A 54 -3.739 49.659 88.163 1.00 24.59 C ATOM 868 C GLU A 54 -3.708 48.914 86.836 1.00 18.61 C ATOM 869 O GLU A 54 -4.595 49.063 86.019 1.00 18.62 O ATOM 870 CB GLU A 54 -4.167 51.121 87.979 1.00 25.86 C ATOM 871 CG GLU A 54 -4.872 51.719 89.184 1.00 30.40 C ATOM 872 CD GLU A 54 -6.184 51.018 89.520 1.00 31.95 C ATOM 873 OE1 GLU A 54 -7.094 51.013 88.662 1.00 27.80 O ATOM 874 OE2 GLU A 54 -6.314 50.473 90.640 1.00 33.76 O ATOM 875 HA GLU A 54 -4.513 49.156 88.743 1.00 0.00 H ATOM 876 HB2 GLU A 54 -3.276 51.715 87.774 1.00 0.00 H ATOM 877 HB3 GLU A 54 -4.843 51.175 87.125 1.00 0.00 H ATOM 878 HG2 GLU A 54 -4.209 51.645 90.046 1.00 0.00 H ATOM 879 HG3 GLU A 54 -5.082 52.768 88.977 1.00 0.00 H ATOM 880 H GLU A 54 -2.645 48.885 89.851 1.00 0.00 H ATOM 881 N PHE A 55 -2.678 48.100 86.629 1.00 20.53 N ATOM 882 CA PHE A 55 -2.630 47.272 85.439 1.00 17.62 C ATOM 883 C PHE A 55 -3.005 45.836 85.817 1.00 19.88 C ATOM 884 O PHE A 55 -2.420 45.260 86.734 1.00 24.50 O ATOM 885 CB PHE A 55 -1.232 47.323 84.804 1.00 19.91 C ATOM 886 CG PHE A 55 -1.176 46.711 83.433 1.00 18.87 C ATOM 887 CD1 PHE A 55 -1.325 47.490 82.301 1.00 16.81 C ATOM 888 CD2 PHE A 55 -0.983 45.349 83.277 1.00 21.28 C ATOM 889 CE1 PHE A 55 -1.270 46.920 81.030 1.00 19.47 C ATOM 890 CE2 PHE A 55 -0.923 44.777 82.020 1.00 22.41 C ATOM 891 CZ PHE A 55 -1.078 45.575 80.884 1.00 19.96 C ATOM 892 HA PHE A 55 -3.341 47.647 84.703 1.00 0.00 H ATOM 893 HB2 PHE A 55 -0.924 48.366 84.730 1.00 0.00 H ATOM 894 HB3 PHE A 55 -0.539 46.786 85.451 1.00 0.00 H ATOM 895 HD2 PHE A 55 -0.877 44.718 84.159 1.00 0.00 H ATOM 896 HE2 PHE A 55 -0.755 43.705 81.915 1.00 0.00 H ATOM 897 HZ PHE A 55 -1.046 45.129 79.890 1.00 0.00 H ATOM 898 HE1 PHE A 55 -1.381 47.551 80.148 1.00 0.00 H ATOM 899 HD1 PHE A 55 -1.487 48.563 82.403 1.00 0.00 H ATOM 900 H PHE A 55 -1.904 48.057 87.322 1.00 0.00 H ATOM 901 N THR A 56 -3.981 45.259 85.121 1.00 18.95 N ATOM 902 CA THR A 56 -4.407 43.883 85.400 1.00 18.73 C ATOM 903 C THR A 56 -4.225 43.034 84.147 1.00 19.01 C ATOM 904 O THR A 56 -4.617 43.441 83.065 1.00 20.36 O ATOM 905 CB THR A 56 -5.889 43.833 85.833 1.00 20.89 C ATOM 906 OG1 THR A 56 -6.027 44.361 87.153 1.00 24.43 O ATOM 907 CG2 THR A 56 -6.434 42.388 85.814 1.00 28.20 C ATOM 908 HA THR A 56 -3.795 43.495 86.214 1.00 0.00 H ATOM 909 HB THR A 56 -6.461 44.432 85.124 1.00 0.00 H ATOM 910 HG1 THR A 56 -5.714 45.300 87.166 1.00 0.00 H ATOM 911 HG23 THR A 56 -6.333 41.976 84.810 1.00 0.00 H ATOM 912 HG21 THR A 56 -5.867 41.778 86.517 1.00 0.00 H ATOM 913 HG22 THR A 56 -7.485 42.394 86.102 1.00 0.00 H ATOM 914 H THR A 56 -4.452 45.794 84.364 1.00 0.00 H ATOM 915 N GLN A 57 -3.619 41.860 84.297 1.00 20.14 N ATOM 916 CA GLN A 57 -3.520 40.923 83.188 1.00 20.22 C ATOM 917 C GLN A 57 -4.147 39.581 83.570 1.00 20.45 C ATOM 918 O GLN A 57 -3.925 39.088 84.677 1.00 21.36 O ATOM 919 CB GLN A 57 -2.059 40.709 82.777 1.00 24.26 C ATOM 920 CG GLN A 57 -1.898 39.676 81.651 1.00 22.39 C ATOM 921 CD GLN A 57 -0.441 39.397 81.303 1.00 31.46 C ATOM 922 OE1 GLN A 57 0.201 40.178 80.601 1.00 28.74 O ATOM 923 NE2 GLN A 57 0.087 38.280 81.800 1.00 30.93 N ATOM 924 HA GLN A 57 -4.061 41.347 82.342 1.00 0.00 H ATOM 925 HB2 GLN A 57 -1.650 41.661 82.437 1.00 0.00 H ATOM 926 HB3 GLN A 57 -1.500 40.365 83.647 1.00 0.00 H ATOM 927 HG2 GLN A 57 -2.365 38.743 81.966 1.00 0.00 H ATOM 928 HG3 GLN A 57 -2.402 40.051 80.760 1.00 0.00 H ATOM 929 HE22 GLN A 57 -0.492 37.648 82.389 1.00 0.00 H ATOM 930 HE21 GLN A 57 1.079 38.039 81.599 1.00 0.00 H ATOM 931 H GLN A 57 -3.210 41.608 85.219 1.00 0.00 H ATOM 932 N PHE A 58 -4.936 39.018 82.658 1.00 19.96 N ATOM 933 CA PHE A 58 -5.538 37.698 82.817 1.00 17.02 C ATOM 934 C PHE A 58 -4.873 36.801 81.789 1.00 22.03 C ATOM 935 O PHE A 58 -4.822 37.163 80.624 1.00 21.25 O ATOM 936 CB PHE A 58 -7.024 37.709 82.436 1.00 20.45 C ATOM 937 CG PHE A 58 -7.929 38.434 83.389 1.00 23.04 C ATOM 938 CD1 PHE A 58 -7.564 38.669 84.701 1.00 27.24 C ATOM 939 CD2 PHE A 58 -9.183 38.842 82.961 1.00 31.36 C ATOM 940 CE1 PHE A 58 -8.428 39.320 85.570 1.00 31.88 C ATOM 941 CE2 PHE A 58 -10.052 39.500 83.822 1.00 34.96 C ATOM 942 CZ PHE A 58 -9.673 39.737 85.126 1.00 28.47 C ATOM 943 HA PHE A 58 -5.420 37.377 83.852 1.00 0.00 H ATOM 944 HB2 PHE A 58 -7.117 38.182 81.458 1.00 0.00 H ATOM 945 HB3 PHE A 58 -7.362 36.675 82.372 1.00 0.00 H ATOM 946 HD2 PHE A 58 -9.491 38.644 81.934 1.00 0.00 H ATOM 947 HE2 PHE A 58 -11.029 39.828 83.468 1.00 0.00 H ATOM 948 HZ PHE A 58 -10.351 40.251 85.807 1.00 0.00 H ATOM 949 HE1 PHE A 58 -8.128 39.503 86.602 1.00 0.00 H ATOM 950 HD1 PHE A 58 -6.588 38.340 85.057 1.00 0.00 H ATOM 951 H PHE A 58 -5.134 39.547 81.785 1.00 0.00 H ATOM 952 N ARG A 59 -4.399 35.631 82.196 1.00 21.34 N ATOM 953 CA ARG A 59 -4.003 34.601 81.232 1.00 22.08 C ATOM 954 C ARG A 59 -4.881 33.373 81.405 1.00 25.94 C ATOM 955 O ARG A 59 -4.771 32.670 82.421 1.00 26.35 O ATOM 956 CB ARG A 59 -2.524 34.195 81.359 1.00 25.04 C ATOM 957 CG ARG A 59 -2.106 33.197 80.279 1.00 24.46 C ATOM 958 CD ARG A 59 -0.661 32.766 80.402 1.00 27.26 C ATOM 959 NE ARG A 59 0.241 33.912 80.340 1.00 36.10 N ATOM 960 CZ ARG A 59 0.814 34.364 79.230 1.00 36.00 C ATOM 961 NH1 ARG A 59 0.596 33.751 78.073 1.00 36.21 N ATOM 962 NH2 ARG A 59 1.616 35.424 79.284 1.00 35.27 N ATOM 963 HA ARG A 59 -4.134 35.030 80.239 1.00 0.00 H ATOM 964 HB2 ARG A 59 -1.905 35.088 81.271 1.00 0.00 H ATOM 965 HB3 ARG A 59 -2.367 33.741 82.337 1.00 0.00 H ATOM 966 HG2 ARG A 59 -2.740 32.314 80.357 1.00 0.00 H ATOM 967 HG3 ARG A 59 -2.249 33.660 79.303 1.00 0.00 H ATOM 968 HD2 ARG A 59 -0.423 32.082 79.587 1.00 0.00 H ATOM 969 HD3 ARG A 59 -0.522 32.256 81.355 1.00 0.00 H ATOM 970 HE ARG A 59 0.450 34.410 81.229 1.00 0.00 H ATOM 971 HH12 ARG A 59 1.045 34.105 77.204 1.00 0.00 H ATOM 972 HH11 ARG A 59 -0.024 32.917 78.035 1.00 0.00 H ATOM 973 HH22 ARG A 59 2.066 35.780 78.417 1.00 0.00 H ATOM 974 HH21 ARG A 59 1.793 35.896 80.193 1.00 0.00 H ATOM 975 H ARG A 59 -4.307 35.442 83.215 1.00 0.00 H ATOM 976 N PHE A 60 -5.737 33.126 80.413 1.00 19.37 N ATOM 977 CA PHE A 60 -6.660 31.994 80.431 1.00 23.57 C ATOM 978 C PHE A 60 -5.966 30.716 79.976 1.00 23.50 C ATOM 979 O PHE A 60 -5.140 30.746 79.066 1.00 24.07 O ATOM 980 CB PHE A 60 -7.878 32.294 79.540 1.00 19.40 C ATOM 981 CG PHE A 60 -8.734 33.438 80.046 1.00 17.58 C ATOM 982 CD1 PHE A 60 -9.891 33.203 80.772 1.00 16.25 C ATOM 983 CD2 PHE A 60 -8.351 34.752 79.825 1.00 18.56 C ATOM 984 CE1 PHE A 60 -10.668 34.252 81.246 1.00 19.29 C ATOM 985 CE2 PHE A 60 -9.113 35.811 80.304 1.00 17.39 C ATOM 986 CZ PHE A 60 -10.275 35.559 81.023 1.00 17.34 C ATOM 987 HA PHE A 60 -7.000 31.843 81.455 1.00 0.00 H ATOM 988 HB2 PHE A 60 -7.521 32.546 78.541 1.00 0.00 H ATOM 989 HB3 PHE A 60 -8.496 31.398 79.488 1.00 0.00 H ATOM 990 HD2 PHE A 60 -7.438 34.958 79.267 1.00 0.00 H ATOM 991 HE2 PHE A 60 -8.800 36.838 80.116 1.00 0.00 H ATOM 992 HZ PHE A 60 -10.872 36.385 81.408 1.00 0.00 H ATOM 993 HE1 PHE A 60 -11.587 34.045 81.794 1.00 0.00 H ATOM 994 HD1 PHE A 60 -10.197 32.177 80.975 1.00 0.00 H ATOM 995 H PHE A 60 -5.748 33.765 79.593 1.00 0.00 H ATOM 996 N SER A 61 -6.257 29.603 80.653 1.00 26.52 N ATOM 997 CA SER A 61 -5.802 28.288 80.212 1.00 31.31 C ATOM 998 C SER A 61 -6.383 27.960 78.841 1.00 28.88 C ATOM 999 O SER A 61 -5.711 27.395 77.975 1.00 31.52 O ATOM 1000 CB SER A 61 -6.252 27.219 81.210 1.00 28.09 C ATOM 1001 OG SER A 61 -5.666 27.463 82.466 1.00 41.41 O ATOM 1002 HA SER A 61 -4.714 28.302 80.151 1.00 0.00 H ATOM 1003 HB2 SER A 61 -5.945 26.237 80.852 1.00 0.00 H ATOM 1004 HB3 SER A 61 -7.337 27.246 81.305 1.00 0.00 H ATOM 1005 HG SER A 61 -5.946 28.355 82.792 1.00 0.00 H ATOM 1006 H SER A 61 -6.825 29.675 81.521 1.00 0.00 H ATOM 1007 N LYS A 62 -7.649 28.319 78.671 1.00 26.04 N ATOM 1008 CA LYS A 62 -8.430 28.050 77.464 1.00 24.25 C ATOM 1009 C LYS A 62 -8.277 29.181 76.455 1.00 23.35 C ATOM 1010 O LYS A 62 -8.260 30.343 76.837 1.00 22.46 O ATOM 1011 CB LYS A 62 -9.898 27.977 77.877 1.00 31.16 C ATOM 1012 CG LYS A 62 -10.876 27.638 76.791 1.00 34.89 C ATOM 1013 CD LYS A 62 -12.284 27.958 77.248 1.00 40.34 C ATOM 1014 CE LYS A 62 -13.236 26.837 76.942 1.00 48.83 C ATOM 1015 NZ LYS A 62 -14.095 26.547 78.133 1.00 53.78 N ATOM 1016 HA LYS A 62 -8.085 27.123 77.007 1.00 0.00 H ATOM 1017 HB2 LYS A 62 -9.988 27.218 78.654 1.00 0.00 H ATOM 1018 HB3 LYS A 62 -10.178 28.948 78.285 1.00 0.00 H ATOM 1019 HG2 LYS A 62 -10.644 28.221 75.900 1.00 0.00 H ATOM 1020 HG3 LYS A 62 -10.804 26.576 76.558 1.00 0.00 H ATOM 1021 HD2 LYS A 62 -12.276 28.131 78.324 1.00 0.00 H ATOM 1022 HD3 LYS A 62 -12.624 28.860 76.739 1.00 0.00 H ATOM 1023 HE2 LYS A 62 -12.669 25.944 76.681 1.00 0.00 H ATOM 1024 HE3 LYS A 62 -13.869 27.122 76.102 1.00 0.00 H ATOM 1025 HZ1 LYS A 62 -13.492 26.273 78.935 1.00 0.00 H ATOM 1026 HZ2 LYS A 62 -14.639 27.398 78.382 1.00 0.00 H ATOM 1027 HZ3 LYS A 62 -14.748 25.770 77.907 1.00 0.00 H ATOM 1028 H LYS A 62 -8.118 28.826 79.449 1.00 0.00 H ATOM 1029 N LYS A 63 -8.158 28.865 75.168 1.00 22.37 N ATOM 1030 CA LYS A 63 -8.133 29.941 74.178 1.00 21.75 C ATOM 1031 C LYS A 63 -9.524 30.574 74.108 1.00 22.47 C ATOM 1032 O LYS A 63 -10.521 29.896 73.812 1.00 23.30 O ATOM 1033 CB LYS A 63 -7.741 29.429 72.797 1.00 22.50 C ATOM 1034 CG LYS A 63 -6.392 28.725 72.714 1.00 27.66 C ATOM 1035 CD LYS A 63 -5.890 28.805 71.279 1.00 32.54 C ATOM 1036 CE LYS A 63 -4.594 28.014 71.032 1.00 41.13 C ATOM 1037 NZ LYS A 63 -4.560 26.667 71.666 1.00 44.18 N ATOM 1038 HA LYS A 63 -7.387 30.674 74.484 1.00 0.00 H ATOM 1039 HB2 LYS A 63 -8.507 28.726 72.470 1.00 0.00 H ATOM 1040 HB3 LYS A 63 -7.717 30.281 72.117 1.00 0.00 H ATOM 1041 HG2 LYS A 63 -5.681 29.214 73.380 1.00 0.00 H ATOM 1042 HG3 LYS A 63 -6.504 27.681 73.007 1.00 0.00 H ATOM 1043 HD2 LYS A 63 -6.664 28.411 70.621 1.00 0.00 H ATOM 1044 HD3 LYS A 63 -5.706 29.852 71.036 1.00 0.00 H ATOM 1045 HE2 LYS A 63 -3.760 28.596 71.424 1.00 0.00 H ATOM 1046 HE3 LYS A 63 -4.473 27.887 69.956 1.00 0.00 H ATOM 1047 HZ1 LYS A 63 -4.661 26.767 72.696 1.00 0.00 H ATOM 1048 HZ2 LYS A 63 -5.342 26.090 71.294 1.00 0.00 H ATOM 1049 HZ3 LYS A 63 -3.654 26.206 71.449 1.00 0.00 H ATOM 1050 H LYS A 63 -8.084 27.871 74.872 1.00 0.00 H ATOM 1051 N MET A 64 -9.604 31.866 74.415 1.00 15.74 N ATOM 1052 CA MET A 64 -10.889 32.561 74.447 1.00 15.51 C ATOM 1053 C MET A 64 -11.164 33.312 73.133 1.00 17.98 C ATOM 1054 O MET A 64 -12.326 33.472 72.723 1.00 16.87 O ATOM 1055 CB MET A 64 -10.899 33.570 75.596 1.00 19.61 C ATOM 1056 CG MET A 64 -10.585 32.960 76.957 1.00 21.17 C ATOM 1057 SD MET A 64 -11.691 31.611 77.434 1.00 27.78 S ATOM 1058 CE MET A 64 -13.223 32.560 77.668 1.00 30.14 C ATOM 1059 HA MET A 64 -11.665 31.809 74.587 1.00 0.00 H ATOM 1060 HB2 MET A 64 -10.156 34.339 75.384 1.00 0.00 H ATOM 1061 HB3 MET A 64 -11.888 34.026 75.644 1.00 0.00 H ATOM 1062 HG2 MET A 64 -10.658 33.745 77.709 1.00 0.00 H ATOM 1063 HG3 MET A 64 -9.566 32.575 76.933 1.00 0.00 H ATOM 1064 HE1 MET A 64 -13.069 33.311 78.443 1.00 0.00 H ATOM 1065 HE2 MET A 64 -13.491 33.052 76.733 1.00 0.00 H ATOM 1066 HE3 MET A 64 -14.025 31.885 77.968 1.00 0.00 H ATOM 1067 H MET A 64 -8.735 32.392 74.637 1.00 0.00 H ATOM 1068 N ARG A 65 -10.102 33.769 72.478 1.00 16.19 N ATOM 1069 CA ARG A 65 -10.249 34.462 71.195 1.00 12.65 C ATOM 1070 C ARG A 65 -9.272 33.870 70.172 1.00 13.64 C ATOM 1071 O ARG A 65 -8.319 34.537 69.758 1.00 17.10 O ATOM 1072 CB ARG A 65 -10.046 35.974 71.344 1.00 15.37 C ATOM 1073 CG ARG A 65 -11.202 36.687 72.065 1.00 13.85 C ATOM 1074 CD ARG A 65 -12.483 36.749 71.182 1.00 12.47 C ATOM 1075 NE ARG A 65 -12.170 37.412 69.923 1.00 13.83 N ATOM 1076 CZ ARG A 65 -12.207 38.729 69.721 1.00 15.64 C ATOM 1077 NH1 ARG A 65 -12.644 39.557 70.679 1.00 15.46 N ATOM 1078 NH2 ARG A 65 -11.819 39.211 68.547 1.00 14.01 N ATOM 1079 HA ARG A 65 -11.268 34.313 70.837 1.00 0.00 H ATOM 1080 HB2 ARG A 65 -9.130 36.144 71.910 1.00 0.00 H ATOM 1081 HB3 ARG A 65 -9.942 36.407 70.349 1.00 0.00 H ATOM 1082 HG2 ARG A 65 -11.432 36.147 72.984 1.00 0.00 H ATOM 1083 HG3 ARG A 65 -10.892 37.703 72.310 1.00 0.00 H ATOM 1084 HD2 ARG A 65 -13.259 37.308 71.705 1.00 0.00 H ATOM 1085 HD3 ARG A 65 -12.837 35.738 70.983 1.00 0.00 H ATOM 1086 HE ARG A 65 -11.896 36.811 69.119 1.00 0.00 H ATOM 1087 HH12 ARG A 65 -12.668 40.583 70.509 1.00 0.00 H ATOM 1088 HH11 ARG A 65 -12.959 39.174 71.593 1.00 0.00 H ATOM 1089 HH22 ARG A 65 -11.842 40.236 68.373 1.00 0.00 H ATOM 1090 HH21 ARG A 65 -11.492 38.564 67.801 1.00 0.00 H ATOM 1091 H ARG A 65 -9.153 33.633 72.881 1.00 0.00 H ATOM 1092 N PRO A 66 -9.490 32.625 69.767 1.00 14.75 N ATOM 1093 CA PRO A 66 -8.600 31.949 68.816 1.00 15.96 C ATOM 1094 C PRO A 66 -8.645 32.526 67.391 1.00 16.92 C ATOM 1095 O PRO A 66 -7.829 32.129 66.543 1.00 20.28 O ATOM 1096 CB PRO A 66 -9.084 30.492 68.821 1.00 17.18 C ATOM 1097 CG PRO A 66 -10.518 30.558 69.311 1.00 16.65 C ATOM 1098 CD PRO A 66 -10.496 31.685 70.331 1.00 18.23 C ATOM 1099 HA PRO A 66 -7.560 32.073 69.117 1.00 0.00 H ATOM 1100 HD3 PRO A 66 -11.474 32.159 70.413 1.00 0.00 H ATOM 1101 HD2 PRO A 66 -10.187 31.321 71.311 1.00 0.00 H ATOM 1102 HG3 PRO A 66 -10.814 29.618 69.776 1.00 0.00 H ATOM 1103 HG2 PRO A 66 -11.199 30.787 68.492 1.00 0.00 H ATOM 1104 HB2 PRO A 66 -9.041 30.070 67.817 1.00 0.00 H ATOM 1105 HB3 PRO A 66 -8.476 29.888 69.494 1.00 0.00 H ATOM 1106 N ASP A 67 -9.564 33.450 67.138 1.00 19.39 N ATOM 1107 CA ASP A 67 -9.582 34.225 65.904 1.00 16.51 C ATOM 1108 C ASP A 67 -8.421 35.252 65.842 1.00 17.99 C ATOM 1109 O ASP A 67 -8.110 35.759 64.768 1.00 23.74 O ATOM 1110 CB ASP A 67 -10.933 34.936 65.790 1.00 17.96 C ATOM 1111 CG ASP A 67 -11.164 35.918 66.925 1.00 19.93 C ATOM 1112 OD1 ASP A 67 -11.318 35.462 68.082 1.00 18.48 O ATOM 1113 OD2 ASP A 67 -11.136 37.141 66.661 1.00 18.21 O ATOM 1114 HA ASP A 67 -9.443 33.544 65.065 1.00 0.00 H ATOM 1115 HB2 ASP A 67 -10.966 35.478 64.845 1.00 0.00 H ATOM 1116 HB3 ASP A 67 -11.726 34.188 65.806 1.00 0.00 H ATOM 1117 H ASP A 67 -10.301 33.628 67.850 1.00 0.00 H ATOM 1118 N LEU A 68 -7.802 35.558 66.983 1.00 15.84 N ATOM 1119 CA LEU A 68 -6.745 36.575 67.034 1.00 15.55 C ATOM 1120 C LEU A 68 -5.325 36.012 66.954 1.00 20.41 C ATOM 1121 O LEU A 68 -5.048 34.913 67.459 1.00 21.42 O ATOM 1122 CB LEU A 68 -6.812 37.351 68.349 1.00 16.02 C ATOM 1123 CG LEU A 68 -8.130 38.050 68.601 1.00 16.97 C ATOM 1124 CD1 LEU A 68 -8.141 38.680 69.982 1.00 14.19 C ATOM 1125 CD2 LEU A 68 -8.322 39.086 67.485 1.00 15.22 C ATOM 1126 HA LEU A 68 -6.931 37.200 66.160 1.00 0.00 H ATOM 1127 HB2 LEU A 68 -6.636 36.652 69.166 1.00 0.00 H ATOM 1128 HB3 LEU A 68 -6.024 38.104 68.341 1.00 0.00 H ATOM 1129 HG LEU A 68 -8.960 37.344 68.583 1.00 0.00 H ATOM 1130 HD21 LEU A 68 -7.500 39.801 67.509 1.00 0.00 H ATOM 1131 HD22 LEU A 68 -8.337 38.580 66.520 1.00 0.00 H ATOM 1132 HD23 LEU A 68 -9.266 39.610 67.636 1.00 0.00 H ATOM 1133 HD11 LEU A 68 -8.001 37.904 70.735 1.00 0.00 H ATOM 1134 HD12 LEU A 68 -7.333 39.408 70.054 1.00 0.00 H ATOM 1135 HD13 LEU A 68 -9.097 39.178 70.145 1.00 0.00 H ATOM 1136 H LEU A 68 -8.075 35.065 67.857 1.00 0.00 H ATOM 1137 N THR A 69 -4.412 36.800 66.390 1.00 22.19 N ATOM 1138 CA THR A 69 -2.993 36.530 66.559 1.00 23.91 C ATOM 1139 C THR A 69 -2.492 37.189 67.851 1.00 23.93 C ATOM 1140 O THR A 69 -3.129 38.103 68.399 1.00 20.53 O ATOM 1141 CB THR A 69 -2.185 37.050 65.361 1.00 31.35 C ATOM 1142 OG1 THR A 69 -2.304 38.479 65.295 1.00 32.06 O ATOM 1143 CG2 THR A 69 -2.707 36.432 64.062 1.00 27.56 C ATOM 1144 HA THR A 69 -2.854 35.451 66.620 1.00 0.00 H ATOM 1145 HB THR A 69 -1.139 36.771 65.487 1.00 0.00 H ATOM 1146 HG1 THR A 69 -3.257 38.725 65.186 1.00 0.00 H ATOM 1147 HG23 THR A 69 -2.615 35.347 64.115 1.00 0.00 H ATOM 1148 HG21 THR A 69 -3.754 36.703 63.927 1.00 0.00 H ATOM 1149 HG22 THR A 69 -2.122 36.807 63.222 1.00 0.00 H ATOM 1150 H THR A 69 -4.717 37.617 65.823 1.00 0.00 H ATOM 1151 N GLY A 70 -1.361 36.716 68.353 1.00 21.18 N ATOM 1152 CA GLY A 70 -0.743 37.351 69.510 1.00 20.70 C ATOM 1153 C GLY A 70 -0.047 38.641 69.102 1.00 25.29 C ATOM 1154 O GLY A 70 0.620 38.698 68.064 1.00 31.89 O ATOM 1155 HA3 GLY A 70 -0.011 36.670 69.945 1.00 0.00 H ATOM 1156 HA2 GLY A 70 -1.512 37.576 70.249 1.00 0.00 H ATOM 1157 H GLY A 70 -0.911 35.885 67.918 1.00 0.00 H ATOM 1158 N MET A 71 -0.216 39.674 69.921 1.00 17.07 N ATOM 1159 CA MET A 71 0.396 40.983 69.727 1.00 24.15 C ATOM 1160 C MET A 71 1.464 41.196 70.786 1.00 22.27 C ATOM 1161 O MET A 71 1.390 40.643 71.874 1.00 22.34 O ATOM 1162 CB MET A 71 -0.647 42.065 69.995 1.00 21.25 C ATOM 1163 CG MET A 71 -1.450 42.440 68.816 1.00 27.85 C ATOM 1164 SD MET A 71 -2.638 43.631 69.429 1.00 21.26 S ATOM 1165 CE MET A 71 -1.621 45.099 69.656 1.00 16.57 C ATOM 1166 HA MET A 71 0.798 41.032 68.715 1.00 0.00 H ATOM 1167 HB2 MET A 71 -1.324 41.702 70.768 1.00 0.00 H ATOM 1168 HB3 MET A 71 -0.131 42.955 70.354 1.00 0.00 H ATOM 1169 HG2 MET A 71 -1.958 41.568 68.404 1.00 0.00 H ATOM 1170 HG3 MET A 71 -0.819 42.887 68.048 1.00 0.00 H ATOM 1171 HE1 MET A 71 -0.827 44.882 70.371 1.00 0.00 H ATOM 1172 HE2 MET A 71 -1.183 45.387 68.700 1.00 0.00 H ATOM 1173 HE3 MET A 71 -2.240 45.913 70.034 1.00 0.00 H ATOM 1174 H MET A 71 -0.824 39.540 70.754 1.00 0.00 H ATOM 1175 N VAL A 72 2.429 42.060 70.495 1.00 19.56 N ATOM 1176 CA VAL A 72 3.402 42.472 71.496 1.00 18.07 C ATOM 1177 C VAL A 72 2.783 43.484 72.448 1.00 20.89 C ATOM 1178 O VAL A 72 2.149 44.459 72.012 1.00 19.62 O ATOM 1179 CB VAL A 72 4.642 43.079 70.843 1.00 21.68 C ATOM 1180 CG1 VAL A 72 5.547 43.717 71.916 1.00 26.42 C ATOM 1181 CG2 VAL A 72 5.394 41.995 70.062 1.00 26.88 C ATOM 1182 HA VAL A 72 3.702 41.584 72.053 1.00 0.00 H ATOM 1183 HB VAL A 72 4.341 43.862 70.147 1.00 0.00 H ATOM 1184 HG11 VAL A 72 4.995 44.501 72.435 1.00 0.00 H ATOM 1185 HG12 VAL A 72 5.855 42.953 72.630 1.00 0.00 H ATOM 1186 HG13 VAL A 72 6.428 44.146 71.438 1.00 0.00 H ATOM 1187 HG21 VAL A 72 5.695 41.200 70.744 1.00 0.00 H ATOM 1188 HG22 VAL A 72 4.741 41.586 69.291 1.00 0.00 H ATOM 1189 HG23 VAL A 72 6.278 42.431 69.597 1.00 0.00 H ATOM 1190 H VAL A 72 2.491 42.450 69.533 1.00 0.00 H ATOM 1191 N LEU A 73 2.932 43.196 73.739 1.00 17.87 N ATOM 1192 CA LEU A 73 2.598 44.117 74.808 1.00 23.82 C ATOM 1193 C LEU A 73 3.921 44.666 75.325 1.00 21.67 C ATOM 1194 O LEU A 73 4.790 43.915 75.798 1.00 24.20 O ATOM 1195 CB LEU A 73 1.835 43.396 75.930 1.00 18.55 C ATOM 1196 CG LEU A 73 1.651 44.080 77.302 1.00 27.23 C ATOM 1197 CD1 LEU A 73 0.869 45.385 77.201 1.00 20.65 C ATOM 1198 CD2 LEU A 73 0.962 43.153 78.289 1.00 23.86 C ATOM 1199 HA LEU A 73 1.950 44.917 74.450 1.00 0.00 H ATOM 1200 HB2 LEU A 73 0.837 43.185 75.547 1.00 0.00 H ATOM 1201 HB3 LEU A 73 2.358 42.457 76.114 1.00 0.00 H ATOM 1202 HG LEU A 73 2.653 44.313 77.663 1.00 0.00 H ATOM 1203 HD21 LEU A 73 -0.019 42.877 77.902 1.00 0.00 H ATOM 1204 HD22 LEU A 73 1.566 42.256 78.425 1.00 0.00 H ATOM 1205 HD23 LEU A 73 0.847 43.663 79.245 1.00 0.00 H ATOM 1206 HD11 LEU A 73 1.402 46.077 76.548 1.00 0.00 H ATOM 1207 HD12 LEU A 73 -0.120 45.184 76.789 1.00 0.00 H ATOM 1208 HD13 LEU A 73 0.768 45.825 78.193 1.00 0.00 H ATOM 1209 H LEU A 73 3.308 42.261 73.995 1.00 0.00 H ATOM 1210 N GLU A 74 4.106 45.977 75.180 1.00 19.98 N ATOM 1211 CA GLU A 74 5.309 46.656 75.671 1.00 23.38 C ATOM 1212 C GLU A 74 5.003 47.386 76.959 1.00 25.02 C ATOM 1213 O GLU A 74 3.853 47.751 77.204 1.00 23.74 O ATOM 1214 CB GLU A 74 5.750 47.725 74.685 1.00 29.32 C ATOM 1215 CG GLU A 74 6.719 47.293 73.636 1.00 44.22 C ATOM 1216 CD GLU A 74 6.768 48.332 72.549 1.00 54.02 C ATOM 1217 OE1 GLU A 74 6.371 49.505 72.793 1.00 57.01 O ATOM 1218 OE2 GLU A 74 7.161 47.964 71.442 1.00 57.74 O ATOM 1219 HA GLU A 74 6.079 45.897 75.809 1.00 0.00 H ATOM 1220 HB2 GLU A 74 4.860 48.101 74.181 1.00 0.00 H ATOM 1221 HB3 GLU A 74 6.212 48.532 75.253 1.00 0.00 H ATOM 1222 HG2 GLU A 74 7.709 47.181 74.078 1.00 0.00 H ATOM 1223 HG3 GLU A 74 6.400 46.340 73.215 1.00 0.00 H ATOM 1224 H GLU A 74 3.372 46.538 74.702 1.00 0.00 H ATOM 1225 N GLU A 75 6.046 47.661 77.745 1.00 23.73 N ATOM 1226 CA GLU A 75 5.886 48.481 78.943 1.00 28.47 C ATOM 1227 C GLU A 75 5.898 49.980 78.596 1.00 26.83 C ATOM 1228 O GLU A 75 6.956 50.615 78.627 1.00 29.65 O ATOM 1229 CB GLU A 75 6.972 48.173 79.984 1.00 32.23 C ATOM 1230 CG GLU A 75 6.951 49.202 81.113 1.00 40.22 C ATOM 1231 CD GLU A 75 7.813 48.869 82.317 1.00 47.00 C ATOM 1232 OE1 GLU A 75 8.811 48.121 82.200 1.00 52.26 O ATOM 1233 OE2 GLU A 75 7.484 49.392 83.401 1.00 45.36 O ATOM 1234 HA GLU A 75 4.917 48.232 79.375 1.00 0.00 H ATOM 1235 HB2 GLU A 75 6.796 47.181 80.401 1.00 0.00 H ATOM 1236 HB3 GLU A 75 7.948 48.194 79.499 1.00 0.00 H ATOM 1237 HG2 GLU A 75 7.294 50.154 80.707 1.00 0.00 H ATOM 1238 HG3 GLU A 75 5.921 49.305 81.455 1.00 0.00 H ATOM 1239 H GLU A 75 6.985 47.286 77.501 1.00 0.00 H ATOM 1240 N GLY A 76 4.731 50.534 78.252 1.00 22.67 N ATOM 1241 CA GLY A 76 4.635 51.917 77.796 1.00 22.55 C ATOM 1242 C GLY A 76 5.195 52.097 76.398 1.00 29.14 C ATOM 1243 O GLY A 76 5.524 51.109 75.742 1.00 25.03 O ATOM 1244 HA3 GLY A 76 5.193 52.553 78.483 1.00 0.00 H ATOM 1245 HA2 GLY A 76 3.587 52.215 77.796 1.00 0.00 H ATOM 1246 H GLY A 76 3.865 49.962 78.311 1.00 0.00 H ATOM 1247 N CYS A 77 5.296 53.333 75.919 1.00 41.92 N ATOM 1248 CA CYS A 77 6.045 53.581 74.673 1.00 44.41 C ATOM 1249 C CYS A 77 7.125 54.623 74.865 1.00 42.98 C ATOM 1250 O CYS A 77 7.163 55.296 75.902 1.00 36.72 O ATOM 1251 CB CYS A 77 5.128 54.055 73.563 1.00 48.58 C ATOM 1252 SG CYS A 77 4.146 55.420 74.150 1.00 41.09 S ATOM 1253 HA CYS A 77 6.501 52.629 74.399 1.00 0.00 H ATOM 1254 HB2 CYS A 77 4.472 53.239 73.259 1.00 0.00 H ATOM 1255 HB3 CYS A 77 5.725 54.377 72.710 1.00 0.00 H ATOM 1256 HG CYS A 77 3.391 55.010 75.230 1.00 0.00 H ATOM 1257 H CYS A 77 4.847 54.125 76.423 1.00 0.00 H ATOM 1258 N PRO A 78 8.005 54.777 73.863 1.00 33.23 N ATOM 1259 CA PRO A 78 9.006 55.795 74.103 1.00 39.24 C ATOM 1260 C PRO A 78 8.277 57.095 74.206 1.00 29.23 C ATOM 1261 O PRO A 78 7.266 57.343 73.521 1.00 30.85 O ATOM 1262 CB PRO A 78 9.889 55.723 72.857 1.00 41.36 C ATOM 1263 CG PRO A 78 9.740 54.307 72.405 1.00 37.27 C ATOM 1264 CD PRO A 78 8.265 54.058 72.605 1.00 38.24 C ATOM 1265 HA PRO A 78 9.603 55.676 75.007 1.00 0.00 H ATOM 1266 HD3 PRO A 78 7.678 54.469 71.784 1.00 0.00 H ATOM 1267 HD2 PRO A 78 8.052 52.994 72.705 1.00 0.00 H ATOM 1268 HG3 PRO A 78 10.341 53.632 73.015 1.00 0.00 H ATOM 1269 HG2 PRO A 78 10.021 54.195 71.358 1.00 0.00 H ATOM 1270 HB2 PRO A 78 9.540 56.416 72.091 1.00 0.00 H ATOM 1271 HB3 PRO A 78 10.927 55.947 73.101 1.00 0.00 H ATOM 1272 N GLU A 79 8.767 57.879 75.143 1.00 32.50 N ATOM 1273 CA GLU A 79 8.334 59.225 75.323 1.00 32.05 C ATOM 1274 C GLU A 79 8.411 59.905 73.999 1.00 29.05 C ATOM 1275 O GLU A 79 9.321 59.635 73.187 1.00 28.06 O ATOM 1276 CB GLU A 79 9.286 59.934 76.259 1.00 37.94 C ATOM 1277 CG GLU A 79 8.986 59.717 77.687 1.00 45.84 C ATOM 1278 CD GLU A 79 10.086 60.258 78.550 1.00 50.53 C ATOM 1279 OE1 GLU A 79 10.023 61.458 78.907 1.00 44.54 O ATOM 1280 OE2 GLU A 79 11.022 59.478 78.844 1.00 52.36 O ATOM 1281 HA GLU A 79 7.323 59.245 75.729 1.00 0.00 H ATOM 1282 HB2 GLU A 79 10.296 59.574 76.061 1.00 0.00 H ATOM 1283 HB3 GLU A 79 9.236 61.004 76.055 1.00 0.00 H ATOM 1284 HG2 GLU A 79 8.053 60.223 77.937 1.00 0.00 H ATOM 1285 HG3 GLU A 79 8.879 58.648 77.872 1.00 0.00 H ATOM 1286 H GLU A 79 9.499 57.501 75.777 1.00 0.00 H ATOM 1287 N GLY A 80 7.480 60.826 73.804 1.00 22.08 N ATOM 1288 CA GLY A 80 7.471 61.641 72.617 1.00 24.24 C ATOM 1289 C GLY A 80 6.722 61.015 71.466 1.00 31.34 C ATOM 1290 O GLY A 80 6.351 61.726 70.534 1.00 45.27 O ATOM 1291 HA3 GLY A 80 8.502 61.812 72.307 1.00 0.00 H ATOM 1292 HA2 GLY A 80 7.002 62.595 72.856 1.00 0.00 H ATOM 1293 H GLY A 80 6.741 60.963 74.522 1.00 0.00 H ATOM 1294 N THR A 81 6.483 59.703 71.525 1.00 24.78 N ATOM 1295 CA THR A 81 5.762 58.981 70.482 1.00 26.20 C ATOM 1296 C THR A 81 4.302 59.405 70.419 1.00 24.24 C ATOM 1297 O THR A 81 3.637 59.491 71.434 1.00 23.60 O ATOM 1298 CB THR A 81 5.666 57.468 70.795 1.00 29.78 C ATOM 1299 OG1 THR A 81 6.964 56.897 70.979 1.00 42.99 O ATOM 1300 CG2 THR A 81 4.948 56.726 69.669 1.00 41.59 C ATOM 1301 HA THR A 81 6.314 59.194 69.566 1.00 0.00 H ATOM 1302 HB THR A 81 5.097 57.363 71.718 1.00 0.00 H ATOM 1303 HG1 THR A 81 7.418 57.349 71.734 1.00 0.00 H ATOM 1304 HG23 THR A 81 3.958 57.158 69.525 1.00 0.00 H ATOM 1305 HG21 THR A 81 5.524 56.820 68.749 1.00 0.00 H ATOM 1306 HG22 THR A 81 4.852 55.673 69.933 1.00 0.00 H ATOM 1307 H THR A 81 6.826 59.172 72.351 1.00 0.00 H ATOM 1308 N VAL A 82 3.794 59.644 69.224 1.00 24.55 N ATOM 1309 CA VAL A 82 2.351 59.735 69.077 1.00 23.85 C ATOM 1310 C VAL A 82 1.754 58.338 68.994 1.00 26.76 C ATOM 1311 O VAL A 82 2.098 57.543 68.113 1.00 31.92 O ATOM 1312 CB VAL A 82 1.937 60.586 67.875 1.00 23.39 C ATOM 1313 CG1 VAL A 82 0.408 60.740 67.866 1.00 20.77 C ATOM 1314 CG2 VAL A 82 2.621 61.959 67.951 1.00 24.95 C ATOM 1315 HA VAL A 82 1.958 60.241 69.958 1.00 0.00 H ATOM 1316 HB VAL A 82 2.248 60.098 66.951 1.00 0.00 H ATOM 1317 HG11 VAL A 82 -0.055 59.756 67.794 1.00 0.00 H ATOM 1318 HG12 VAL A 82 0.088 61.227 68.787 1.00 0.00 H ATOM 1319 HG13 VAL A 82 0.110 61.346 67.010 1.00 0.00 H ATOM 1320 HG21 VAL A 82 2.322 62.462 68.870 1.00 0.00 H ATOM 1321 HG22 VAL A 82 3.703 61.825 67.944 1.00 0.00 H ATOM 1322 HG23 VAL A 82 2.322 62.560 67.092 1.00 0.00 H ATOM 1323 H VAL A 82 4.417 59.765 68.400 1.00 0.00 H ATOM 1324 N CYS A 83 0.892 58.048 69.961 1.00 22.42 N ATOM 1325 CA CYS A 83 0.170 56.792 70.057 1.00 24.68 C ATOM 1326 C CYS A 83 -1.348 57.044 69.921 1.00 22.94 C ATOM 1327 O CYS A 83 -1.789 58.207 69.853 1.00 22.84 O ATOM 1328 CB CYS A 83 0.556 56.094 71.374 1.00 24.75 C ATOM 1329 SG CYS A 83 2.324 55.650 71.378 1.00 39.72 S ATOM 1330 HA CYS A 83 0.443 56.123 69.241 1.00 0.00 H ATOM 1331 HB2 CYS A 83 -0.040 55.189 71.487 1.00 0.00 H ATOM 1332 HB3 CYS A 83 0.354 56.767 72.208 1.00 0.00 H ATOM 1333 HG CYS A 83 2.638 55.028 72.569 1.00 0.00 H ATOM 1334 H CYS A 83 0.723 58.765 70.695 1.00 0.00 H ATOM 1335 N SER A 84 -2.146 55.982 69.828 1.00 18.92 N ATOM 1336 CA SER A 84 -3.601 56.138 69.717 1.00 20.57 C ATOM 1337 C SER A 84 -4.332 55.404 70.835 1.00 21.51 C ATOM 1338 O SER A 84 -3.999 54.243 71.144 1.00 23.96 O ATOM 1339 CB SER A 84 -4.125 55.561 68.387 1.00 22.78 C ATOM 1340 OG SER A 84 -3.417 56.084 67.269 1.00 29.60 O ATOM 1341 HA SER A 84 -3.792 57.209 69.777 1.00 0.00 H ATOM 1342 HB2 SER A 84 -5.181 55.811 68.285 1.00 0.00 H ATOM 1343 HB3 SER A 84 -4.010 54.477 68.402 1.00 0.00 H ATOM 1344 HG SER A 84 -2.457 55.855 67.351 1.00 0.00 H ATOM 1345 H SER A 84 -1.732 55.028 69.834 1.00 0.00 H ATOM 1346 N VAL A 85 -5.372 56.017 71.396 1.00 15.85 N ATOM 1347 CA VAL A 85 -6.211 55.250 72.308 1.00 17.73 C ATOM 1348 C VAL A 85 -7.432 54.716 71.533 1.00 16.94 C ATOM 1349 O VAL A 85 -8.187 55.486 70.922 1.00 16.93 O ATOM 1350 CB VAL A 85 -6.653 56.095 73.507 1.00 17.64 C ATOM 1351 CG1 VAL A 85 -7.353 55.218 74.552 1.00 18.16 C ATOM 1352 CG2 VAL A 85 -5.463 56.824 74.110 1.00 17.54 C ATOM 1353 HA VAL A 85 -5.634 54.414 72.703 1.00 0.00 H ATOM 1354 HB VAL A 85 -7.367 56.843 73.164 1.00 0.00 H ATOM 1355 HG11 VAL A 85 -8.230 54.751 74.104 1.00 0.00 H ATOM 1356 HG12 VAL A 85 -6.665 54.446 74.896 1.00 0.00 H ATOM 1357 HG13 VAL A 85 -7.660 55.836 75.396 1.00 0.00 H ATOM 1358 HG21 VAL A 85 -4.723 56.096 74.442 1.00 0.00 H ATOM 1359 HG22 VAL A 85 -5.020 57.478 73.359 1.00 0.00 H ATOM 1360 HG23 VAL A 85 -5.796 57.419 74.960 1.00 0.00 H ATOM 1361 H VAL A 85 -5.580 57.015 71.189 1.00 0.00 H ATOM 1362 N LEU A 86 -7.627 53.399 71.524 1.00 14.32 N ATOM 1363 CA LEU A 86 -8.721 52.831 70.747 1.00 15.40 C ATOM 1364 C LEU A 86 -10.010 52.809 71.582 1.00 16.48 C ATOM 1365 O LEU A 86 -10.338 51.842 72.283 1.00 17.05 O ATOM 1366 CB LEU A 86 -8.396 51.429 70.230 1.00 14.19 C ATOM 1367 CG LEU A 86 -7.075 51.243 69.495 1.00 15.42 C ATOM 1368 CD1 LEU A 86 -7.000 49.809 69.001 1.00 19.27 C ATOM 1369 CD2 LEU A 86 -7.032 52.204 68.324 1.00 15.21 C ATOM 1370 HA LEU A 86 -8.867 53.469 69.876 1.00 0.00 H ATOM 1371 HB2 LEU A 86 -8.391 50.757 71.088 1.00 0.00 H ATOM 1372 HB3 LEU A 86 -9.194 51.139 69.547 1.00 0.00 H ATOM 1373 HG LEU A 86 -6.230 51.444 70.154 1.00 0.00 H ATOM 1374 HD21 LEU A 86 -7.864 51.993 67.652 1.00 0.00 H ATOM 1375 HD22 LEU A 86 -7.111 53.227 68.692 1.00 0.00 H ATOM 1376 HD23 LEU A 86 -6.090 52.081 67.789 1.00 0.00 H ATOM 1377 HD11 LEU A 86 -7.053 49.130 69.852 1.00 0.00 H ATOM 1378 HD12 LEU A 86 -7.834 49.614 68.326 1.00 0.00 H ATOM 1379 HD13 LEU A 86 -6.059 49.657 68.472 1.00 0.00 H ATOM 1380 H LEU A 86 -6.999 52.776 72.071 1.00 0.00 H ATOM 1381 N ILE A 87 -10.750 53.899 71.504 1.00 12.78 N ATOM 1382 CA ILE A 87 -11.951 54.054 72.327 1.00 13.27 C ATOM 1383 C ILE A 87 -13.189 53.533 71.623 1.00 16.59 C ATOM 1384 O ILE A 87 -13.490 53.949 70.504 1.00 16.43 O ATOM 1385 CB ILE A 87 -12.138 55.527 72.663 1.00 16.39 C ATOM 1386 CG1 ILE A 87 -11.022 55.940 73.603 1.00 22.90 C ATOM 1387 CG2 ILE A 87 -13.477 55.796 73.361 1.00 16.21 C ATOM 1388 CD1 ILE A 87 -11.021 57.384 73.852 1.00 37.75 C ATOM 1389 HA ILE A 87 -11.817 53.469 73.237 1.00 0.00 H ATOM 1390 HB ILE A 87 -12.122 56.094 71.732 1.00 0.00 H ATOM 1391 HG12 ILE A 87 -11.150 55.419 74.552 1.00 0.00 H ATOM 1392 HG13 ILE A 87 -10.066 55.658 73.161 1.00 0.00 H ATOM 1393 HD11 ILE A 87 -10.887 57.914 72.909 1.00 0.00 H ATOM 1394 HD12 ILE A 87 -11.971 57.675 74.301 1.00 0.00 H ATOM 1395 HD13 ILE A 87 -10.205 57.634 74.530 1.00 0.00 H ATOM 1396 HG21 ILE A 87 -14.294 55.491 72.707 1.00 0.00 H ATOM 1397 HG22 ILE A 87 -13.522 55.228 74.290 1.00 0.00 H ATOM 1398 HG23 ILE A 87 -13.564 56.860 73.580 1.00 0.00 H ATOM 1399 H ILE A 87 -10.476 54.659 70.849 1.00 0.00 H ATOM 1400 N LYS A 88 -13.879 52.605 72.277 1.00 12.59 N ATOM 1401 CA LYS A 88 -15.251 52.277 71.909 1.00 12.52 C ATOM 1402 C LYS A 88 -16.211 52.950 72.868 1.00 13.96 C ATOM 1403 O LYS A 88 -15.951 53.048 74.079 1.00 18.86 O ATOM 1404 CB LYS A 88 -15.497 50.775 71.985 1.00 12.98 C ATOM 1405 CG LYS A 88 -14.891 50.005 70.836 1.00 15.99 C ATOM 1406 CD LYS A 88 -15.354 48.548 70.893 1.00 15.44 C ATOM 1407 CE LYS A 88 -14.873 47.760 69.685 1.00 15.74 C ATOM 1408 NZ LYS A 88 -15.129 46.276 69.896 1.00 16.26 N ATOM 1409 HA LYS A 88 -15.410 52.622 70.888 1.00 0.00 H ATOM 1410 HB2 LYS A 88 -15.068 50.402 72.915 1.00 0.00 H ATOM 1411 HB3 LYS A 88 -16.573 50.601 71.987 1.00 0.00 H ATOM 1412 HG2 LYS A 88 -15.209 50.450 69.893 1.00 0.00 H ATOM 1413 HG3 LYS A 88 -13.804 50.043 70.907 1.00 0.00 H ATOM 1414 HD2 LYS A 88 -14.958 48.086 71.797 1.00 0.00 H ATOM 1415 HD3 LYS A 88 -16.443 48.524 70.921 1.00 0.00 H ATOM 1416 HE2 LYS A 88 -13.805 47.926 69.547 1.00 0.00 H ATOM 1417 HE3 LYS A 88 -15.409 48.096 68.798 1.00 0.00 H ATOM 1418 HZ1 LYS A 88 -14.616 45.954 70.742 1.00 0.00 H ATOM 1419 HZ2 LYS A 88 -16.148 46.116 70.025 1.00 0.00 H ATOM 1420 HZ3 LYS A 88 -14.797 45.747 69.065 1.00 0.00 H ATOM 1421 H LYS A 88 -13.431 52.101 73.069 1.00 0.00 H ATOM 1422 N ARG A 89 -17.312 53.441 72.319 1.00 13.88 N ATOM 1423 CA ARG A 89 -18.335 54.052 73.151 1.00 18.80 C ATOM 1424 C ARG A 89 -19.524 53.110 73.238 1.00 18.62 C ATOM 1425 O ARG A 89 -19.673 52.219 72.418 1.00 17.84 O ATOM 1426 CB ARG A 89 -18.740 55.409 72.571 1.00 19.51 C ATOM 1427 CG ARG A 89 -17.654 56.479 72.750 1.00 19.30 C ATOM 1428 CD ARG A 89 -17.528 56.861 74.226 1.00 19.53 C ATOM 1429 NE ARG A 89 -16.259 57.479 74.608 1.00 17.71 N ATOM 1430 CZ ARG A 89 -15.879 58.708 74.267 1.00 22.73 C ATOM 1431 NH1 ARG A 89 -16.658 59.455 73.488 1.00 24.43 N ATOM 1432 NH2 ARG A 89 -14.709 59.189 74.695 1.00 17.05 N ATOM 1433 HA ARG A 89 -17.949 54.225 74.156 1.00 0.00 H ATOM 1434 HB2 ARG A 89 -18.938 55.288 71.506 1.00 0.00 H ATOM 1435 HB3 ARG A 89 -19.647 55.746 73.072 1.00 0.00 H ATOM 1436 HG2 ARG A 89 -16.700 56.087 72.396 1.00 0.00 H ATOM 1437 HG3 ARG A 89 -17.920 57.363 72.170 1.00 0.00 H ATOM 1438 HD2 ARG A 89 -17.654 55.956 74.820 1.00 0.00 H ATOM 1439 HD3 ARG A 89 -18.328 57.562 74.462 1.00 0.00 H ATOM 1440 HE ARG A 89 -15.605 56.917 75.189 1.00 0.00 H ATOM 1441 HH12 ARG A 89 -16.360 60.415 73.222 1.00 0.00 H ATOM 1442 HH11 ARG A 89 -17.565 59.078 73.145 1.00 0.00 H ATOM 1443 HH22 ARG A 89 -14.413 60.150 74.428 1.00 0.00 H ATOM 1444 HH21 ARG A 89 -14.094 58.603 75.295 1.00 0.00 H ATOM 1445 H ARG A 89 -17.445 53.389 71.289 1.00 0.00 H ATOM 1446 N ASP A 90 -20.369 53.312 74.245 1.00 20.50 N ATOM 1447 CA ASP A 90 -21.502 52.430 74.466 1.00 21.59 C ATOM 1448 C ASP A 90 -22.446 52.414 73.257 1.00 20.89 C ATOM 1449 O ASP A 90 -23.092 51.407 73.001 1.00 20.52 O ATOM 1450 CB ASP A 90 -22.246 52.828 75.739 1.00 30.58 C ATOM 1451 CG ASP A 90 -21.713 52.107 76.972 1.00 39.75 C ATOM 1452 OD1 ASP A 90 -20.963 51.108 76.812 1.00 33.58 O ATOM 1453 OD2 ASP A 90 -22.067 52.522 78.102 1.00 45.15 O ATOM 1454 HA ASP A 90 -21.121 51.417 74.592 1.00 0.00 H ATOM 1455 HB2 ASP A 90 -22.138 53.902 75.887 1.00 0.00 H ATOM 1456 HB3 ASP A 90 -23.301 52.584 75.619 1.00 0.00 H ATOM 1457 H ASP A 90 -20.216 54.116 74.886 1.00 0.00 H ATOM 1458 N SER A 91 -22.487 53.518 72.507 1.00 22.51 N ATOM 1459 CA SER A 91 -23.300 53.608 71.280 1.00 19.98 C ATOM 1460 C SER A 91 -22.813 52.711 70.159 1.00 18.15 C ATOM 1461 O SER A 91 -23.546 52.454 69.198 1.00 17.68 O ATOM 1462 CB SER A 91 -23.302 55.037 70.738 1.00 19.24 C ATOM 1463 OG SER A 91 -22.022 55.379 70.202 1.00 21.04 O ATOM 1464 HA SER A 91 -24.297 53.285 71.580 1.00 0.00 H ATOM 1465 HB2 SER A 91 -23.547 55.726 71.547 1.00 0.00 H ATOM 1466 HB3 SER A 91 -24.053 55.120 69.952 1.00 0.00 H ATOM 1467 HG SER A 91 -22.047 56.307 69.858 1.00 0.00 H ATOM 1468 H SER A 91 -21.926 54.344 72.799 1.00 0.00 H ATOM 1469 N GLY A 92 -21.578 52.251 70.267 1.00 15.11 N ATOM 1470 CA GLY A 92 -20.920 51.545 69.179 1.00 16.87 C ATOM 1471 C GLY A 92 -19.882 52.369 68.423 1.00 15.61 C ATOM 1472 O GLY A 92 -19.043 51.795 67.705 1.00 14.88 O ATOM 1473 HA3 GLY A 92 -21.683 51.226 68.470 1.00 0.00 H ATOM 1474 HA2 GLY A 92 -20.422 50.669 69.594 1.00 0.00 H ATOM 1475 H GLY A 92 -21.061 52.399 71.157 1.00 0.00 H ATOM 1476 N GLU A 93 -19.916 53.700 68.565 1.00 12.39 N ATOM 1477 CA GLU A 93 -18.963 54.574 67.868 1.00 13.86 C ATOM 1478 C GLU A 93 -17.511 54.215 68.193 1.00 15.55 C ATOM 1479 O GLU A 93 -17.175 53.978 69.366 1.00 15.08 O ATOM 1480 CB GLU A 93 -19.225 56.040 68.253 1.00 22.77 C ATOM 1481 CG GLU A 93 -18.313 57.027 67.517 1.00 22.71 C ATOM 1482 CD GLU A 93 -18.567 58.481 67.888 1.00 25.77 C ATOM 1483 OE1 GLU A 93 -19.359 58.759 68.806 1.00 28.30 O ATOM 1484 OE2 GLU A 93 -17.960 59.362 67.256 1.00 31.95 O ATOM 1485 HA GLU A 93 -19.111 54.433 66.797 1.00 0.00 H ATOM 1486 HB2 GLU A 93 -20.261 56.281 68.016 1.00 0.00 H ATOM 1487 HB3 GLU A 93 -19.064 56.152 69.325 1.00 0.00 H ATOM 1488 HG2 GLU A 93 -17.278 56.785 67.757 1.00 0.00 H ATOM 1489 HG3 GLU A 93 -18.473 56.911 66.445 1.00 0.00 H ATOM 1490 H GLU A 93 -20.635 54.126 69.184 1.00 0.00 H ATOM 1491 N LEU A 94 -16.658 54.185 67.162 1.00 15.88 N ATOM 1492 CA LEU A 94 -15.209 54.014 67.322 1.00 16.64 C ATOM 1493 C LEU A 94 -14.504 55.375 67.282 1.00 18.40 C ATOM 1494 O LEU A 94 -14.803 56.198 66.398 1.00 19.82 O ATOM 1495 CB LEU A 94 -14.629 53.159 66.190 1.00 17.20 C ATOM 1496 CG LEU A 94 -15.350 51.839 65.956 1.00 18.30 C ATOM 1497 CD1 LEU A 94 -14.672 51.108 64.780 1.00 19.93 C ATOM 1498 CD2 LEU A 94 -15.351 50.984 67.208 1.00 20.85 C ATOM 1499 HA LEU A 94 -15.045 53.524 68.282 1.00 0.00 H ATOM 1500 HB2 LEU A 94 -14.675 53.739 65.268 1.00 0.00 H ATOM 1501 HB3 LEU A 94 -13.588 52.940 66.429 1.00 0.00 H ATOM 1502 HG LEU A 94 -16.393 52.034 65.708 1.00 0.00 H ATOM 1503 HD21 LEU A 94 -14.323 50.772 67.502 1.00 0.00 H ATOM 1504 HD22 LEU A 94 -15.857 51.519 68.011 1.00 0.00 H ATOM 1505 HD23 LEU A 94 -15.873 50.049 67.007 1.00 0.00 H ATOM 1506 HD11 LEU A 94 -14.733 51.728 63.885 1.00 0.00 H ATOM 1507 HD12 LEU A 94 -13.626 50.921 65.024 1.00 0.00 H ATOM 1508 HD13 LEU A 94 -15.180 50.160 64.602 1.00 0.00 H ATOM 1509 H LEU A 94 -17.041 54.288 66.200 1.00 0.00 H ATOM 1510 N LEU A 95 -13.570 55.597 68.215 1.00 18.99 N ATOM 1511 CA LEU A 95 -12.839 56.861 68.316 1.00 21.51 C ATOM 1512 C LEU A 95 -11.369 56.654 68.598 1.00 16.30 C ATOM 1513 O LEU A 95 -10.979 56.555 69.754 1.00 22.34 O ATOM 1514 CB LEU A 95 -13.406 57.700 69.448 1.00 30.06 C ATOM 1515 CG LEU A 95 -14.646 58.531 69.166 1.00 44.02 C ATOM 1516 CD1 LEU A 95 -14.939 59.363 70.397 1.00 49.78 C ATOM 1517 CD2 LEU A 95 -14.407 59.432 67.959 1.00 41.99 C ATOM 1518 HA LEU A 95 -12.951 57.361 67.354 1.00 0.00 H ATOM 1519 HB2 LEU A 95 -13.649 57.021 70.265 1.00 0.00 H ATOM 1520 HB3 LEU A 95 -12.622 58.386 69.768 1.00 0.00 H ATOM 1521 HG LEU A 95 -15.495 57.885 68.941 1.00 0.00 H ATOM 1522 HD21 LEU A 95 -13.568 60.097 68.164 1.00 0.00 H ATOM 1523 HD22 LEU A 95 -14.181 58.818 67.088 1.00 0.00 H ATOM 1524 HD23 LEU A 95 -15.302 60.023 67.766 1.00 0.00 H ATOM 1525 HD11 LEU A 95 -15.112 58.703 71.247 1.00 0.00 H ATOM 1526 HD12 LEU A 95 -14.089 60.012 70.606 1.00 0.00 H ATOM 1527 HD13 LEU A 95 -15.827 59.970 70.221 1.00 0.00 H ATOM 1528 H LEU A 95 -13.355 54.841 68.896 1.00 0.00 H ATOM 1529 N PRO A 96 -10.541 56.593 67.550 1.00 18.92 N ATOM 1530 CA PRO A 96 -9.103 56.475 67.808 1.00 18.99 C ATOM 1531 C PRO A 96 -8.526 57.845 68.189 1.00 23.38 C ATOM 1532 O PRO A 96 -8.336 58.700 67.314 1.00 29.97 O ATOM 1533 CB PRO A 96 -8.554 56.033 66.453 1.00 20.80 C ATOM 1534 CG PRO A 96 -9.515 56.660 65.457 1.00 22.18 C ATOM 1535 CD PRO A 96 -10.866 56.589 66.112 1.00 19.69 C ATOM 1536 HA PRO A 96 -8.858 55.792 68.622 1.00 0.00 H ATOM 1537 HD3 PRO A 96 -11.476 57.452 65.846 1.00 0.00 H ATOM 1538 HD2 PRO A 96 -11.390 55.675 65.831 1.00 0.00 H ATOM 1539 HG3 PRO A 96 -9.514 56.101 64.521 1.00 0.00 H ATOM 1540 HG2 PRO A 96 -9.240 57.696 65.260 1.00 0.00 H ATOM 1541 HB2 PRO A 96 -7.540 56.405 66.303 1.00 0.00 H ATOM 1542 HB3 PRO A 96 -8.558 54.946 66.367 1.00 0.00 H ATOM 1543 N LEU A 97 -8.244 58.049 69.465 1.00 17.11 N ATOM 1544 CA LEU A 97 -7.712 59.347 69.904 1.00 20.10 C ATOM 1545 C LEU A 97 -6.191 59.404 69.876 1.00 20.39 C ATOM 1546 O LEU A 97 -5.536 58.588 70.514 1.00 23.51 O ATOM 1547 CB LEU A 97 -8.189 59.641 71.317 1.00 20.13 C ATOM 1548 CG LEU A 97 -9.701 59.742 71.426 1.00 25.06 C ATOM 1549 CD1 LEU A 97 -10.024 60.171 72.835 1.00 28.72 C ATOM 1550 CD2 LEU A 97 -10.228 60.745 70.405 1.00 28.26 C ATOM 1551 HA LEU A 97 -8.083 60.094 69.202 1.00 0.00 H ATOM 1552 HB2 LEU A 97 -7.846 58.841 71.973 1.00 0.00 H ATOM 1553 HB3 LEU A 97 -7.754 60.586 71.641 1.00 0.00 H ATOM 1554 HG LEU A 97 -10.177 58.785 71.215 1.00 0.00 H ATOM 1555 HD21 LEU A 97 -9.787 61.723 70.597 1.00 0.00 H ATOM 1556 HD22 LEU A 97 -9.960 60.415 69.401 1.00 0.00 H ATOM 1557 HD23 LEU A 97 -11.313 60.812 70.490 1.00 0.00 H ATOM 1558 HD11 LEU A 97 -9.639 59.431 73.536 1.00 0.00 H ATOM 1559 HD12 LEU A 97 -9.561 61.137 73.034 1.00 0.00 H ATOM 1560 HD13 LEU A 97 -11.105 60.254 72.949 1.00 0.00 H ATOM 1561 H LEU A 97 -8.399 57.290 70.159 1.00 0.00 H ATOM 1562 N ALA A 98 -5.622 60.404 69.206 1.00 18.64 N ATOM 1563 CA ALA A 98 -4.164 60.550 69.189 1.00 17.82 C ATOM 1564 C ALA A 98 -3.656 61.185 70.463 1.00 21.62 C ATOM 1565 O ALA A 98 -4.173 62.197 70.928 1.00 21.48 O ATOM 1566 CB ALA A 98 -3.701 61.377 67.987 1.00 22.81 C ATOM 1567 HA ALA A 98 -3.748 59.546 69.108 1.00 0.00 H ATOM 1568 HB1 ALA A 98 -4.011 60.883 67.066 1.00 0.00 H ATOM 1569 HB2 ALA A 98 -4.149 62.370 68.036 1.00 0.00 H ATOM 1570 HB3 ALA A 98 -2.615 61.466 68.005 1.00 0.00 H ATOM 1571 H ALA A 98 -6.216 61.086 68.692 1.00 0.00 H ATOM 1572 N VAL A 99 -2.601 60.606 71.009 1.00 17.35 N ATOM 1573 CA VAL A 99 -2.030 61.137 72.234 1.00 18.45 C ATOM 1574 C VAL A 99 -0.515 61.147 72.136 1.00 22.71 C ATOM 1575 O VAL A 99 0.074 60.253 71.549 1.00 24.60 O ATOM 1576 CB VAL A 99 -2.475 60.307 73.456 1.00 19.79 C ATOM 1577 CG1 VAL A 99 -1.919 60.917 74.713 1.00 26.90 C ATOM 1578 CG2 VAL A 99 -3.956 60.298 73.554 1.00 23.52 C ATOM 1579 HA VAL A 99 -2.390 62.157 72.366 1.00 0.00 H ATOM 1580 HB VAL A 99 -2.106 59.288 73.337 1.00 0.00 H ATOM 1581 HG11 VAL A 99 -0.830 60.927 74.660 1.00 0.00 H ATOM 1582 HG12 VAL A 99 -2.289 61.937 74.815 1.00 0.00 H ATOM 1583 HG13 VAL A 99 -2.236 60.327 75.573 1.00 0.00 H ATOM 1584 HG21 VAL A 99 -4.318 61.320 73.664 1.00 0.00 H ATOM 1585 HG22 VAL A 99 -4.376 59.858 72.650 1.00 0.00 H ATOM 1586 HG23 VAL A 99 -4.258 59.709 74.420 1.00 0.00 H ATOM 1587 H VAL A 99 -2.179 59.768 70.560 1.00 0.00 H ATOM 1588 N ARG A 100 0.117 62.185 72.666 1.00 21.87 N ATOM 1589 CA ARG A 100 1.568 62.151 72.760 1.00 23.88 C ATOM 1590 C ARG A 100 2.012 61.792 74.147 1.00 24.59 C ATOM 1591 O ARG A 100 1.702 62.484 75.127 1.00 27.61 O ATOM 1592 CB ARG A 100 2.235 63.452 72.348 1.00 23.33 C ATOM 1593 CG ARG A 100 3.740 63.188 72.202 1.00 21.90 C ATOM 1594 CD ARG A 100 4.534 64.398 71.877 1.00 25.10 C ATOM 1595 NE ARG A 100 4.107 65.152 70.699 1.00 26.24 N ATOM 1596 CZ ARG A 100 4.625 65.032 69.477 1.00 27.68 C ATOM 1597 NH1 ARG A 100 5.561 64.127 69.216 1.00 24.35 N ATOM 1598 NH2 ARG A 100 4.212 65.836 68.510 1.00 25.96 N ATOM 1599 HA ARG A 100 1.883 61.383 72.054 1.00 0.00 H ATOM 1600 HB2 ARG A 100 1.825 63.793 71.397 1.00 0.00 H ATOM 1601 HB3 ARG A 100 2.065 64.213 73.110 1.00 0.00 H ATOM 1602 HG2 ARG A 100 4.109 62.777 73.142 1.00 0.00 H ATOM 1603 HG3 ARG A 100 3.885 62.458 71.406 1.00 0.00 H ATOM 1604 HD2 ARG A 100 5.566 64.086 71.717 1.00 0.00 H ATOM 1605 HD3 ARG A 100 4.487 65.068 72.736 1.00 0.00 H ATOM 1606 HE ARG A 100 3.336 65.838 70.825 1.00 0.00 H ATOM 1607 HH12 ARG A 100 5.954 64.047 68.256 1.00 0.00 H ATOM 1608 HH11 ARG A 100 5.901 63.498 69.971 1.00 0.00 H ATOM 1609 HH22 ARG A 100 4.612 65.748 67.554 1.00 0.00 H ATOM 1610 HH21 ARG A 100 3.488 66.556 68.706 1.00 0.00 H ATOM 1611 H ARG A 100 -0.416 63.010 73.009 1.00 0.00 H ATOM 1612 N MET A 101 2.792 60.731 74.239 1.00 24.72 N ATOM 1613 CA MET A 101 3.134 60.208 75.535 1.00 26.75 C ATOM 1614 C MET A 101 4.400 60.769 76.107 1.00 32.02 C ATOM 1615 O MET A 101 5.361 61.063 75.386 1.00 32.28 O ATOM 1616 CB MET A 101 3.222 58.703 75.474 1.00 29.40 C ATOM 1617 CG MET A 101 2.125 58.171 74.625 1.00 32.99 C ATOM 1618 SD MET A 101 0.447 58.155 75.317 1.00 33.90 S ATOM 1619 CE MET A 101 0.232 59.399 76.557 1.00 22.23 C ATOM 1620 HA MET A 101 2.334 60.520 76.207 1.00 0.00 H ATOM 1621 HB2 MET A 101 4.183 58.413 75.049 1.00 0.00 H ATOM 1622 HB3 MET A 101 3.133 58.293 76.480 1.00 0.00 H ATOM 1623 HG2 MET A 101 2.381 57.143 74.370 1.00 0.00 H ATOM 1624 HG3 MET A 101 2.096 58.773 73.717 1.00 0.00 H ATOM 1625 HE1 MET A 101 0.938 59.227 77.369 1.00 0.00 H ATOM 1626 HE2 MET A 101 0.412 60.381 76.120 1.00 0.00 H ATOM 1627 HE3 MET A 101 -0.786 59.353 76.943 1.00 0.00 H ATOM 1628 H MET A 101 3.158 60.275 73.379 1.00 0.00 H ATOM 1629 N GLY A 102 4.371 60.912 77.423 1.00 30.76 N ATOM 1630 CA GLY A 102 5.472 61.450 78.158 1.00 27.50 C ATOM 1631 C GLY A 102 6.076 60.405 79.057 1.00 29.93 C ATOM 1632 O GLY A 102 6.227 59.240 78.693 1.00 30.03 O ATOM 1633 HA3 GLY A 102 5.123 62.285 78.765 1.00 0.00 H ATOM 1634 HA2 GLY A 102 6.231 61.802 77.459 1.00 0.00 H ATOM 1635 H GLY A 102 3.516 60.622 77.940 1.00 0.00 H ATOM 1636 N ALA A 103 6.419 60.831 80.260 1.00 33.07 N ATOM 1637 CA ALA A 103 7.205 60.009 81.175 1.00 33.68 C ATOM 1638 C ALA A 103 6.388 58.904 81.861 1.00 31.66 C ATOM 1639 O ALA A 103 5.204 59.081 82.153 1.00 34.54 O ATOM 1640 CB ALA A 103 7.861 60.895 82.225 1.00 41.35 C ATOM 1641 HA ALA A 103 7.961 59.506 80.573 1.00 0.00 H ATOM 1642 HB1 ALA A 103 8.514 61.616 81.733 1.00 0.00 H ATOM 1643 HB2 ALA A 103 7.090 61.424 82.785 1.00 0.00 H ATOM 1644 HB3 ALA A 103 8.447 60.277 82.906 1.00 0.00 H ATOM 1645 H ALA A 103 6.120 61.780 80.564 1.00 0.00 H ATOM 1646 N ILE A 104 7.030 57.759 82.081 1.00 32.38 N ATOM 1647 CA ILE A 104 6.486 56.693 82.912 1.00 35.25 C ATOM 1648 C ILE A 104 6.847 56.996 84.341 1.00 36.28 C ATOM 1649 O ILE A 104 8.015 57.271 84.640 1.00 40.14 O ATOM 1650 CB ILE A 104 7.129 55.327 82.617 1.00 37.31 C ATOM 1651 CG1 ILE A 104 6.810 54.842 81.198 1.00 38.15 C ATOM 1652 CG2 ILE A 104 6.646 54.296 83.632 1.00 38.82 C ATOM 1653 CD1 ILE A 104 7.296 53.426 80.955 1.00 37.61 C ATOM 1654 HA ILE A 104 5.415 56.646 82.717 1.00 0.00 H ATOM 1655 HB ILE A 104 8.210 55.447 82.695 1.00 0.00 H ATOM 1656 HG12 ILE A 104 5.731 54.873 81.050 1.00 0.00 H ATOM 1657 HG13 ILE A 104 7.293 55.507 80.482 1.00 0.00 H ATOM 1658 HD11 ILE A 104 8.376 53.385 81.093 1.00 0.00 H ATOM 1659 HD12 ILE A 104 6.813 52.751 81.661 1.00 0.00 H ATOM 1660 HD13 ILE A 104 7.047 53.127 79.937 1.00 0.00 H ATOM 1661 HG21 ILE A 104 6.926 54.617 84.635 1.00 0.00 H ATOM 1662 HG22 ILE A 104 5.562 54.205 83.568 1.00 0.00 H ATOM 1663 HG23 ILE A 104 7.106 53.332 83.416 1.00 0.00 H ATOM 1664 H ILE A 104 7.961 57.619 81.640 1.00 0.00 H ATOM 1665 N ALA A 105 5.859 56.927 85.227 1.00 30.90 N ATOM 1666 CA ALA A 105 6.069 57.284 86.619 1.00 35.07 C ATOM 1667 C ALA A 105 5.092 56.571 87.540 1.00 36.54 C ATOM 1668 O ALA A 105 4.105 55.972 87.082 1.00 33.00 O ATOM 1669 CB ALA A 105 5.959 58.785 86.801 1.00 39.76 C ATOM 1670 HA ALA A 105 7.074 56.962 86.891 1.00 0.00 H ATOM 1671 HB1 ALA A 105 6.713 59.280 86.189 1.00 0.00 H ATOM 1672 HB2 ALA A 105 4.966 59.115 86.495 1.00 0.00 H ATOM 1673 HB3 ALA A 105 6.119 59.035 87.850 1.00 0.00 H ATOM 1674 H ALA A 105 4.918 56.611 84.918 1.00 0.00 H ATOM 1675 N SER A 106 5.372 56.639 88.838 1.00 36.39 N ATOM 1676 CA SER A 106 4.411 56.211 89.844 1.00 40.39 C ATOM 1677 C SER A 106 3.662 57.450 90.297 1.00 39.93 C ATOM 1678 O SER A 106 4.263 58.470 90.669 1.00 35.52 O ATOM 1679 CB SER A 106 5.102 55.555 91.042 1.00 47.26 C ATOM 1680 OG SER A 106 6.107 54.644 90.621 1.00 52.63 O ATOM 1681 HA SER A 106 3.737 55.467 89.419 1.00 0.00 H ATOM 1682 HB2 SER A 106 4.359 55.017 91.631 1.00 0.00 H ATOM 1683 HB3 SER A 106 5.560 56.330 91.657 1.00 0.00 H ATOM 1684 HG SER A 106 6.535 54.237 91.415 1.00 0.00 H ATOM 1685 H SER A 106 6.297 57.006 89.141 1.00 0.00 H ATOM 1686 N MET A 107 2.345 57.352 90.253 1.00 35.64 N ATOM 1687 CA MET A 107 1.491 58.479 90.520 1.00 37.66 C ATOM 1688 C MET A 107 0.485 58.013 91.553 1.00 39.73 C ATOM 1689 O MET A 107 0.287 56.813 91.740 1.00 39.47 O ATOM 1690 CB MET A 107 0.793 58.909 89.229 1.00 35.73 C ATOM 1691 CG MET A 107 1.748 59.198 88.072 1.00 39.60 C ATOM 1692 SD MET A 107 0.864 59.231 86.504 1.00 42.79 S ATOM 1693 CE MET A 107 1.237 57.600 85.879 1.00 51.40 C ATOM 1694 HA MET A 107 2.050 59.338 90.889 1.00 0.00 H ATOM 1695 HB2 MET A 107 0.116 58.112 88.923 1.00 0.00 H ATOM 1696 HB3 MET A 107 0.219 59.813 89.434 1.00 0.00 H ATOM 1697 HG2 MET A 107 2.511 58.421 88.036 1.00 0.00 H ATOM 1698 HG3 MET A 107 2.224 60.165 88.234 1.00 0.00 H ATOM 1699 HE1 MET A 107 2.316 57.492 85.771 1.00 0.00 H ATOM 1700 HE2 MET A 107 0.863 56.851 86.577 1.00 0.00 H ATOM 1701 HE3 MET A 107 0.758 57.466 84.909 1.00 0.00 H ATOM 1702 H MET A 107 1.914 56.435 90.019 1.00 0.00 H ATOM 1703 N ARG A 108 -0.157 58.939 92.225 1.00 37.57 N ATOM 1704 CA ARG A 108 -1.190 58.606 93.178 1.00 39.65 C ATOM 1705 C ARG A 108 -2.407 59.309 92.668 1.00 44.04 C ATOM 1706 O ARG A 108 -2.401 60.525 92.612 1.00 48.94 O ATOM 1707 CB ARG A 108 -0.819 59.150 94.568 1.00 43.53 C ATOM 1708 CG ARG A 108 -1.752 58.763 95.689 1.00 53.46 C ATOM 1709 CD ARG A 108 -1.736 57.280 95.995 1.00 60.16 C ATOM 1710 NE ARG A 108 -0.593 56.806 96.777 1.00 64.81 N ATOM 1711 CZ ARG A 108 -0.510 55.565 97.232 1.00 67.85 C ATOM 1712 NH1 ARG A 108 -1.494 54.741 96.999 1.00 69.86 N ATOM 1713 NH2 ARG A 108 0.533 55.133 97.906 1.00 72.87 N ATOM 1714 HA ARG A 108 -1.335 57.530 93.277 1.00 0.00 H ATOM 1715 HB2 ARG A 108 0.176 58.783 94.818 1.00 0.00 H ATOM 1716 HB3 ARG A 108 -0.799 60.238 94.508 1.00 0.00 H ATOM 1717 HG2 ARG A 108 -1.458 59.305 96.588 1.00 0.00 H ATOM 1718 HG3 ARG A 108 -2.766 59.048 95.410 1.00 0.00 H ATOM 1719 HD2 ARG A 108 -1.740 56.742 95.047 1.00 0.00 H ATOM 1720 HD3 ARG A 108 -2.644 57.042 96.550 1.00 0.00 H ATOM 1721 HE ARG A 108 0.182 57.468 96.983 1.00 0.00 H ATOM 1722 HH12 ARG A 108 -1.447 53.763 97.348 1.00 0.00 H ATOM 1723 HH11 ARG A 108 -2.326 55.062 96.464 1.00 0.00 H ATOM 1724 HH22 ARG A 108 0.561 54.151 98.247 1.00 0.00 H ATOM 1725 HH21 ARG A 108 1.330 55.773 98.098 1.00 0.00 H ATOM 1726 H ARG A 108 0.084 59.938 92.067 1.00 0.00 H ATOM 1727 N ILE A 109 -3.441 58.570 92.271 1.00 40.43 N ATOM 1728 CA ILE A 109 -4.545 59.251 91.602 1.00 39.57 C ATOM 1729 C ILE A 109 -5.728 59.639 92.464 1.00 47.79 C ATOM 1730 O ILE A 109 -5.783 60.784 92.927 1.00 55.83 O ATOM 1731 CB ILE A 109 -4.786 58.749 90.174 1.00 37.96 C ATOM 1732 CG1 ILE A 109 -3.537 59.115 89.381 1.00 32.99 C ATOM 1733 CG2 ILE A 109 -6.022 59.394 89.593 1.00 36.77 C ATOM 1734 CD1 ILE A 109 -3.533 58.762 87.924 1.00 30.16 C ATOM 1735 HA ILE A 109 -4.200 60.269 91.420 1.00 0.00 H ATOM 1736 HB ILE A 109 -4.957 57.673 90.145 1.00 0.00 H ATOM 1737 HG12 ILE A 109 -3.401 60.194 89.460 1.00 0.00 H ATOM 1738 HG13 ILE A 109 -2.691 58.608 89.846 1.00 0.00 H ATOM 1739 HD11 ILE A 109 -3.648 57.684 87.812 1.00 0.00 H ATOM 1740 HD12 ILE A 109 -4.359 59.270 87.426 1.00 0.00 H ATOM 1741 HD13 ILE A 109 -2.589 59.076 87.478 1.00 0.00 H ATOM 1742 HG21 ILE A 109 -6.885 59.143 90.209 1.00 0.00 H ATOM 1743 HG22 ILE A 109 -5.890 60.476 89.573 1.00 0.00 H ATOM 1744 HG23 ILE A 109 -6.179 59.027 88.579 1.00 0.00 H ATOM 1745 H ILE A 109 -3.461 57.543 92.432 1.00 0.00 H ATOM 1746 N GLN A 110 -6.638 58.730 92.719 1.00 44.09 N ATOM 1747 CA GLN A 110 -7.658 59.022 93.708 1.00 46.53 C ATOM 1748 C GLN A 110 -7.433 58.036 94.811 1.00 48.14 C ATOM 1749 O GLN A 110 -8.258 57.215 95.097 1.00 51.09 O ATOM 1750 CB GLN A 110 -9.048 58.971 93.126 1.00 47.58 C ATOM 1751 CG GLN A 110 -9.396 60.230 92.375 1.00 46.84 C ATOM 1752 CD GLN A 110 -10.711 60.124 91.674 1.00 46.63 C ATOM 1753 OE1 GLN A 110 -10.902 59.283 90.825 1.00 43.51 O ATOM 1754 NE2 GLN A 110 -11.629 60.993 92.031 1.00 51.18 N ATOM 1755 HA GLN A 110 -7.580 60.042 94.085 1.00 0.00 H ATOM 1756 HB2 GLN A 110 -9.112 58.125 92.442 1.00 0.00 H ATOM 1757 HB3 GLN A 110 -9.764 58.836 93.937 1.00 0.00 H ATOM 1758 HG2 GLN A 110 -9.440 61.059 93.081 1.00 0.00 H ATOM 1759 HG3 GLN A 110 -8.619 60.424 91.636 1.00 0.00 H ATOM 1760 HE22 GLN A 110 -11.420 61.698 92.766 1.00 0.00 H ATOM 1761 HE21 GLN A 110 -12.565 60.976 91.579 1.00 0.00 H ATOM 1762 H GLN A 110 -6.629 57.817 92.221 1.00 0.00 H ATOM 1763 N GLY A 111 -6.255 58.132 95.398 1.00 51.64 N ATOM 1764 CA GLY A 111 -5.834 57.220 96.435 1.00 51.64 C ATOM 1765 C GLY A 111 -5.306 55.893 95.908 1.00 51.43 C ATOM 1766 O GLY A 111 -4.878 55.061 96.708 1.00 54.35 O ATOM 1767 HA3 GLY A 111 -6.687 57.018 97.083 1.00 0.00 H ATOM 1768 HA2 GLY A 111 -5.045 57.699 97.015 1.00 0.00 H ATOM 1769 H GLY A 111 -5.608 58.891 95.103 1.00 0.00 H ATOM 1770 N ARG A 112 -5.332 55.674 94.591 1.00 41.11 N ATOM 1771 CA ARG A 112 -4.770 54.445 94.035 1.00 39.18 C ATOM 1772 C ARG A 112 -3.375 54.678 93.505 1.00 46.32 C ATOM 1773 O ARG A 112 -3.104 55.716 92.896 1.00 50.24 O ATOM 1774 CB ARG A 112 -5.622 53.921 92.890 1.00 40.09 C ATOM 1775 CG ARG A 112 -7.024 53.626 93.275 1.00 44.97 C ATOM 1776 CD ARG A 112 -7.483 52.431 92.508 1.00 50.08 C ATOM 1777 NE ARG A 112 -8.811 52.010 92.915 1.00 50.00 N ATOM 1778 CZ ARG A 112 -9.275 50.782 92.718 1.00 50.11 C ATOM 1779 NH1 ARG A 112 -8.501 49.870 92.126 1.00 43.47 N ATOM 1780 NH2 ARG A 112 -10.507 50.462 93.105 1.00 46.99 N ATOM 1781 HA ARG A 112 -4.746 53.716 94.845 1.00 0.00 H ATOM 1782 HB2 ARG A 112 -5.633 54.670 92.098 1.00 0.00 H ATOM 1783 HB3 ARG A 112 -5.168 53.004 92.515 1.00 0.00 H ATOM 1784 HG2 ARG A 112 -7.077 53.420 94.344 1.00 0.00 H ATOM 1785 HG3 ARG A 112 -7.658 54.481 93.039 1.00 0.00 H ATOM 1786 HD2 ARG A 112 -6.785 51.612 92.678 1.00 0.00 H ATOM 1787 HD3 ARG A 112 -7.500 52.677 91.446 1.00 0.00 H ATOM 1788 HE ARG A 112 -9.429 52.703 93.383 1.00 0.00 H ATOM 1789 HH12 ARG A 112 -8.860 48.906 91.969 1.00 0.00 H ATOM 1790 HH11 ARG A 112 -7.539 50.123 91.821 1.00 0.00 H ATOM 1791 HH22 ARG A 112 -10.867 49.499 92.949 1.00 0.00 H ATOM 1792 HH21 ARG A 112 -11.110 51.175 93.563 1.00 0.00 H ATOM 1793 H ARG A 112 -5.755 56.382 93.957 1.00 0.00 H ATOM 1794 N LEU A 113 -2.492 53.709 93.725 1.00 37.70 N ATOM 1795 CA LEU A 113 -1.145 53.783 93.185 1.00 36.66 C ATOM 1796 C LEU A 113 -1.160 53.387 91.709 1.00 33.01 C ATOM 1797 O LEU A 113 -1.468 52.256 91.360 1.00 36.78 O ATOM 1798 CB LEU A 113 -0.212 52.847 93.936 1.00 42.21 C ATOM 1799 CG LEU A 113 1.192 52.804 93.328 1.00 52.36 C ATOM 1800 CD1 LEU A 113 1.880 54.152 93.473 1.00 53.61 C ATOM 1801 CD2 LEU A 113 2.035 51.693 93.948 1.00 55.78 C ATOM 1802 HA LEU A 113 -0.788 54.807 93.296 1.00 0.00 H ATOM 1803 HB2 LEU A 113 -0.135 53.185 94.969 1.00 0.00 H ATOM 1804 HB3 LEU A 113 -0.633 51.842 93.914 1.00 0.00 H ATOM 1805 HG LEU A 113 1.088 52.583 92.266 1.00 0.00 H ATOM 1806 HD21 LEU A 113 2.127 51.864 95.020 1.00 0.00 H ATOM 1807 HD22 LEU A 113 1.552 50.732 93.773 1.00 0.00 H ATOM 1808 HD23 LEU A 113 3.025 51.693 93.492 1.00 0.00 H ATOM 1809 HD11 LEU A 113 1.295 54.914 92.958 1.00 0.00 H ATOM 1810 HD12 LEU A 113 1.960 54.406 94.530 1.00 0.00 H ATOM 1811 HD13 LEU A 113 2.876 54.099 93.034 1.00 0.00 H ATOM 1812 H LEU A 113 -2.770 52.884 94.293 1.00 0.00 H ATOM 1813 N VAL A 114 -0.822 54.323 90.838 1.00 30.10 N ATOM 1814 CA VAL A 114 -0.819 54.030 89.418 1.00 27.12 C ATOM 1815 C VAL A 114 0.606 53.978 88.873 1.00 36.85 C ATOM 1816 O VAL A 114 1.389 54.925 89.036 1.00 36.06 O ATOM 1817 CB VAL A 114 -1.692 55.045 88.651 1.00 27.62 C ATOM 1818 CG1 VAL A 114 -1.689 54.739 87.149 1.00 26.65 C ATOM 1819 CG2 VAL A 114 -3.126 55.000 89.183 1.00 31.81 C ATOM 1820 HA VAL A 114 -1.256 53.043 89.268 1.00 0.00 H ATOM 1821 HB VAL A 114 -1.277 56.041 88.803 1.00 0.00 H ATOM 1822 HG11 VAL A 114 -0.668 54.795 86.770 1.00 0.00 H ATOM 1823 HG12 VAL A 114 -2.085 53.737 86.983 1.00 0.00 H ATOM 1824 HG13 VAL A 114 -2.311 55.468 86.630 1.00 0.00 H ATOM 1825 HG21 VAL A 114 -3.532 53.998 89.046 1.00 0.00 H ATOM 1826 HG22 VAL A 114 -3.127 55.251 90.244 1.00 0.00 H ATOM 1827 HG23 VAL A 114 -3.737 55.719 88.637 1.00 0.00 H ATOM 1828 H VAL A 114 -0.558 55.272 91.172 1.00 0.00 H ATOM 1829 N HIS A 115 0.959 52.851 88.268 1.00 24.50 N ATOM 1830 CA HIS A 115 2.217 52.769 87.554 1.00 26.46 C ATOM 1831 C HIS A 115 1.879 52.996 86.095 1.00 30.52 C ATOM 1832 O HIS A 115 1.234 52.162 85.456 1.00 25.65 O ATOM 1833 CB HIS A 115 2.875 51.409 87.752 1.00 27.32 C ATOM 1834 CG HIS A 115 4.142 51.240 86.971 1.00 29.03 C ATOM 1835 ND1 HIS A 115 5.307 51.901 87.291 1.00 34.59 N ATOM 1836 CD2 HIS A 115 4.430 50.468 85.896 1.00 26.99 C ATOM 1837 CE1 HIS A 115 6.257 51.554 86.440 1.00 37.83 C ATOM 1838 NE2 HIS A 115 5.750 50.686 85.582 1.00 34.10 N ATOM 1839 HA HIS A 115 2.928 53.509 87.921 1.00 0.00 H ATOM 1840 HB2 HIS A 115 3.103 51.286 88.811 1.00 0.00 H ATOM 1841 HB3 HIS A 115 2.172 50.636 87.441 1.00 0.00 H ATOM 1842 HD2 HIS A 115 3.743 49.799 85.377 1.00 0.00 H ATOM 1843 HE1 HIS A 115 7.283 51.921 86.445 1.00 0.00 H ATOM 1844 H HIS A 115 0.330 52.023 88.306 1.00 0.00 H ATOM 1845 N GLY A 116 2.276 54.147 85.567 1.00 32.30 N ATOM 1846 CA GLY A 116 1.788 54.505 84.244 1.00 31.08 C ATOM 1847 C GLY A 116 2.499 55.646 83.566 1.00 27.42 C ATOM 1848 O GLY A 116 3.517 56.158 84.037 1.00 27.45 O ATOM 1849 HA3 GLY A 116 0.736 54.775 84.338 1.00 0.00 H ATOM 1850 HA2 GLY A 116 1.880 53.627 83.605 1.00 0.00 H ATOM 1851 H GLY A 116 2.920 54.777 86.086 1.00 0.00 H ATOM 1852 N GLN A 117 1.929 56.063 82.444 1.00 27.07 N ATOM 1853 CA GLN A 117 2.545 57.042 81.595 1.00 27.63 C ATOM 1854 C GLN A 117 1.547 58.169 81.366 1.00 25.64 C ATOM 1855 O GLN A 117 0.399 57.915 81.024 1.00 24.40 O ATOM 1856 CB GLN A 117 2.874 56.362 80.277 1.00 26.81 C ATOM 1857 CG GLN A 117 3.960 57.025 79.469 1.00 31.35 C ATOM 1858 CD GLN A 117 4.478 56.096 78.401 1.00 31.59 C ATOM 1859 OE1 GLN A 117 3.945 54.993 78.200 1.00 33.95 O ATOM 1860 NE2 GLN A 117 5.507 56.526 77.703 1.00 32.20 N ATOM 1861 HA GLN A 117 3.452 57.449 82.041 1.00 0.00 H ATOM 1862 HB2 GLN A 117 3.189 55.341 80.493 1.00 0.00 H ATOM 1863 HB3 GLN A 117 1.968 56.341 79.672 1.00 0.00 H ATOM 1864 HG2 GLN A 117 3.558 57.922 78.998 1.00 0.00 H ATOM 1865 HG3 GLN A 117 4.781 57.301 80.131 1.00 0.00 H ATOM 1866 HE22 GLN A 117 5.921 57.458 77.907 1.00 0.00 H ATOM 1867 HE21 GLN A 117 5.906 55.934 76.947 1.00 0.00 H ATOM 1868 H GLN A 117 1.007 55.668 82.171 1.00 0.00 H ATOM 1869 N SER A 118 1.963 59.415 81.567 1.00 27.61 N ATOM 1870 CA SER A 118 1.082 60.522 81.197 1.00 27.75 C ATOM 1871 C SER A 118 1.207 60.756 79.711 1.00 30.27 C ATOM 1872 O SER A 118 2.188 60.350 79.075 1.00 31.40 O ATOM 1873 CB SER A 118 1.450 61.818 81.907 1.00 31.14 C ATOM 1874 OG SER A 118 1.428 61.647 83.304 1.00 38.86 O ATOM 1875 HA SER A 118 0.067 60.249 81.487 1.00 0.00 H ATOM 1876 HB2 SER A 118 0.735 62.593 81.630 1.00 0.00 H ATOM 1877 HB3 SER A 118 2.451 62.122 81.600 1.00 0.00 H ATOM 1878 HG SER A 118 1.670 62.500 83.744 1.00 0.00 H ATOM 1879 H SER A 118 2.899 59.600 81.980 1.00 0.00 H ATOM 1880 N GLY A 119 0.215 61.443 79.166 1.00 26.51 N ATOM 1881 CA GLY A 119 0.238 61.862 77.782 1.00 25.94 C ATOM 1882 C GLY A 119 -0.663 63.057 77.564 1.00 27.50 C ATOM 1883 O GLY A 119 -1.508 63.382 78.407 1.00 27.85 O ATOM 1884 HA3 GLY A 119 -0.103 61.039 77.154 1.00 0.00 H ATOM 1885 HA2 GLY A 119 1.258 62.129 77.507 1.00 0.00 H ATOM 1886 H GLY A 119 -0.608 61.689 79.752 1.00 0.00 H ATOM 1887 N MET A 120 -0.460 63.730 76.439 1.00 24.89 N ATOM 1888 CA MET A 120 -1.310 64.853 76.056 1.00 25.34 C ATOM 1889 C MET A 120 -2.176 64.487 74.863 1.00 24.07 C ATOM 1890 O MET A 120 -1.681 64.006 73.847 1.00 22.15 O ATOM 1891 CB MET A 120 -0.453 66.064 75.702 1.00 23.21 C ATOM 1892 CG MET A 120 0.417 66.554 76.863 1.00 47.97 C ATOM 1893 SD MET A 120 -0.540 67.408 78.143 1.00 66.52 S ATOM 1894 CE MET A 120 -0.450 69.084 77.571 1.00 86.16 C ATOM 1895 HA MET A 120 -1.953 65.095 76.902 1.00 0.00 H ATOM 1896 HB2 MET A 120 0.199 65.795 74.871 1.00 0.00 H ATOM 1897 HB3 MET A 120 -1.112 66.877 75.397 1.00 0.00 H ATOM 1898 HG2 MET A 120 1.167 67.241 76.471 1.00 0.00 H ATOM 1899 HG3 MET A 120 0.914 65.695 77.314 1.00 0.00 H ATOM 1900 HE1 MET A 120 0.593 69.396 77.527 1.00 0.00 H ATOM 1901 HE2 MET A 120 -0.893 69.152 76.578 1.00 0.00 H ATOM 1902 HE3 MET A 120 -0.995 69.731 78.258 1.00 0.00 H ATOM 1903 H MET A 120 0.324 63.451 75.815 1.00 0.00 H ATOM 1904 N LEU A 121 -3.477 64.706 75.006 1.00 19.71 N ATOM 1905 CA LEU A 121 -4.392 64.641 73.882 1.00 22.46 C ATOM 1906 C LEU A 121 -3.995 65.705 72.881 1.00 22.76 C ATOM 1907 O LEU A 121 -3.821 66.876 73.245 1.00 25.90 O ATOM 1908 CB LEU A 121 -5.797 64.957 74.360 1.00 30.91 C ATOM 1909 CG LEU A 121 -6.757 63.828 74.697 1.00 39.32 C ATOM 1910 CD1 LEU A 121 -8.121 64.479 74.704 1.00 41.96 C ATOM 1911 CD2 LEU A 121 -6.711 62.715 73.669 1.00 38.33 C ATOM 1912 HA LEU A 121 -4.358 63.647 73.436 1.00 0.00 H ATOM 1913 HB2 LEU A 121 -5.695 65.563 75.260 1.00 0.00 H ATOM 1914 HB3 LEU A 121 -6.270 65.550 73.577 1.00 0.00 H ATOM 1915 HG LEU A 121 -6.501 63.361 75.648 1.00 0.00 H ATOM 1916 HD21 LEU A 121 -6.984 63.113 72.692 1.00 0.00 H ATOM 1917 HD22 LEU A 121 -5.703 62.303 73.626 1.00 0.00 H ATOM 1918 HD23 LEU A 121 -7.413 61.931 73.952 1.00 0.00 H ATOM 1919 HD11 LEU A 121 -8.142 65.268 75.455 1.00 0.00 H ATOM 1920 HD12 LEU A 121 -8.324 64.906 73.722 1.00 0.00 H ATOM 1921 HD13 LEU A 121 -8.878 63.731 74.940 1.00 0.00 H ATOM 1922 H LEU A 121 -3.851 64.930 75.950 1.00 0.00 H ATOM 1923 N LEU A 122 -3.850 65.328 71.618 1.00 21.91 N ATOM 1924 CA LEU A 122 -3.365 66.285 70.622 1.00 25.86 C ATOM 1925 C LEU A 122 -4.440 67.240 70.090 1.00 26.36 C ATOM 1926 O LEU A 122 -5.562 66.824 69.808 1.00 30.55 O ATOM 1927 CB LEU A 122 -2.689 65.545 69.472 1.00 22.79 C ATOM 1928 CG LEU A 122 -1.515 64.698 69.982 1.00 30.29 C ATOM 1929 CD1 LEU A 122 -0.787 64.035 68.833 1.00 34.88 C ATOM 1930 CD2 LEU A 122 -0.539 65.521 70.838 1.00 31.22 C ATOM 1931 HA LEU A 122 -2.642 66.918 71.138 1.00 0.00 H ATOM 1932 HB2 LEU A 122 -3.417 64.893 68.990 1.00 0.00 H ATOM 1933 HB3 LEU A 122 -2.318 66.271 68.749 1.00 0.00 H ATOM 1934 HG LEU A 122 -1.935 63.922 70.622 1.00 0.00 H ATOM 1935 HD21 LEU A 122 -0.135 66.339 70.241 1.00 0.00 H ATOM 1936 HD22 LEU A 122 -1.067 65.926 71.701 1.00 0.00 H ATOM 1937 HD23 LEU A 122 0.275 64.880 71.176 1.00 0.00 H ATOM 1938 HD11 LEU A 122 -1.477 63.388 68.292 1.00 0.00 H ATOM 1939 HD12 LEU A 122 -0.401 64.800 68.159 1.00 0.00 H ATOM 1940 HD13 LEU A 122 0.040 63.441 69.223 1.00 0.00 H ATOM 1941 H LEU A 122 -4.080 64.354 71.335 1.00 0.00 H ATOM 1942 N THR A 123 -4.087 68.522 69.970 1.00 26.10 N ATOM 1943 CA THR A 123 -4.953 69.512 69.329 1.00 29.64 C ATOM 1944 C THR A 123 -5.273 69.034 67.918 1.00 34.04 C ATOM 1945 O THR A 123 -4.402 68.521 67.222 1.00 25.46 O ATOM 1946 CB THR A 123 -4.246 70.893 69.180 1.00 34.44 C ATOM 1947 OG1 THR A 123 -3.912 71.420 70.470 1.00 36.55 O ATOM 1948 CG2 THR A 123 -5.143 71.894 68.449 1.00 41.04 C ATOM 1949 HA THR A 123 -5.842 69.623 69.950 1.00 0.00 H ATOM 1950 HB THR A 123 -3.338 70.740 68.597 1.00 0.00 H ATOM 1951 HG1 THR A 123 -3.464 72.296 70.361 1.00 0.00 H ATOM 1952 HG23 THR A 123 -5.401 71.499 67.466 1.00 0.00 H ATOM 1953 HG21 THR A 123 -6.053 72.055 69.028 1.00 0.00 H ATOM 1954 HG22 THR A 123 -4.612 72.839 68.334 1.00 0.00 H ATOM 1955 H THR A 123 -3.166 68.827 70.345 1.00 0.00 H ATOM 1956 N GLY A 124 -6.520 69.206 67.499 1.00 38.03 N ATOM 1957 CA GLY A 124 -6.914 68.901 66.137 1.00 42.51 C ATOM 1958 C GLY A 124 -7.677 70.088 65.580 1.00 50.05 C ATOM 1959 O GLY A 124 -7.965 70.153 64.377 1.00 58.22 O ATOM 1960 HA3 GLY A 124 -7.551 68.017 66.127 1.00 0.00 H ATOM 1961 HA2 GLY A 124 -6.028 68.715 65.530 1.00 0.00 H ATOM 1962 H GLY A 124 -7.233 69.569 68.164 1.00 0.00 H TER 1963 GLY A 124 ATOM 1964 N ASP A 131 -17.393 66.284 73.246 1.00 58.99 N ATOM 1965 CA ASP A 131 -16.033 66.687 73.603 1.00 63.19 C ATOM 1966 C ASP A 131 -15.028 66.072 72.624 1.00 64.00 C ATOM 1967 O ASP A 131 -15.402 65.338 71.701 1.00 68.84 O ATOM 1968 CB ASP A 131 -15.706 66.269 75.022 1.00 64.52 C ATOM 1969 HA ASP A 131 -15.967 67.773 73.542 1.00 0.00 H ATOM 1970 HB2 ASP A 131 -16.407 66.743 75.710 1.00 0.00 H ATOM 1971 HB3 ASP A 131 -15.787 65.185 75.108 1.00 0.00 H ATOM 1972 HN3 ASP A 131 -17.468 65.247 73.285 1.00 0.00 H ATOM 1973 HN2 ASP A 131 -17.609 66.612 72.283 1.00 0.00 H ATOM 1974 HN1 ASP A 131 -18.066 66.707 73.917 1.00 0.00 H ATOM 1975 N LEU A 132 -13.749 66.368 72.805 1.00 56.56 N ATOM 1976 CA LEU A 132 -12.766 65.766 71.927 1.00 50.04 C ATOM 1977 C LEU A 132 -12.104 64.564 72.592 1.00 43.98 C ATOM 1978 O LEU A 132 -11.422 63.788 71.930 1.00 44.64 O ATOM 1979 CB LEU A 132 -11.723 66.799 71.507 1.00 53.71 C ATOM 1980 HA LEU A 132 -13.278 65.412 71.032 1.00 0.00 H ATOM 1981 HB2 LEU A 132 -12.215 67.617 70.981 1.00 0.00 H ATOM 1982 HB3 LEU A 132 -11.219 67.185 72.393 1.00 0.00 H ATOM 1983 H LEU A 132 -13.457 67.019 73.562 1.00 0.00 H ATOM 1984 N GLY A 133 -12.333 64.388 73.893 1.00 33.51 N ATOM 1985 CA GLY A 133 -11.473 63.518 74.680 1.00 25.29 C ATOM 1986 C GLY A 133 -12.054 62.250 75.252 1.00 24.15 C ATOM 1987 O GLY A 133 -13.052 61.740 74.760 1.00 22.92 O ATOM 1988 HA3 GLY A 133 -11.101 64.107 75.518 1.00 0.00 H ATOM 1989 HA2 GLY A 133 -10.638 63.229 74.042 1.00 0.00 H ATOM 1990 H GLY A 133 -13.131 64.875 74.348 1.00 0.00 H ATOM 1991 N THR A 134 -11.405 61.728 76.294 1.00 19.90 N ATOM 1992 CA THR A 134 -11.906 60.544 76.989 1.00 17.13 C ATOM 1993 C THR A 134 -13.022 60.911 77.959 1.00 19.82 C ATOM 1994 O THR A 134 -13.197 62.085 78.309 1.00 25.29 O ATOM 1995 CB THR A 134 -10.805 59.821 77.782 1.00 17.42 C ATOM 1996 OG1 THR A 134 -10.193 60.717 78.744 1.00 16.97 O ATOM 1997 CG2 THR A 134 -9.750 59.284 76.841 1.00 18.55 C ATOM 1998 HA THR A 134 -12.281 59.877 76.212 1.00 0.00 H ATOM 1999 HB THR A 134 -11.262 58.990 78.320 1.00 0.00 H ATOM 2000 HG1 THR A 134 -9.792 61.487 78.268 1.00 0.00 H ATOM 2001 HG23 THR A 134 -10.216 58.612 76.121 1.00 0.00 H ATOM 2002 HG21 THR A 134 -9.279 60.114 76.314 1.00 0.00 H ATOM 2003 HG22 THR A 134 -8.997 58.741 77.413 1.00 0.00 H ATOM 2004 H THR A 134 -10.523 62.173 76.619 1.00 0.00 H ATOM 2005 N ILE A 135 -13.776 59.905 78.382 1.00 20.41 N ATOM 2006 CA ILE A 135 -14.819 60.076 79.394 1.00 22.16 C ATOM 2007 C ILE A 135 -14.658 59.015 80.472 1.00 20.33 C ATOM 2008 O ILE A 135 -13.901 58.058 80.309 1.00 19.17 O ATOM 2009 CB ILE A 135 -16.236 59.934 78.786 1.00 24.05 C ATOM 2010 CG1 ILE A 135 -16.367 58.574 78.077 1.00 21.07 C ATOM 2011 CG2 ILE A 135 -16.527 61.113 77.861 1.00 27.91 C ATOM 2012 CD1 ILE A 135 -17.783 58.243 77.567 1.00 20.25 C ATOM 2013 HA ILE A 135 -14.712 61.078 79.809 1.00 0.00 H ATOM 2014 HB ILE A 135 -16.986 59.957 79.577 1.00 0.00 H ATOM 2015 HG12 ILE A 135 -15.690 58.570 77.223 1.00 0.00 H ATOM 2016 HG13 ILE A 135 -16.069 57.795 78.779 1.00 0.00 H ATOM 2017 HD11 ILE A 135 -18.476 58.227 78.408 1.00 0.00 H ATOM 2018 HD12 ILE A 135 -18.096 59.002 76.851 1.00 0.00 H ATOM 2019 HD13 ILE A 135 -17.774 57.266 77.083 1.00 0.00 H ATOM 2020 HG21 ILE A 135 -16.471 62.041 78.429 1.00 0.00 H ATOM 2021 HG22 ILE A 135 -15.791 61.133 77.057 1.00 0.00 H ATOM 2022 HG23 ILE A 135 -17.526 61.004 77.438 1.00 0.00 H ATOM 2023 H ILE A 135 -13.620 58.959 77.979 1.00 0.00 H ATOM 2024 N PRO A 136 -15.372 59.178 81.590 1.00 19.46 N ATOM 2025 CA PRO A 136 -15.224 58.191 82.671 1.00 17.01 C ATOM 2026 C PRO A 136 -15.466 56.715 82.292 1.00 22.96 C ATOM 2027 O PRO A 136 -14.851 55.835 82.903 1.00 22.35 O ATOM 2028 CB PRO A 136 -16.240 58.678 83.701 1.00 25.82 C ATOM 2029 CG PRO A 136 -16.261 60.163 83.501 1.00 26.02 C ATOM 2030 CD PRO A 136 -16.109 60.379 82.026 1.00 25.40 C ATOM 2031 HA PRO A 136 -14.190 58.154 83.013 1.00 0.00 H ATOM 2032 HD3 PRO A 136 -17.081 60.442 81.537 1.00 0.00 H ATOM 2033 HD2 PRO A 136 -15.540 61.285 81.819 1.00 0.00 H ATOM 2034 HG3 PRO A 136 -15.437 60.631 84.040 1.00 0.00 H ATOM 2035 HG2 PRO A 136 -17.205 60.580 83.851 1.00 0.00 H ATOM 2036 HB2 PRO A 136 -17.223 58.246 83.513 1.00 0.00 H ATOM 2037 HB3 PRO A 136 -15.921 58.426 84.712 1.00 0.00 H ATOM 2038 N GLY A 137 -16.308 56.427 81.302 1.00 22.38 N ATOM 2039 CA GLY A 137 -16.558 55.038 80.923 1.00 18.21 C ATOM 2040 C GLY A 137 -15.496 54.408 80.022 1.00 16.75 C ATOM 2041 O GLY A 137 -15.646 53.257 79.600 1.00 15.35 O ATOM 2042 HA3 GLY A 137 -17.513 54.998 80.398 1.00 0.00 H ATOM 2043 HA2 GLY A 137 -16.621 54.445 81.836 1.00 0.00 H ATOM 2044 H GLY A 137 -16.791 57.196 80.795 1.00 0.00 H ATOM 2045 N ASP A 138 -14.433 55.160 79.733 1.00 13.24 N ATOM 2046 CA ASP A 138 -13.407 54.746 78.766 1.00 14.53 C ATOM 2047 C ASP A 138 -12.255 53.952 79.390 1.00 15.61 C ATOM 2048 O ASP A 138 -11.340 53.521 78.655 1.00 15.65 O ATOM 2049 CB ASP A 138 -12.782 55.964 78.063 1.00 15.64 C ATOM 2050 CG ASP A 138 -13.697 56.616 77.045 1.00 15.92 C ATOM 2051 OD1 ASP A 138 -14.697 55.987 76.607 1.00 17.86 O ATOM 2052 OD2 ASP A 138 -13.374 57.759 76.637 1.00 19.70 O ATOM 2053 HA ASP A 138 -13.938 54.105 78.063 1.00 0.00 H ATOM 2054 HB2 ASP A 138 -12.526 56.705 78.820 1.00 0.00 H ATOM 2055 HB3 ASP A 138 -11.875 55.639 77.553 1.00 0.00 H ATOM 2056 H ASP A 138 -14.326 56.077 80.212 1.00 0.00 H ATOM 2057 N CYS A 139 -12.246 53.758 80.707 1.00 16.43 N ATOM 2058 CA CYS A 139 -11.069 53.081 81.278 1.00 16.47 C ATOM 2059 C CYS A 139 -10.914 51.668 80.758 1.00 13.03 C ATOM 2060 O CYS A 139 -11.892 50.957 80.539 1.00 16.85 O ATOM 2061 CB CYS A 139 -11.030 53.088 82.796 1.00 15.89 C ATOM 2062 SG CYS A 139 -10.827 54.765 83.430 1.00 18.18 S ATOM 2063 HA CYS A 139 -10.220 53.675 80.938 1.00 0.00 H ATOM 2064 HB2 CYS A 139 -10.194 52.475 83.134 1.00 0.00 H ATOM 2065 HB3 CYS A 139 -11.962 52.672 83.179 1.00 0.00 H ATOM 2066 HG CYS A 139 -10.796 54.733 84.809 1.00 0.00 H ATOM 2067 H CYS A 139 -13.036 54.071 81.307 1.00 0.00 H ATOM 2068 N GLY A 140 -9.662 51.276 80.531 1.00 16.63 N ATOM 2069 CA GLY A 140 -9.384 49.960 79.991 1.00 17.08 C ATOM 2070 C GLY A 140 -9.109 49.963 78.495 1.00 19.97 C ATOM 2071 O GLY A 140 -8.553 48.992 77.980 1.00 18.02 O ATOM 2072 HA3 GLY A 140 -10.245 49.319 80.182 1.00 0.00 H ATOM 2073 HA2 GLY A 140 -8.510 49.555 80.502 1.00 0.00 H ATOM 2074 H GLY A 140 -8.875 51.921 80.744 1.00 0.00 H ATOM 2075 N ALA A 141 -9.489 51.034 77.792 1.00 14.73 N ATOM 2076 CA ALA A 141 -9.195 51.123 76.348 1.00 14.98 C ATOM 2077 C ALA A 141 -7.679 51.102 76.132 1.00 12.49 C ATOM 2078 O ALA A 141 -6.924 51.720 76.866 1.00 14.13 O ATOM 2079 CB ALA A 141 -9.782 52.394 75.757 1.00 16.00 C ATOM 2080 HA ALA A 141 -9.648 50.268 75.846 1.00 0.00 H ATOM 2081 HB1 ALA A 141 -10.863 52.393 75.897 1.00 0.00 H ATOM 2082 HB2 ALA A 141 -9.350 53.260 76.259 1.00 0.00 H ATOM 2083 HB3 ALA A 141 -9.553 52.438 74.692 1.00 0.00 H ATOM 2084 H ALA A 141 -9.995 51.810 78.265 1.00 0.00 H ATOM 2085 N PRO A 142 -7.224 50.427 75.070 1.00 11.28 N ATOM 2086 CA PRO A 142 -5.779 50.236 74.887 1.00 13.81 C ATOM 2087 C PRO A 142 -5.061 51.428 74.236 1.00 15.08 C ATOM 2088 O PRO A 142 -5.657 52.087 73.366 1.00 15.22 O ATOM 2089 CB PRO A 142 -5.749 49.067 73.906 1.00 10.22 C ATOM 2090 CG PRO A 142 -6.928 49.328 73.029 1.00 13.17 C ATOM 2091 CD PRO A 142 -7.999 49.705 74.053 1.00 10.92 C ATOM 2092 HA PRO A 142 -5.275 50.094 75.843 1.00 0.00 H ATOM 2093 HD3 PRO A 142 -8.761 50.346 73.609 1.00 0.00 H ATOM 2094 HD2 PRO A 142 -8.472 48.818 74.474 1.00 0.00 H ATOM 2095 HG3 PRO A 142 -7.211 48.438 72.467 1.00 0.00 H ATOM 2096 HG2 PRO A 142 -6.735 50.147 72.336 1.00 0.00 H ATOM 2097 HB2 PRO A 142 -4.825 49.065 73.328 1.00 0.00 H ATOM 2098 HB3 PRO A 142 -5.852 48.116 74.428 1.00 0.00 H ATOM 2099 N TYR A 143 -3.805 51.682 74.624 1.00 13.10 N ATOM 2100 CA TYR A 143 -2.967 52.672 73.955 1.00 14.68 C ATOM 2101 C TYR A 143 -2.083 51.889 73.010 1.00 18.26 C ATOM 2102 O TYR A 143 -1.390 50.972 73.453 1.00 18.11 O ATOM 2103 CB TYR A 143 -2.085 53.409 74.978 1.00 16.04 C ATOM 2104 CG TYR A 143 -2.833 54.457 75.789 1.00 14.26 C ATOM 2105 CD1 TYR A 143 -2.298 55.743 75.951 1.00 17.35 C ATOM 2106 CD2 TYR A 143 -4.042 54.171 76.393 1.00 14.37 C ATOM 2107 CE1 TYR A 143 -2.961 56.702 76.690 1.00 16.13 C ATOM 2108 CE2 TYR A 143 -4.722 55.135 77.131 1.00 17.36 C ATOM 2109 CZ TYR A 143 -4.176 56.395 77.278 1.00 17.88 C ATOM 2110 OH TYR A 143 -4.856 57.354 78.029 1.00 15.87 O ATOM 2111 HA TYR A 143 -3.573 53.416 73.438 1.00 0.00 H ATOM 2112 HB3 TYR A 143 -1.275 53.903 74.442 1.00 0.00 H ATOM 2113 HB2 TYR A 143 -1.668 52.674 75.666 1.00 0.00 H ATOM 2114 HD2 TYR A 143 -4.470 53.174 76.290 1.00 0.00 H ATOM 2115 HE2 TYR A 143 -5.681 54.897 77.591 1.00 0.00 H ATOM 2116 HE1 TYR A 143 -2.530 57.696 76.810 1.00 0.00 H ATOM 2117 HD1 TYR A 143 -1.343 55.989 75.486 1.00 0.00 H ATOM 2118 HH TYR A 143 -4.969 57.026 78.956 1.00 0.00 H ATOM 2119 H TYR A 143 -3.413 51.155 75.430 1.00 0.00 H ATOM 2120 N VAL A 144 -2.136 52.201 71.720 1.00 17.42 N ATOM 2121 CA VAL A 144 -1.416 51.396 70.733 1.00 19.24 C ATOM 2122 C VAL A 144 -0.600 52.236 69.762 1.00 22.58 C ATOM 2123 O VAL A 144 -0.795 53.452 69.636 1.00 21.19 O ATOM 2124 CB VAL A 144 -2.388 50.520 69.910 1.00 17.59 C ATOM 2125 CG1 VAL A 144 -3.253 49.625 70.838 1.00 16.68 C ATOM 2126 CG2 VAL A 144 -3.268 51.397 69.037 1.00 18.70 C ATOM 2127 HA VAL A 144 -0.735 50.772 71.311 1.00 0.00 H ATOM 2128 HB VAL A 144 -1.801 49.863 69.268 1.00 0.00 H ATOM 2129 HG11 VAL A 144 -2.603 48.973 71.421 1.00 0.00 H ATOM 2130 HG12 VAL A 144 -3.834 50.256 71.510 1.00 0.00 H ATOM 2131 HG13 VAL A 144 -3.927 49.020 70.232 1.00 0.00 H ATOM 2132 HG21 VAL A 144 -3.843 52.075 69.668 1.00 0.00 H ATOM 2133 HG22 VAL A 144 -2.642 51.975 68.357 1.00 0.00 H ATOM 2134 HG23 VAL A 144 -3.948 50.769 68.462 1.00 0.00 H ATOM 2135 H VAL A 144 -2.693 53.023 71.410 1.00 0.00 H ATOM 2136 N HIS A 145 0.312 51.575 69.058 1.00 17.76 N ATOM 2137 CA HIS A 145 1.015 52.225 67.979 1.00 20.68 C ATOM 2138 C HIS A 145 1.548 51.165 67.051 1.00 25.28 C ATOM 2139 O HIS A 145 1.595 49.978 67.401 1.00 19.73 O ATOM 2140 CB HIS A 145 2.130 53.135 68.501 1.00 21.67 C ATOM 2141 CG HIS A 145 3.304 52.408 69.083 1.00 23.83 C ATOM 2142 ND1 HIS A 145 3.365 52.014 70.409 1.00 30.30 N ATOM 2143 CD2 HIS A 145 4.484 52.038 68.535 1.00 24.99 C ATOM 2144 CE1 HIS A 145 4.519 51.423 70.640 1.00 26.30 C ATOM 2145 NE2 HIS A 145 5.219 51.419 69.517 1.00 29.44 N ATOM 2146 HA HIS A 145 0.328 52.872 67.433 1.00 0.00 H ATOM 2147 HB2 HIS A 145 2.485 53.748 67.673 1.00 0.00 H ATOM 2148 HB3 HIS A 145 1.711 53.779 69.274 1.00 0.00 H ATOM 2149 HD2 HIS A 145 4.795 52.201 67.503 1.00 0.00 H ATOM 2150 HE1 HIS A 145 4.843 51.008 71.594 1.00 0.00 H ATOM 2151 H HIS A 145 0.521 50.582 69.286 1.00 0.00 H ATOM 2152 N LYS A 146 1.934 51.589 65.858 1.00 31.12 N ATOM 2153 CA LYS A 146 2.311 50.627 64.862 1.00 37.02 C ATOM 2154 C LYS A 146 3.792 50.673 64.658 1.00 35.95 C ATOM 2155 O LYS A 146 4.374 51.756 64.518 1.00 39.21 O ATOM 2156 CB LYS A 146 1.557 50.870 63.568 1.00 38.60 C ATOM 2157 CG LYS A 146 1.674 49.721 62.633 1.00 38.48 C ATOM 2158 CD LYS A 146 0.492 49.711 61.748 1.00 39.35 C ATOM 2159 CE LYS A 146 0.619 48.644 60.727 1.00 42.02 C ATOM 2160 NZ LYS A 146 0.152 49.273 59.483 1.00 44.94 N ATOM 2161 HA LYS A 146 2.043 49.627 65.205 1.00 0.00 H ATOM 2162 HB2 LYS A 146 0.504 51.031 63.799 1.00 0.00 H ATOM 2163 HB3 LYS A 146 1.962 51.760 63.086 1.00 0.00 H ATOM 2164 HG2 LYS A 146 2.580 49.824 62.035 1.00 0.00 H ATOM 2165 HG3 LYS A 146 1.718 48.790 63.198 1.00 0.00 H ATOM 2166 HD2 LYS A 146 -0.402 49.532 62.345 1.00 0.00 H ATOM 2167 HD3 LYS A 146 0.408 50.677 61.250 1.00 0.00 H ATOM 2168 HE2 LYS A 146 -0.004 47.787 60.984 1.00 0.00 H ATOM 2169 HE3 LYS A 146 1.656 48.322 60.632 1.00 0.00 H ATOM 2170 HZ1 LYS A 146 -0.833 49.583 59.602 1.00 0.00 H ATOM 2171 HZ2 LYS A 146 0.752 50.094 59.265 1.00 0.00 H ATOM 2172 HZ3 LYS A 146 0.209 48.585 58.705 1.00 0.00 H ATOM 2173 H LYS A 146 1.964 52.607 65.645 1.00 0.00 H ATOM 2174 N ARG A 147 4.390 49.486 64.661 1.00 35.00 N ATOM 2175 CA ARG A 147 5.825 49.333 64.608 1.00 37.01 C ATOM 2176 C ARG A 147 6.201 48.434 63.451 1.00 35.50 C ATOM 2177 O ARG A 147 5.949 47.226 63.482 1.00 35.43 O ATOM 2178 CB ARG A 147 6.308 48.654 65.865 1.00 41.10 C ATOM 2179 CG ARG A 147 7.586 47.905 65.616 1.00 47.81 C ATOM 2180 CD ARG A 147 7.990 47.220 66.857 1.00 48.32 C ATOM 2181 NE ARG A 147 8.102 48.230 67.887 1.00 43.99 N ATOM 2182 CZ ARG A 147 8.121 47.963 69.179 1.00 41.30 C ATOM 2183 NH1 ARG A 147 8.026 46.705 69.611 1.00 36.49 N ATOM 2184 NH2 ARG A 147 8.246 48.962 70.039 1.00 43.54 N ATOM 2185 HA ARG A 147 6.272 50.321 64.497 1.00 0.00 H ATOM 2186 HB2 ARG A 147 6.480 49.407 66.634 1.00 0.00 H ATOM 2187 HB3 ARG A 147 5.546 47.954 66.208 1.00 0.00 H ATOM 2188 HG2 ARG A 147 7.431 47.170 64.826 1.00 0.00 H ATOM 2189 HG3 ARG A 147 8.366 48.603 65.313 1.00 0.00 H ATOM 2190 HD2 ARG A 147 8.950 46.724 66.714 1.00 0.00 H ATOM 2191 HD3 ARG A 147 7.239 46.482 67.138 1.00 0.00 H ATOM 2192 HE ARG A 147 8.172 49.225 67.592 1.00 0.00 H ATOM 2193 HH12 ARG A 147 8.042 46.503 70.631 1.00 0.00 H ATOM 2194 HH11 ARG A 147 7.936 45.926 68.928 1.00 0.00 H ATOM 2195 HH22 ARG A 147 8.263 48.769 71.061 1.00 0.00 H ATOM 2196 HH21 ARG A 147 8.327 49.939 69.693 1.00 0.00 H ATOM 2197 H ARG A 147 3.799 48.631 64.703 1.00 0.00 H ATOM 2198 N GLY A 148 6.840 49.005 62.444 1.00 38.67 N ATOM 2199 CA GLY A 148 6.974 48.292 61.197 1.00 40.55 C ATOM 2200 C GLY A 148 5.558 48.037 60.734 1.00 36.93 C ATOM 2201 O GLY A 148 4.746 48.961 60.700 1.00 38.00 O ATOM 2202 HA3 GLY A 148 7.502 47.351 61.349 1.00 0.00 H ATOM 2203 HA2 GLY A 148 7.513 48.896 60.467 1.00 0.00 H ATOM 2204 H GLY A 148 7.242 49.958 62.550 1.00 0.00 H ATOM 2205 N ASN A 149 5.253 46.785 60.407 1.00 36.14 N ATOM 2206 CA ASN A 149 3.932 46.426 59.901 1.00 39.46 C ATOM 2207 C ASN A 149 2.999 45.928 60.988 1.00 36.66 C ATOM 2208 O ASN A 149 1.856 45.554 60.703 1.00 40.68 O ATOM 2209 CB ASN A 149 4.047 45.315 58.864 1.00 44.13 C ATOM 2210 CG ASN A 149 4.985 45.663 57.744 1.00 54.23 C ATOM 2211 OD1 ASN A 149 4.830 46.694 57.090 1.00 59.26 O ATOM 2212 ND2 ASN A 149 5.973 44.805 57.512 1.00 55.34 N ATOM 2213 HA ASN A 149 3.521 47.339 59.470 1.00 0.00 H ATOM 2214 HB2 ASN A 149 4.411 44.414 59.357 1.00 0.00 H ATOM 2215 HB3 ASN A 149 3.059 45.125 58.445 1.00 0.00 H ATOM 2216 HD22 ASN A 149 6.063 43.946 58.092 1.00 0.00 H ATOM 2217 HD21 ASN A 149 6.656 44.992 56.751 1.00 0.00 H ATOM 2218 H ASN A 149 5.974 46.043 60.514 1.00 0.00 H ATOM 2219 N ASP A 150 3.491 45.877 62.222 1.00 31.40 N ATOM 2220 CA ASP A 150 2.736 45.248 63.310 1.00 31.38 C ATOM 2221 C ASP A 150 2.216 46.268 64.293 1.00 27.74 C ATOM 2222 O ASP A 150 2.887 47.247 64.603 1.00 29.36 O ATOM 2223 CB ASP A 150 3.630 44.316 64.122 1.00 35.81 C ATOM 2224 CG ASP A 150 4.238 43.208 63.301 1.00 46.38 C ATOM 2225 OD1 ASP A 150 3.485 42.441 62.658 1.00 42.45 O ATOM 2226 OD2 ASP A 150 5.486 43.107 63.308 1.00 52.76 O ATOM 2227 HA ASP A 150 1.916 44.712 62.831 1.00 0.00 H ATOM 2228 HB2 ASP A 150 4.436 44.904 64.560 1.00 0.00 H ATOM 2229 HB3 ASP A 150 3.033 43.870 64.918 1.00 0.00 H ATOM 2230 H ASP A 150 4.425 46.289 62.418 1.00 0.00 H ATOM 2231 N TRP A 151 1.045 46.004 64.841 1.00 21.66 N ATOM 2232 CA TRP A 151 0.540 46.818 65.923 1.00 17.08 C ATOM 2233 C TRP A 151 1.041 46.336 67.278 1.00 21.63 C ATOM 2234 O TRP A 151 1.184 45.131 67.502 1.00 23.00 O ATOM 2235 CB TRP A 151 -0.981 46.779 65.926 1.00 16.08 C ATOM 2236 CG TRP A 151 -1.578 47.505 64.779 1.00 21.87 C ATOM 2237 CD1 TRP A 151 -1.957 46.983 63.581 1.00 21.15 C ATOM 2238 CD2 TRP A 151 -1.846 48.905 64.716 1.00 20.53 C ATOM 2239 NE1 TRP A 151 -2.463 47.975 62.774 1.00 21.08 N ATOM 2240 CE2 TRP A 151 -2.404 49.167 63.451 1.00 22.29 C ATOM 2241 CE3 TRP A 151 -1.674 49.964 65.615 1.00 21.68 C ATOM 2242 CZ2 TRP A 151 -2.781 50.447 63.055 1.00 25.30 C ATOM 2243 CZ3 TRP A 151 -2.068 51.227 65.230 1.00 27.07 C ATOM 2244 CH2 TRP A 151 -2.608 51.462 63.960 1.00 24.68 C ATOM 2245 HA TRP A 151 0.901 47.834 65.763 1.00 0.00 H ATOM 2246 HB2 TRP A 151 -1.303 45.738 65.885 1.00 0.00 H ATOM 2247 HB3 TRP A 151 -1.339 47.233 66.850 1.00 0.00 H ATOM 2248 HE1 TRP A 151 -2.830 47.843 61.810 1.00 0.00 H ATOM 2249 HD1 TRP A 151 -1.872 45.933 63.302 1.00 0.00 H ATOM 2250 HZ2 TRP A 151 -3.197 50.635 62.065 1.00 0.00 H ATOM 2251 HH2 TRP A 151 -2.898 52.476 63.684 1.00 0.00 H ATOM 2252 HZ3 TRP A 151 -1.957 52.058 65.927 1.00 0.00 H ATOM 2253 HE3 TRP A 151 -1.238 49.793 66.599 1.00 0.00 H ATOM 2254 H TRP A 151 0.481 45.203 64.491 1.00 0.00 H ATOM 2255 N VAL A 152 1.294 47.282 68.175 1.00 16.55 N ATOM 2256 CA VAL A 152 1.802 46.974 69.500 1.00 17.61 C ATOM 2257 C VAL A 152 0.897 47.669 70.515 1.00 17.45 C ATOM 2258 O VAL A 152 0.377 48.740 70.239 1.00 20.32 O ATOM 2259 CB VAL A 152 3.252 47.520 69.624 1.00 28.19 C ATOM 2260 CG1 VAL A 152 3.672 47.706 71.071 1.00 33.50 C ATOM 2261 CG2 VAL A 152 4.233 46.626 68.832 1.00 27.72 C ATOM 2262 HA VAL A 152 1.812 45.899 69.677 1.00 0.00 H ATOM 2263 HB VAL A 152 3.279 48.515 69.179 1.00 0.00 H ATOM 2264 HG11 VAL A 152 3.000 48.415 71.555 1.00 0.00 H ATOM 2265 HG12 VAL A 152 3.625 46.747 71.588 1.00 0.00 H ATOM 2266 HG13 VAL A 152 4.692 48.089 71.106 1.00 0.00 H ATOM 2267 HG21 VAL A 152 4.200 45.611 69.229 1.00 0.00 H ATOM 2268 HG22 VAL A 152 3.945 46.616 67.781 1.00 0.00 H ATOM 2269 HG23 VAL A 152 5.244 47.023 68.930 1.00 0.00 H ATOM 2270 H VAL A 152 1.123 48.276 67.920 1.00 0.00 H ATOM 2271 N VAL A 153 0.689 47.059 71.677 1.00 18.03 N ATOM 2272 CA VAL A 153 -0.138 47.693 72.706 1.00 15.37 C ATOM 2273 C VAL A 153 0.775 48.002 73.890 1.00 20.17 C ATOM 2274 O VAL A 153 1.686 47.221 74.204 1.00 18.08 O ATOM 2275 CB VAL A 153 -1.330 46.813 73.115 1.00 15.84 C ATOM 2276 CG1 VAL A 153 -0.892 45.420 73.624 1.00 14.21 C ATOM 2277 CG2 VAL A 153 -2.213 47.540 74.162 1.00 16.76 C ATOM 2278 HA VAL A 153 -0.581 48.611 72.319 1.00 0.00 H ATOM 2279 HB VAL A 153 -1.925 46.642 72.218 1.00 0.00 H ATOM 2280 HG11 VAL A 153 -0.347 44.901 72.835 1.00 0.00 H ATOM 2281 HG12 VAL A 153 -0.248 45.539 74.495 1.00 0.00 H ATOM 2282 HG13 VAL A 153 -1.774 44.841 73.899 1.00 0.00 H ATOM 2283 HG21 VAL A 153 -1.617 47.761 75.047 1.00 0.00 H ATOM 2284 HG22 VAL A 153 -2.590 48.469 73.735 1.00 0.00 H ATOM 2285 HG23 VAL A 153 -3.051 46.899 74.437 1.00 0.00 H ATOM 2286 H VAL A 153 1.115 46.127 71.856 1.00 0.00 H ATOM 2287 N CYS A 154 0.577 49.156 74.521 1.00 16.59 N ATOM 2288 CA CYS A 154 1.515 49.570 75.568 1.00 15.87 C ATOM 2289 C CYS A 154 0.910 50.073 76.867 1.00 16.26 C ATOM 2290 O CYS A 154 1.636 50.419 77.781 1.00 16.69 O ATOM 2291 CB CYS A 154 2.540 50.572 75.051 1.00 25.83 C ATOM 2292 SG CYS A 154 1.869 52.059 74.270 1.00 39.24 S ATOM 2293 HA CYS A 154 2.001 48.631 75.832 1.00 0.00 H ATOM 2294 HB2 CYS A 154 3.165 50.062 74.317 1.00 0.00 H ATOM 2295 HB3 CYS A 154 3.155 50.886 75.894 1.00 0.00 H ATOM 2296 HG CYS A 154 1.088 52.742 75.180 1.00 0.00 H ATOM 2297 H CYS A 154 -0.234 49.758 74.274 1.00 0.00 H ATOM 2298 N GLY A 155 -0.406 50.058 76.993 1.00 15.77 N ATOM 2299 CA GLY A 155 -1.034 50.471 78.237 1.00 16.93 C ATOM 2300 C GLY A 155 -2.533 50.468 78.095 1.00 16.44 C ATOM 2301 O GLY A 155 -3.050 50.225 77.005 1.00 14.52 O ATOM 2302 HA3 GLY A 155 -0.699 51.476 78.492 1.00 0.00 H ATOM 2303 HA2 GLY A 155 -0.747 49.781 79.031 1.00 0.00 H ATOM 2304 H GLY A 155 -0.997 49.748 76.195 1.00 0.00 H ATOM 2305 N VAL A 156 -3.221 50.725 79.205 1.00 15.19 N ATOM 2306 CA VAL A 156 -4.668 50.767 79.226 1.00 15.83 C ATOM 2307 C VAL A 156 -5.116 52.055 79.898 1.00 15.38 C ATOM 2308 O VAL A 156 -4.471 52.525 80.838 1.00 15.77 O ATOM 2309 CB VAL A 156 -5.234 49.537 79.966 1.00 18.76 C ATOM 2310 CG1 VAL A 156 -5.075 48.293 79.096 1.00 16.54 C ATOM 2311 CG2 VAL A 156 -4.533 49.356 81.322 1.00 19.13 C ATOM 2312 HA VAL A 156 -5.048 50.743 78.205 1.00 0.00 H ATOM 2313 HB VAL A 156 -6.296 49.692 80.158 1.00 0.00 H ATOM 2314 HG11 VAL A 156 -5.617 48.433 78.161 1.00 0.00 H ATOM 2315 HG12 VAL A 156 -4.018 48.132 78.884 1.00 0.00 H ATOM 2316 HG13 VAL A 156 -5.476 47.428 79.624 1.00 0.00 H ATOM 2317 HG21 VAL A 156 -3.465 49.213 81.161 1.00 0.00 H ATOM 2318 HG22 VAL A 156 -4.694 50.244 81.934 1.00 0.00 H ATOM 2319 HG23 VAL A 156 -4.945 48.484 81.829 1.00 0.00 H ATOM 2320 H VAL A 156 -2.701 50.902 80.088 1.00 0.00 H ATOM 2321 N HIS A 157 -6.195 52.657 79.404 1.00 13.81 N ATOM 2322 CA HIS A 157 -6.616 53.966 79.921 1.00 16.44 C ATOM 2323 C HIS A 157 -6.990 53.891 81.403 1.00 14.17 C ATOM 2324 O HIS A 157 -7.780 53.017 81.803 1.00 14.20 O ATOM 2325 CB HIS A 157 -7.846 54.496 79.154 1.00 13.86 C ATOM 2326 CG HIS A 157 -8.203 55.902 79.525 1.00 15.75 C ATOM 2327 ND1 HIS A 157 -7.322 56.953 79.332 1.00 17.74 N ATOM 2328 CD2 HIS A 157 -9.297 56.429 80.101 1.00 16.92 C ATOM 2329 CE1 HIS A 157 -7.876 58.063 79.775 1.00 17.12 C ATOM 2330 NE2 HIS A 157 -9.073 57.786 80.250 1.00 15.48 N ATOM 2331 HA HIS A 157 -5.767 54.637 79.787 1.00 0.00 H ATOM 2332 HB2 HIS A 157 -7.631 54.462 78.086 1.00 0.00 H ATOM 2333 HB3 HIS A 157 -8.697 53.851 79.373 1.00 0.00 H ATOM 2334 HD2 HIS A 157 -10.195 55.887 80.396 1.00 0.00 H ATOM 2335 HE1 HIS A 157 -7.418 59.052 79.752 1.00 0.00 H ATOM 2336 H HIS A 157 -6.743 52.199 78.648 1.00 0.00 H ATOM 2337 N ALA A 158 -6.452 54.814 82.205 1.00 13.34 N ATOM 2338 CA ALA A 158 -6.652 54.785 83.650 1.00 17.74 C ATOM 2339 C ALA A 158 -7.173 56.087 84.265 1.00 18.34 C ATOM 2340 O ALA A 158 -7.900 56.038 85.269 1.00 18.80 O ATOM 2341 CB ALA A 158 -5.373 54.343 84.365 1.00 20.50 C ATOM 2342 HA ALA A 158 -7.447 54.055 83.803 1.00 0.00 H ATOM 2343 HB1 ALA A 158 -5.096 53.344 84.027 1.00 0.00 H ATOM 2344 HB2 ALA A 158 -4.569 55.042 84.134 1.00 0.00 H ATOM 2345 HB3 ALA A 158 -5.546 54.329 85.441 1.00 0.00 H ATOM 2346 H ALA A 158 -5.876 55.573 81.789 1.00 0.00 H ATOM 2347 N ALA A 159 -6.828 57.239 83.693 1.00 18.27 N ATOM 2348 CA ALA A 159 -7.189 58.511 84.323 1.00 17.13 C ATOM 2349 C ALA A 159 -7.062 59.666 83.345 1.00 22.26 C ATOM 2350 O ALA A 159 -6.417 59.549 82.298 1.00 16.35 O ATOM 2351 CB ALA A 159 -6.291 58.772 85.552 1.00 15.43 C ATOM 2352 HA ALA A 159 -8.229 58.441 84.641 1.00 0.00 H ATOM 2353 HB1 ALA A 159 -6.422 57.966 86.274 1.00 0.00 H ATOM 2354 HB2 ALA A 159 -5.248 58.813 85.237 1.00 0.00 H ATOM 2355 HB3 ALA A 159 -6.571 59.721 86.010 1.00 0.00 H ATOM 2356 H ALA A 159 -6.301 57.235 82.797 1.00 0.00 H ATOM 2357 N ALA A 160 -7.635 60.804 83.715 1.00 17.84 N ATOM 2358 CA ALA A 160 -7.461 62.017 82.933 1.00 17.16 C ATOM 2359 C ALA A 160 -7.709 63.189 83.868 1.00 26.04 C ATOM 2360 O ALA A 160 -8.474 63.077 84.821 1.00 26.01 O ATOM 2361 CB ALA A 160 -8.417 62.062 81.768 1.00 22.42 C ATOM 2362 HA ALA A 160 -6.455 62.054 82.515 1.00 0.00 H ATOM 2363 HB1 ALA A 160 -8.239 61.204 81.120 1.00 0.00 H ATOM 2364 HB2 ALA A 160 -9.441 62.033 82.139 1.00 0.00 H ATOM 2365 HB3 ALA A 160 -8.259 62.982 81.205 1.00 0.00 H ATOM 2366 H ALA A 160 -8.217 60.829 84.577 1.00 0.00 H ATOM 2367 N THR A 161 -7.045 64.307 83.609 1.00 25.69 N ATOM 2368 CA THR A 161 -7.245 65.504 84.412 1.00 29.70 C ATOM 2369 C THR A 161 -8.622 66.072 84.138 1.00 32.82 C ATOM 2370 O THR A 161 -9.315 65.638 83.215 1.00 35.56 O ATOM 2371 CB THR A 161 -6.239 66.601 84.039 1.00 29.77 C ATOM 2372 OG1 THR A 161 -6.392 66.920 82.648 1.00 31.17 O ATOM 2373 CG2 THR A 161 -4.824 66.127 84.317 1.00 29.86 C ATOM 2374 HA THR A 161 -7.121 65.218 85.456 1.00 0.00 H ATOM 2375 HB THR A 161 -6.427 67.491 84.639 1.00 0.00 H ATOM 2376 HG1 THR A 161 -5.746 67.628 82.400 1.00 0.00 H ATOM 2377 HG23 THR A 161 -4.723 65.889 85.376 1.00 0.00 H ATOM 2378 HG21 THR A 161 -4.617 65.238 83.722 1.00 0.00 H ATOM 2379 HG22 THR A 161 -4.119 66.915 84.052 1.00 0.00 H ATOM 2380 H THR A 161 -6.370 64.329 82.818 1.00 0.00 H ATOM 2381 N LYS A 162 -9.013 67.062 84.931 1.00 39.01 N ATOM 2382 CA LYS A 162 -10.331 67.669 84.769 1.00 47.63 C ATOM 2383 C LYS A 162 -10.563 68.308 83.400 1.00 47.11 C ATOM 2384 O LYS A 162 -11.617 68.123 82.831 1.00 52.41 O ATOM 2385 CB LYS A 162 -10.744 68.594 85.938 1.00 56.32 C ATOM 2386 CG LYS A 162 -9.649 69.380 86.680 1.00 61.51 C ATOM 2387 CD LYS A 162 -8.233 68.873 86.473 1.00 62.79 C ATOM 2388 CE LYS A 162 -7.918 67.645 87.306 1.00 63.45 C ATOM 2389 NZ LYS A 162 -6.453 67.614 87.579 1.00 66.96 N ATOM 2390 HA LYS A 162 -11.015 66.821 84.810 1.00 0.00 H ATOM 2391 HB2 LYS A 162 -11.447 69.324 85.537 1.00 0.00 H ATOM 2392 HB3 LYS A 162 -11.249 67.972 86.677 1.00 0.00 H ATOM 2393 HG2 LYS A 162 -9.689 70.415 86.341 1.00 0.00 H ATOM 2394 HG3 LYS A 162 -9.869 69.339 87.747 1.00 0.00 H ATOM 2395 HD2 LYS A 162 -8.104 68.622 85.420 1.00 0.00 H ATOM 2396 HD3 LYS A 162 -7.536 69.666 86.745 1.00 0.00 H ATOM 2397 HE2 LYS A 162 -8.209 66.747 86.760 1.00 0.00 H ATOM 2398 HE3 LYS A 162 -8.466 67.690 88.247 1.00 0.00 H ATOM 2399 HZ1 LYS A 162 -5.935 67.573 86.678 1.00 0.00 H ATOM 2400 HZ2 LYS A 162 -6.180 68.473 88.098 1.00 0.00 H ATOM 2401 HZ3 LYS A 162 -6.226 66.775 88.150 1.00 0.00 H ATOM 2402 H LYS A 162 -8.374 67.409 85.675 1.00 0.00 H ATOM 2403 N SER A 163 -9.589 69.024 82.845 1.00 44.23 N ATOM 2404 CA SER A 163 -9.740 69.499 81.468 1.00 45.56 C ATOM 2405 C SER A 163 -9.866 68.334 80.468 1.00 44.94 C ATOM 2406 O SER A 163 -10.441 68.488 79.391 1.00 46.79 O ATOM 2407 CB SER A 163 -8.574 70.403 81.063 1.00 46.83 C ATOM 2408 OG SER A 163 -7.379 69.657 80.877 1.00 41.77 O ATOM 2409 HA SER A 163 -10.664 70.077 81.437 1.00 0.00 H ATOM 2410 HB2 SER A 163 -8.411 71.144 81.845 1.00 0.00 H ATOM 2411 HB3 SER A 163 -8.825 70.909 80.131 1.00 0.00 H ATOM 2412 HG SER A 163 -7.143 69.199 81.722 1.00 0.00 H ATOM 2413 H SER A 163 -8.728 69.245 83.384 1.00 0.00 H ATOM 2414 N GLY A 164 -9.326 67.171 80.824 1.00 34.80 N ATOM 2415 CA GLY A 164 -9.283 66.043 79.910 1.00 25.02 C ATOM 2416 C GLY A 164 -8.072 66.084 78.984 1.00 26.09 C ATOM 2417 O GLY A 164 -7.819 65.149 78.220 1.00 26.70 O ATOM 2418 HA3 GLY A 164 -10.188 66.051 79.302 1.00 0.00 H ATOM 2419 HA2 GLY A 164 -9.246 65.122 80.493 1.00 0.00 H ATOM 2420 H GLY A 164 -8.926 67.067 81.778 1.00 0.00 H ATOM 2421 N ASN A 165 -7.312 67.176 79.032 1.00 21.15 N ATOM 2422 CA ASN A 165 -6.157 67.325 78.145 1.00 24.75 C ATOM 2423 C ASN A 165 -4.960 66.446 78.468 1.00 21.51 C ATOM 2424 O ASN A 165 -4.103 66.224 77.612 1.00 23.53 O ATOM 2425 CB ASN A 165 -5.690 68.763 78.138 1.00 26.07 C ATOM 2426 CG ASN A 165 -6.691 69.680 77.491 1.00 35.15 C ATOM 2427 OD1 ASN A 165 -7.331 69.308 76.505 1.00 35.33 O ATOM 2428 ND2 ASN A 165 -6.836 70.887 78.034 1.00 33.28 N ATOM 2429 HA ASN A 165 -6.525 67.001 77.171 1.00 0.00 H ATOM 2430 HB2 ASN A 165 -5.531 69.086 79.167 1.00 0.00 H ATOM 2431 HB3 ASN A 165 -4.750 68.825 77.589 1.00 0.00 H ATOM 2432 HD22 ASN A 165 -6.272 71.154 78.866 1.00 0.00 H ATOM 2433 HD21 ASN A 165 -7.513 71.563 77.626 1.00 0.00 H ATOM 2434 H ASN A 165 -7.542 67.932 79.708 1.00 0.00 H ATOM 2435 N THR A 166 -4.898 65.967 79.701 1.00 20.64 N ATOM 2436 CA THR A 166 -3.821 65.093 80.117 1.00 19.24 C ATOM 2437 C THR A 166 -4.447 63.761 80.455 1.00 18.04 C ATOM 2438 O THR A 166 -5.444 63.704 81.187 1.00 19.72 O ATOM 2439 CB THR A 166 -3.098 65.637 81.363 1.00 25.16 C ATOM 2440 OG1 THR A 166 -2.557 66.935 81.076 1.00 32.06 O ATOM 2441 CG2 THR A 166 -1.980 64.700 81.764 1.00 25.62 C ATOM 2442 HA THR A 166 -3.083 65.013 79.318 1.00 0.00 H ATOM 2443 HB THR A 166 -3.811 65.712 82.184 1.00 0.00 H ATOM 2444 HG1 THR A 166 -3.292 67.550 80.826 1.00 0.00 H ATOM 2445 HG23 THR A 166 -2.393 63.715 81.981 1.00 0.00 H ATOM 2446 HG21 THR A 166 -1.262 64.622 80.947 1.00 0.00 H ATOM 2447 HG22 THR A 166 -1.481 65.090 82.651 1.00 0.00 H ATOM 2448 H THR A 166 -5.638 66.224 80.385 1.00 0.00 H ATOM 2449 N VAL A 167 -3.886 62.695 79.891 1.00 17.42 N ATOM 2450 CA VAL A 167 -4.409 61.362 80.136 1.00 15.11 C ATOM 2451 C VAL A 167 -3.307 60.517 80.732 1.00 16.85 C ATOM 2452 O VAL A 167 -2.131 60.853 80.620 1.00 20.14 O ATOM 2453 CB VAL A 167 -4.941 60.689 78.842 1.00 17.69 C ATOM 2454 CG1 VAL A 167 -6.175 61.414 78.341 1.00 20.80 C ATOM 2455 CG2 VAL A 167 -3.852 60.727 77.739 1.00 19.42 C ATOM 2456 HA VAL A 167 -5.252 61.447 80.822 1.00 0.00 H ATOM 2457 HB VAL A 167 -5.197 59.655 79.072 1.00 0.00 H ATOM 2458 HG11 VAL A 167 -6.951 61.379 79.106 1.00 0.00 H ATOM 2459 HG12 VAL A 167 -5.922 62.452 78.125 1.00 0.00 H ATOM 2460 HG13 VAL A 167 -6.536 60.930 77.433 1.00 0.00 H ATOM 2461 HG21 VAL A 167 -3.591 61.763 77.524 1.00 0.00 H ATOM 2462 HG22 VAL A 167 -2.968 60.192 78.085 1.00 0.00 H ATOM 2463 HG23 VAL A 167 -4.235 60.253 76.836 1.00 0.00 H ATOM 2464 H VAL A 167 -3.063 62.817 79.267 1.00 0.00 H ATOM 2465 N VAL A 168 -3.686 59.427 81.391 1.00 15.96 N ATOM 2466 CA VAL A 168 -2.706 58.490 81.924 1.00 15.36 C ATOM 2467 C VAL A 168 -3.128 57.090 81.541 1.00 15.86 C ATOM 2468 O VAL A 168 -4.289 56.731 81.705 1.00 16.20 O ATOM 2469 CB VAL A 168 -2.653 58.547 83.452 1.00 21.84 C ATOM 2470 CG1 VAL A 168 -1.745 57.441 83.991 1.00 20.63 C ATOM 2471 CG2 VAL A 168 -2.171 59.915 83.903 1.00 21.19 C ATOM 2472 HA VAL A 168 -1.728 58.752 81.520 1.00 0.00 H ATOM 2473 HB VAL A 168 -3.655 58.387 83.851 1.00 0.00 H ATOM 2474 HG11 VAL A 168 -2.134 56.471 83.683 1.00 0.00 H ATOM 2475 HG12 VAL A 168 -0.739 57.573 83.593 1.00 0.00 H ATOM 2476 HG13 VAL A 168 -1.717 57.494 85.079 1.00 0.00 H ATOM 2477 HG21 VAL A 168 -1.174 60.098 83.501 1.00 0.00 H ATOM 2478 HG22 VAL A 168 -2.857 60.679 83.538 1.00 0.00 H ATOM 2479 HG23 VAL A 168 -2.137 59.946 84.992 1.00 0.00 H ATOM 2480 H VAL A 168 -4.700 59.240 81.529 1.00 0.00 H ATOM 2481 N CYS A 169 -2.184 56.303 81.035 1.00 16.98 N ATOM 2482 CA CYS A 169 -2.415 54.867 80.905 1.00 17.25 C ATOM 2483 C CYS A 169 -1.623 54.097 81.942 1.00 17.55 C ATOM 2484 O CYS A 169 -0.497 54.459 82.258 1.00 20.95 O ATOM 2485 CB CYS A 169 -2.074 54.386 79.495 1.00 17.76 C ATOM 2486 SG CYS A 169 -0.342 54.573 78.969 1.00 23.70 S ATOM 2487 HA CYS A 169 -3.474 54.679 81.080 1.00 0.00 H ATOM 2488 HB2 CYS A 169 -2.695 54.945 78.795 1.00 0.00 H ATOM 2489 HB3 CYS A 169 -2.326 53.327 79.436 1.00 0.00 H ATOM 2490 HG CYS A 169 0.007 55.908 79.007 1.00 0.00 H ATOM 2491 H CYS A 169 -1.277 56.711 80.730 1.00 0.00 H ATOM 2492 N ALA A 170 -2.218 53.041 82.482 1.00 14.40 N ATOM 2493 CA ALA A 170 -1.491 52.133 83.353 1.00 15.37 C ATOM 2494 C ALA A 170 -0.630 51.242 82.463 1.00 19.57 C ATOM 2495 O ALA A 170 -1.058 50.873 81.361 1.00 17.38 O ATOM 2496 CB ALA A 170 -2.461 51.296 84.163 1.00 21.69 C ATOM 2497 HA ALA A 170 -0.868 52.687 84.055 1.00 0.00 H ATOM 2498 HB1 ALA A 170 -3.085 51.951 84.771 1.00 0.00 H ATOM 2499 HB2 ALA A 170 -3.090 50.716 83.488 1.00 0.00 H ATOM 2500 HB3 ALA A 170 -1.903 50.620 84.811 1.00 0.00 H ATOM 2501 H ALA A 170 -3.222 52.860 82.278 1.00 0.00 H ATOM 2502 N VAL A 171 0.570 50.903 82.922 1.00 18.12 N ATOM 2503 CA VAL A 171 1.438 50.040 82.136 1.00 17.08 C ATOM 2504 C VAL A 171 1.915 48.879 82.985 1.00 22.02 C ATOM 2505 O VAL A 171 1.965 48.960 84.209 1.00 23.75 O ATOM 2506 CB VAL A 171 2.671 50.797 81.609 1.00 19.46 C ATOM 2507 CG1 VAL A 171 2.252 52.032 80.831 1.00 19.11 C ATOM 2508 CG2 VAL A 171 3.572 51.192 82.761 1.00 23.94 C ATOM 2509 HA VAL A 171 0.857 49.683 81.286 1.00 0.00 H ATOM 2510 HB VAL A 171 3.219 50.135 80.938 1.00 0.00 H ATOM 2511 HG11 VAL A 171 1.633 51.734 79.985 1.00 0.00 H ATOM 2512 HG12 VAL A 171 1.683 52.695 81.483 1.00 0.00 H ATOM 2513 HG13 VAL A 171 3.140 52.550 80.469 1.00 0.00 H ATOM 2514 HG21 VAL A 171 3.022 51.837 83.446 1.00 0.00 H ATOM 2515 HG22 VAL A 171 3.900 50.296 83.288 1.00 0.00 H ATOM 2516 HG23 VAL A 171 4.440 51.726 82.375 1.00 0.00 H ATOM 2517 H VAL A 171 0.890 51.256 83.847 1.00 0.00 H ATOM 2518 N GLN A 172 2.300 47.807 82.320 1.00 20.51 N ATOM 2519 CA GLN A 172 2.769 46.624 83.013 1.00 23.28 C ATOM 2520 C GLN A 172 4.207 46.800 83.493 1.00 34.37 C ATOM 2521 O GLN A 172 5.075 47.196 82.725 1.00 38.79 O ATOM 2522 CB GLN A 172 2.699 45.458 82.043 1.00 28.58 C ATOM 2523 CG GLN A 172 3.003 44.117 82.644 1.00 33.47 C ATOM 2524 CD GLN A 172 2.802 43.022 81.626 1.00 39.93 C ATOM 2525 OE1 GLN A 172 3.526 42.951 80.623 1.00 39.46 O ATOM 2526 NE2 GLN A 172 1.787 42.184 81.847 1.00 35.81 N ATOM 2527 HA GLN A 172 2.145 46.445 83.888 1.00 0.00 H ATOM 2528 HB2 GLN A 172 1.692 45.423 81.628 1.00 0.00 H ATOM 2529 HB3 GLN A 172 3.415 45.640 81.242 1.00 0.00 H ATOM 2530 HG2 GLN A 172 4.038 44.103 82.986 1.00 0.00 H ATOM 2531 HG3 GLN A 172 2.340 43.945 83.492 1.00 0.00 H ATOM 2532 HE22 GLN A 172 1.207 42.284 82.705 1.00 0.00 H ATOM 2533 HE21 GLN A 172 1.576 41.431 81.162 1.00 0.00 H ATOM 2534 H GLN A 172 2.266 47.811 81.281 1.00 0.00 H ATOM 2535 N ALA A 173 4.474 46.512 84.758 1.00 35.55 N ATOM 2536 CA ALA A 173 5.856 46.593 85.234 1.00 41.65 C ATOM 2537 C ALA A 173 6.681 45.394 84.777 1.00 42.78 C ATOM 2538 O ALA A 173 6.166 44.281 84.650 1.00 46.00 O ATOM 2539 CB ALA A 173 5.912 46.756 86.734 1.00 47.83 C ATOM 2540 HA ALA A 173 6.300 47.482 84.787 1.00 0.00 H ATOM 2541 HB1 ALA A 173 5.393 47.671 87.018 1.00 0.00 H ATOM 2542 HB2 ALA A 173 5.431 45.901 87.209 1.00 0.00 H ATOM 2543 HB3 ALA A 173 6.953 46.813 87.053 1.00 0.00 H ATOM 2544 H ALA A 173 3.710 46.231 85.406 1.00 0.00 H ATOM 2545 N GLY A 174 7.965 45.640 84.522 1.00 49.61 N ATOM 2546 CA GLY A 174 8.877 44.609 84.055 1.00 49.02 C ATOM 2547 C GLY A 174 9.463 43.786 85.187 1.00 43.41 C ATOM 2548 O GLY A 174 9.180 44.050 86.358 1.00 44.91 O ATOM 2549 HA3 GLY A 174 9.693 45.085 83.512 1.00 0.00 H ATOM 2550 HA2 GLY A 174 8.335 43.943 83.384 1.00 0.00 H ATOM 2551 H GLY A 174 8.328 46.604 84.662 1.00 0.00 H TER 2552 GLY A 174 HETATM 2553 O HOH 1 -12.217 39.424 65.069 1.00 14.30 O HETATM 2554 O HOH 2 -18.983 47.883 70.385 1.00 19.31 O HETATM 2555 O HOH 3 -5.409 42.430 65.205 1.00 17.86 O HETATM 2556 O HOH 4 -14.298 53.300 82.896 1.00 19.82 O HETATM 2557 O HOH 5 -20.476 49.433 72.142 1.00 17.22 O HETATM 2558 O HOH 6 -14.555 42.269 71.974 1.00 20.26 O HETATM 2559 O HOH 7 -17.675 54.221 64.363 1.00 15.41 O HETATM 2560 O HOH 8 2.737 42.923 67.734 1.00 27.16 O HETATM 2561 O HOH 9 -16.552 54.065 76.601 1.00 16.60 O HETATM 2562 O HOH 10 -9.287 43.215 60.146 1.00 24.76 O HETATM 2563 O HOH 11 -22.082 56.022 73.683 1.00 28.30 O HETATM 2564 O HOH 12 -17.609 44.418 73.628 1.00 19.91 O HETATM 2565 O HOH 13 -22.924 49.030 70.475 1.00 18.75 O HETATM 2566 O HOH 14 -26.157 51.771 69.470 1.00 17.07 O HETATM 2567 O HOH 15 -17.409 45.619 71.140 1.00 22.68 O HETATM 2568 O HOH 16 -18.423 49.301 68.177 1.00 25.16 O HETATM 2569 O HOH 17 -13.318 52.156 75.022 1.00 18.07 O HETATM 2570 O HOH 18 -25.384 50.152 71.555 1.00 21.00 O HETATM 2571 O HOH 19 -5.200 32.183 67.018 1.00 23.72 O HETATM 2572 O HOH 20 2.132 48.019 79.380 1.00 24.58 O HETATM 2573 O HOH 21 -11.127 53.160 58.730 1.00 26.76 O HETATM 2574 O HOH 22 -17.894 41.875 76.804 1.00 25.21 O HETATM 2575 O HOH 23 -11.532 45.916 90.664 1.00 21.24 O HETATM 2576 O HOH 24 -1.246 54.789 66.644 1.00 28.50 O HETATM 2577 O HOH 25 -3.489 47.079 90.354 1.00 26.02 O HETATM 2578 O HOH 26 -1.345 36.635 83.968 1.00 23.79 O HETATM 2579 O HOH 27 -1.200 31.657 76.935 1.00 26.53 O HETATM 2580 O HOH 28 1.615 54.666 74.999 1.00 24.21 O HETATM 2581 O HOH 29 -5.234 38.914 64.574 1.00 24.75 O HETATM 2582 O HOH 30 -20.036 45.909 81.514 1.00 34.67 O HETATM 2583 O HOH 31 -9.519 29.517 80.992 1.00 28.03 O HETATM 2584 O HOH 32 0.518 31.938 83.650 1.00 30.85 O HETATM 2585 O HOH 33 -4.260 33.939 89.610 1.00 33.81 O HETATM 2586 O HOH 34 -18.084 42.629 82.480 1.00 26.40 O HETATM 2587 O HOH 35 -18.000 52.018 80.172 1.00 23.04 O HETATM 2588 O HOH 36 -6.204 63.870 70.129 1.00 26.34 O HETATM 2589 O HOH 37 -8.247 26.016 74.538 1.00 31.61 O HETATM 2590 O HOH 38 -4.150 30.085 83.130 1.00 28.07 O HETATM 2591 O HOH 39 -15.306 56.483 63.373 1.00 33.67 O HETATM 2592 O HOH 40 -20.739 56.683 76.365 1.00 31.88 O HETATM 2593 O HOH 41 -18.809 57.968 81.192 1.00 30.04 O HETATM 2594 O HOH 42 6.333 63.851 75.295 1.00 29.70 O HETATM 2595 O HOH 43 -20.162 44.776 73.982 1.00 27.31 O HETATM 2596 O HOH 44 -0.300 43.463 64.706 1.00 40.79 O HETATM 2597 O HOH 45 1.999 47.994 86.768 1.00 29.17 O HETATM 2598 O HOH 46 -12.896 33.326 68.592 1.00 27.18 O HETATM 2599 O HOH 47 3.953 56.147 66.694 1.00 33.57 O HETATM 2600 O HOH 48 -4.994 58.330 66.568 1.00 28.97 O HETATM 2601 O HOH 49 -20.095 42.725 75.811 1.00 31.55 O HETATM 2602 O HOH 50 -12.435 47.778 92.389 1.00 41.76 O HETATM 2603 O HOH 51 -9.604 63.289 77.928 1.00 33.77 O HETATM 2604 O HOH 52 -19.160 54.466 76.696 1.00 25.28 O HETATM 2605 O HOH 53 -2.712 29.857 78.481 1.00 26.22 O HETATM 2606 O HOH 54 -14.594 30.150 90.848 1.00 33.50 O HETATM 2607 O HOH 55 -13.733 23.636 78.639 1.00 50.96 O HETATM 2608 O HOH 56 -15.442 62.176 73.142 1.00 36.92 O HETATM 2609 O HOH 57 -17.091 38.214 82.569 1.00 37.10 O HETATM 2610 O HOH 58 -19.792 35.047 89.929 1.00 33.63 O HETATM 2611 O HOH 59 -17.998 37.463 85.658 1.00 38.96 O HETATM 2612 O HOH 60 -9.844 43.644 90.975 1.00 34.78 O HETATM 2613 O HOH 61 -1.238 30.062 82.925 1.00 35.42 O HETATM 2614 O HOH 62 -4.590 49.056 91.967 1.00 32.49 O HETATM 2615 O HOH 63 3.343 64.208 76.304 1.00 35.59 O HETATM 2616 O HOH 64 -20.806 60.999 67.989 1.00 36.02 O HETATM 2617 O HOH 65 -1.110 68.431 73.043 1.00 37.86 O HETATM 2618 O HOH 66 -15.935 30.082 78.991 1.00 37.72 O HETATM 2619 O HOH 67 -3.352 45.537 92.555 1.00 45.62 O HETATM 2620 O HOH 68 -12.041 64.537 78.534 1.00 36.33 O HETATM 2621 O HOH 69 1.006 37.849 72.793 1.00 42.23 O HETATM 2622 O HOH 70 -3.642 30.662 68.711 1.00 32.08 O HETATM 2623 O HOH 71 -24.733 55.832 74.463 1.00 41.03 O HETATM 2624 O HOH 72 -23.602 49.226 74.671 1.00 31.79 O HETATM 2625 O HOH 73 -0.622 48.209 93.115 1.00 53.66 O HETATM 2626 O HOH 74 -12.381 28.782 90.568 1.00 30.06 O HETATM 2627 O HOH 75 -19.966 50.350 82.013 1.00 37.96 O HETATM 2628 O HOH 76 -5.162 43.734 62.781 1.00 34.63 O HETATM 2629 O HOH 77 -12.843 26.329 90.307 1.00 45.08 O HETATM 2630 O HOH 78 -18.587 35.142 83.332 1.00 48.16 O HETATM 2631 O HOH 79 -21.933 48.506 76.350 1.00 38.25 O HETATM 2632 O HOH 80 -20.061 42.704 84.389 1.00 43.00 O HETATM 2633 O HOH 81 -17.109 32.617 77.285 1.00 40.73 O HETATM 2634 O HOH 82 2.791 54.462 64.859 1.00 43.15 O HETATM 2635 O HOH 83 -8.136 24.310 76.537 1.00 39.88 O HETATM 2636 O HOH 84 -7.024 32.919 89.786 1.00 35.36 O HETATM 2637 O HOH 85 -19.062 40.053 86.081 1.00 48.09 O HETATM 2638 O HOH 86 4.030 33.945 83.660 1.00 34.56 O HETATM 2639 O HOH 87 -0.060 34.576 67.179 1.00 33.87 O HETATM 2640 O HOH 88 -22.838 46.507 78.193 1.00 47.52 O HETATM 2641 O HOH 89 -2.433 50.466 92.888 1.00 37.06 O HETATM 2642 O HOH 90 2.859 32.120 82.297 1.00 30.09 O HETATM 2643 O HOH 91 0.340 34.595 83.237 1.00 32.32 O HETATM 2644 O HOH 92 -0.034 54.055 64.748 1.00 30.34 O HETATM 2645 O HOH 93 -19.743 43.533 80.576 1.00 44.02 O HETATM 2646 O HOH 94 -14.726 31.191 93.630 1.00 40.71 O HETATM 2647 O HOH 95 -11.379 39.156 62.533 1.00 35.36 O HETATM 2648 O HOH 96 -20.509 47.374 74.159 1.00 36.14 O HETATM 2649 O HOH 97 8.056 57.863 89.785 1.00 35.06 O HETATM 2650 O HOH 98 -14.975 52.882 86.034 1.00 35.05 O HETATM 2651 O HOH 99 -21.703 43.465 77.883 1.00 50.76 O HETATM 2652 O HOH 100 -1.214 29.086 80.514 1.00 31.22 O HETATM 2653 O HOH 101 -27.069 54.493 70.283 1.00 29.04 O HETATM 2654 O HOH 102 -10.307 38.017 64.295 1.00 34.90 O HETATM 2655 O HOH 103 2.080 45.035 86.455 1.00 43.23 O HETATM 2656 O HOH 104 3.831 48.130 88.855 1.00 34.80 O HETATM 2657 O HOH 105 -3.410 67.983 75.537 1.00 42.83 O HETATM 2658 O HOH 106 -0.366 30.629 74.753 1.00 37.17 O HETATM 2659 O HOH 107 -6.975 32.735 63.825 1.00 41.29 O HETATM 2660 O HOH 108 -7.451 52.923 58.087 1.00 41.58 O HETATM 2661 O HOH 109 -19.738 60.358 80.327 1.00 45.13 O HETATM 2662 O HOH 110 -8.817 64.623 70.627 1.00 34.23 O HETATM 2663 O HOH 111 -13.447 37.751 92.171 1.00 34.87 O HETATM 2664 O HOH 112 0.318 32.725 88.334 1.00 41.89 O HETATM 2665 O HOH 113 -14.814 34.540 93.889 1.00 47.21 O HETATM 2666 O HOH 114 -20.183 56.126 80.079 1.00 42.30 O HETATM 2667 O HOH 115 -20.708 41.077 88.251 1.00 41.47 O HETATM 2668 O HOH 116 -5.559 49.858 58.991 1.00 42.69 O HETATM 2669 O HOH 117 -1.182 27.950 84.914 1.00 48.17 O HETATM 2670 O HOH 118 1.670 39.304 78.419 1.00 38.55 O HETATM 2671 O HOH 119 1.049 31.420 86.216 1.00 37.34 O HETATM 2672 O HOH 120 -13.377 39.597 94.338 1.00 39.54 O HETATM 2673 O HOH 121 -2.596 43.481 66.080 1.00 30.87 O HETATM 2674 O HOH 122 3.105 49.943 91.054 1.00 44.18 O HETATM 2675 O HOH 123 4.929 63.425 81.318 1.00 42.81 O HETATM 2676 O HOH 124 -3.233 40.388 63.411 1.00 47.08 O HETATM 2677 O HOH 125 -26.394 52.071 73.599 1.00 40.63 O HETATM 2678 O HOH 126 -10.385 23.470 76.761 1.00 45.99 O HETATM 2679 O HOH 127 -14.269 61.105 90.014 1.00 40.54 O HETATM 2680 O HOH 128 -10.008 25.259 86.538 1.00 45.87 O HETATM 2681 O HOH 129 1.486 38.556 76.143 1.00 36.28 O HETATM 2682 O HOH 130 5.479 43.104 66.901 1.00 36.28 O HETATM 2683 O HOH 131 -13.192 65.851 80.396 1.00 43.46 O HETATM 2684 O HOH 132 11.247 57.190 76.821 1.00 51.22 O HETATM 2685 O HOH 133 -7.961 34.675 91.211 1.00 37.77 O HETATM 2686 O HOH 134 -16.496 58.707 65.468 1.00 48.68 O HETATM 2687 O HOH 135 -11.639 42.137 58.825 1.00 46.09 O HETATM 2688 O HOH 136 8.967 48.452 85.751 1.00 50.67 O HETATM 2689 O HOH 137 -16.862 28.295 90.100 1.00 53.34 O HETATM 2690 O HOH 138 4.857 46.222 90.334 1.00 49.00 O HETATM 2691 O HOH 139 9.486 59.274 85.617 1.00 36.83 O HETATM 2692 O HOH 140 -18.317 28.249 92.619 1.00 53.99 O HETATM 2693 O HOH 141 -5.161 30.421 88.534 1.00 48.12 O HETATM 2694 O HOH 142 9.924 46.669 80.264 1.00 46.88 O HETATM 2695 O HOH 143 3.366 32.346 79.611 1.00 30.48 O HETATM 2696 O HOH 144 2.805 33.671 67.583 1.00 50.98 O HETATM 2697 O HOH 145 1.146 57.249 77.264 1.00 45.03 O HETATM 2698 O HOH 146 2.212 39.247 73.801 1.00 44.31 O HETATM 2699 O HOH 147 -10.558 64.591 86.133 1.00 43.98 O HETATM 2700 O HOH 148 8.636 51.241 69.855 1.00 49.94 O HETATM 2701 O HOH 149 -12.403 66.369 81.971 1.00 48.62 O HETATM 2702 O HOH 150 -4.859 69.191 81.981 1.00 46.40 O HETATM 2703 O HOH 151 7.863 44.417 67.826 1.00 47.74 O HETATM 2704 O HOH 152 7.036 66.146 73.935 1.00 39.91 O HETATM 2705 O HOH 153 -20.538 34.781 92.608 1.00 50.24 O HETATM 2706 O HOH 154 -13.196 35.249 95.243 1.00 53.23 O HETATM 2707 O HOH 155 10.168 59.987 70.484 1.00 46.53 O HETATM 2708 O HOH 156 8.526 46.494 77.378 1.00 42.46 O HETATM 2709 O HOH 157 -1.187 39.808 91.297 1.00 43.98 O HETATM 2710 O HOH 158 -7.180 70.223 83.946 1.00 54.05 O HETATM 2711 O HOH 159 -11.098 56.190 94.528 1.00 53.93 O HETATM 2712 O HOH 160 -9.031 51.247 59.487 1.00 29.18 O HETATM 2713 O HOH 161 0.129 43.183 85.885 1.00 43.40 O HETATM 2714 O HOH 162 -16.131 34.043 75.224 1.00 40.19 O HETATM 2715 O HOH 163 -0.233 34.900 74.723 1.00 43.06 O HETATM 2716 O HOH 164 -21.913 57.981 72.874 1.00 45.44 O HETATM 2717 O HOH 165 -14.678 33.007 73.934 1.00 42.11 O HETATM 2718 O HOH 166 -3.700 52.805 59.621 1.00 52.96 O HETATM 2719 O HOH 167 9.760 59.586 88.341 1.00 54.52 O HETATM 2720 O HOH 168 4.509 64.532 83.263 1.00 57.13 O HETATM 2721 O HOH 169 7.345 44.770 60.688 1.00 46.99 O HETATM 2722 O HOH 170 -8.535 73.126 77.972 1.00 54.10 O HETATM 2723 O HOH 171 2.979 66.878 74.983 1.00 39.76 O HETATM 2724 O HOH 172 -20.641 32.362 88.766 1.00 41.83 O HETATM 2725 O HOH 173 9.352 57.651 80.879 1.00 50.23 O HETATM 2726 O HOH 174 7.599 62.096 86.098 1.00 44.68 O HETATM 2727 O HOH 175 -20.749 36.622 88.551 1.00 46.10 O HETATM 2728 O HOH 176 -21.833 38.358 88.068 1.00 52.06 O HETATM 2729 O HOH 177 -20.210 30.295 88.296 1.00 44.82 O HETATM 2730 O HOH 178 9.264 55.513 78.276 1.00 43.70 O HETATM 2731 O HOH 179 10.058 55.554 84.567 1.00 52.27 O HETATM 2732 O HOH 180 2.435 64.263 79.325 1.00 54.40 O HETATM 2733 O HOH 181 -2.541 44.015 61.561 1.00 47.63 O HETATM 2734 O HOH 182 -15.109 52.399 88.045 1.00 56.21 O HETATM 2735 O HOH 183 5.005 62.133 85.131 1.00 43.13 O HETATM 2736 O HOH 184 -7.090 62.435 67.656 1.00 36.47 O HETATM 2737 O HOH 185 -9.106 63.923 68.069 1.00 49.99 O HETATM 2738 O HOH 186 -13.141 58.624 89.283 1.00 43.25 O HETATM 2739 O HOH 187 -13.972 56.047 89.862 1.00 52.95 O HETATM 2740 O HOH 188 -14.028 59.648 86.209 1.00 34.26 O HETATM 2741 C1 PHQ A 189 -7.533 62.774 88.405 1.00 0.32 C HETATM 2742 O1 PHQ A 189 -7.478 62.745 89.639 1.00 -0.38 O HETATM 2743 O2 PHQ A 189 -6.669 63.556 87.702 1.00 -0.25 O HETATM 2744 C2 PHQ A 189 -5.537 64.081 88.406 1.00 0.11 C HETATM 2745 C3 PHQ A 189 -4.366 63.620 87.779 1.00 -0.01 C HETATM 2746 C4 PHQ A 189 -3.183 63.299 88.443 1.00 -0.06 C HETATM 2747 C5 PHQ A 189 -2.087 62.834 87.712 1.00 -0.07 C HETATM 2748 C6 PHQ A 189 -2.162 62.678 86.329 1.00 -0.07 C HETATM 2749 C7 PHQ A 189 -3.348 62.986 85.674 1.00 -0.07 C HETATM 2750 C8 PHQ A 189 -4.437 63.446 86.402 1.00 -0.06 C HETATM 2751 H7 PHQ A 189 -5.362 63.674 85.885 1.00 0.06 H HETATM 2752 H6 PHQ A 189 -3.423 62.868 84.599 1.00 0.06 H HETATM 2753 H5 PHQ A 189 -1.304 62.320 85.771 1.00 0.06 H HETATM 2754 H4 PHQ A 189 -1.165 62.591 88.228 1.00 0.06 H HETATM 2755 H3 PHQ A 189 -3.114 63.409 89.519 1.00 0.06 H HETATM 2756 H1 PHQ A 189 -5.558 63.737 89.451 1.00 0.08 H HETATM 2757 H2 PHQ A 189 -5.562 65.180 88.381 1.00 0.08 H HETATM 2758 N PHQ A 189 -8.559 62.287 87.711 1.00 -0.24 N HETATM 2759 CA PHQ A 189 -9.573 61.432 88.318 1.00 0.13 C HETATM 2760 C PHQ A 189 -9.524 60.089 87.574 1.00 0.20 C HETATM 2761 O PHQ A 189 -9.236 60.074 86.372 1.00 -0.39 O HETATM 2762 N PHQ A 189 -9.622 58.948 88.117 1.00 -0.26 N HETATM 2763 CA PHQ A 189 -9.624 57.618 87.474 1.00 0.13 C HETATM 2764 C PHQ A 189 -10.789 57.664 86.505 1.00 0.20 C HETATM 2765 O PHQ A 189 -11.865 58.204 86.772 1.00 -0.39 O HETATM 2766 N PHQ A 189 -10.577 56.998 85.466 1.00 -0.27 N HETATM 2767 CA PHQ A 189 -11.667 56.968 84.465 1.00 0.10 C HETATM 2768 C PHQ A 189 -12.241 55.558 84.131 1.00 0.06 C HETATM 2769 O PHQ A 189 -12.428 54.681 85.016 1.00 -0.57 O HETATM 2770 O PHQ A 189 -12.528 55.286 82.935 1.00 -0.57 O HETATM 2771 CB PHQ A 189 -11.434 57.797 83.193 1.00 -0.00 C HETATM 2772 CG PHQ A 189 -11.327 59.303 83.545 1.00 0.04 C HETATM 2773 CD PHQ A 189 -11.278 60.169 82.288 1.00 0.18 C HETATM 2774 OE1 PHQ A 189 -10.920 59.726 81.187 1.00 -0.40 O HETATM 2775 NE2 PHQ A 189 -11.759 61.397 82.473 1.00 -0.28 N HETATM 2776 CH1 PHQ A 189 -12.149 61.805 83.836 1.00 0.02 C HETATM 2777 H27 PHQ A 189 -12.523 62.839 83.816 1.00 0.05 H HETATM 2778 H28 PHQ A 189 -11.275 61.744 84.501 1.00 0.05 H HETATM 2779 H29 PHQ A 189 -12.940 61.136 84.207 1.00 0.05 H HETATM 2780 CH2 PHQ A 189 -11.777 62.345 81.349 1.00 0.02 C HETATM 2781 H30 PHQ A 189 -11.452 61.832 80.432 1.00 0.05 H HETATM 2782 H31 PHQ A 189 -11.095 63.181 81.563 1.00 0.05 H HETATM 2783 H32 PHQ A 189 -12.798 62.731 81.211 1.00 0.05 H HETATM 2784 H24 PHQ A 189 -12.202 59.593 84.145 1.00 0.05 H HETATM 2785 H25 PHQ A 189 -10.410 59.469 84.130 1.00 0.05 H HETATM 2786 H34 PHQ A 189 -10.501 57.469 82.712 1.00 0.03 H HETATM 2787 H35 PHQ A 189 -12.276 57.645 82.501 1.00 0.03 H HETATM 2788 H33 PHQ A 189 -12.495 57.483 84.975 1.00 0.07 H HETATM 2789 H26 PHQ A 189 -9.716 56.511 85.320 1.00 0.19 H HETATM 2790 CB PHQ A 189 -9.977 56.547 88.495 1.00 -0.01 C HETATM 2791 CG PHQ A 189 -8.894 56.451 89.572 1.00 -0.04 C HETATM 2792 CD1 PHQ A 189 -9.248 55.517 90.682 1.00 -0.06 C HETATM 2793 H18 PHQ A 189 -8.431 55.495 91.418 1.00 0.02 H HETATM 2794 H19 PHQ A 189 -9.402 54.507 90.276 1.00 0.02 H HETATM 2795 H20 PHQ A 189 -10.172 55.861 91.170 1.00 0.02 H HETATM 2796 CD2 PHQ A 189 -7.607 55.924 88.933 1.00 -0.06 C HETATM 2797 H21 PHQ A 189 -7.310 56.587 88.107 1.00 0.02 H HETATM 2798 H22 PHQ A 189 -7.779 54.909 88.546 1.00 0.02 H HETATM 2799 H23 PHQ A 189 -6.807 55.898 89.688 1.00 0.02 H HETATM 2800 H17 PHQ A 189 -8.722 57.454 89.989 1.00 0.03 H HETATM 2801 H15 PHQ A 189 -10.066 55.577 87.985 1.00 0.03 H HETATM 2802 H16 PHQ A 189 -10.936 56.802 88.969 1.00 0.03 H HETATM 2803 H14 PHQ A 189 -8.667 57.403 86.977 1.00 0.08 H HETATM 2804 H13 PHQ A 189 -9.710 58.948 89.113 1.00 0.19 H HETATM 2805 CB PHQ A 189 -10.934 62.081 88.087 1.00 -0.02 C HETATM 2806 H10 PHQ A 189 -11.720 61.455 88.536 1.00 0.03 H HETATM 2807 H11 PHQ A 189 -11.115 62.178 87.006 1.00 0.03 H HETATM 2808 H12 PHQ A 189 -10.949 63.078 88.552 1.00 0.03 H HETATM 2809 H9 PHQ A 189 -9.385 61.294 89.393 1.00 0.08 H HETATM 2810 H8 PHQ A 189 -8.637 62.515 86.740 1.00 0.19 H CONECT 1 2 12 13 14 CONECT 12 1 CONECT 13 1 CONECT 14 1 CONECT 1964 1965 1972 1973 1974 CONECT 1972 1964 CONECT 1973 1964 CONECT 1974 1964 CONECT 2741 2742 2743 2758 CONECT 2742 2741 CONECT 2743 2741 2744 CONECT 2744 2743 2745 2756 2757 CONECT 2745 2744 2746 2750 CONECT 2746 2745 2747 2755 CONECT 2747 2746 2748 2754 CONECT 2748 2747 2749 2753 CONECT 2749 2748 2750 2752 CONECT 2750 2745 2749 2751 CONECT 2751 2750 CONECT 2752 2749 CONECT 2753 2748 CONECT 2754 2747 CONECT 2755 2746 CONECT 2756 2744 CONECT 2757 2744 CONECT 2758 2741 2759 2810 CONECT 2759 2758 2760 2805 2809 CONECT 2760 2759 2761 2762 CONECT 2761 2760 CONECT 2762 2760 2763 2804 CONECT 2763 2762 2764 2790 2803 CONECT 2764 2763 2765 2766 CONECT 2765 2764 CONECT 2766 2764 2767 2789 CONECT 2767 2766 2768 2771 2788 CONECT 2768 2767 2769 2770 CONECT 2769 2768 CONECT 2770 2768 CONECT 2771 2767 2772 2786 2787 CONECT 2772 2771 2773 2784 2785 CONECT 2773 2772 2774 2775 CONECT 2774 2773 CONECT 2775 2773 2776 2780 CONECT 2776 2775 2777 2778 2779 CONECT 2777 2776 CONECT 2778 2776 CONECT 2779 2776 CONECT 2780 2775 2781 2782 2783 CONECT 2781 2780 CONECT 2782 2780 CONECT 2783 2780 CONECT 2784 2772 CONECT 2785 2772 CONECT 2786 2771 CONECT 2787 2771 CONECT 2788 2767 CONECT 2789 2766 CONECT 2790 2763 2791 2801 2802 CONECT 2791 2790 2792 2796 2800 CONECT 2792 2791 2793 2794 2795 CONECT 2793 2792 CONECT 2794 2792 CONECT 2795 2792 CONECT 2796 2791 2797 2798 2799 CONECT 2797 2796 CONECT 2798 2796 CONECT 2799 2796 CONECT 2800 2791 CONECT 2801 2790 CONECT 2802 2790 CONECT 2803 2763 CONECT 2804 2762 CONECT 2805 2759 2806 2807 2808 CONECT 2806 2805 CONECT 2807 2805 CONECT 2808 2805 CONECT 2809 2759 CONECT 2810 2758 MASTER 0 0 0 0 0 0 0 0 2808 2 78 14 END
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Related entries of code: 4inh
Entries with 90% protein sequence similarity cutoff in PDBbind
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188aa, >3UR9_1|Chains... *
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183aa, >4IMQ_1|Chain... at 98%
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RCSB PDB
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183aa, >4IMZ_1|Chain... at 98%
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188aa, >4XBB_1|Chain... at 100%
4xbd
RCSB PDB
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188aa, >4XBD_1|Chains... at 100%
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RCSB PDB
PDBbind
188aa, >5DG6_1|Chains... at 98%
5dgj
RCSB PDB
PDBbind
188aa, >5DGJ_1|Chain... at 98%
5e0g
RCSB PDB
PDBbind
188aa, >5E0G_1|Chain... at 98%
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RCSB PDB
PDBbind
188aa, >5E0H_1|Chains... at 98%
5e0j
RCSB PDB
PDBbind
188aa, >5E0J_1|Chain... at 98%
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RCSB PDB
PDBbind
188aa, >5T6F_1|Chains... at 98%
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RCSB PDB
PDBbind
188aa, >5T6G_1|Chains... at 98%
5tg1
RCSB PDB
PDBbind
188aa, >5TG1_1|Chain... at 98%
5tg2
RCSB PDB
PDBbind
188aa, >5TG2_1|Chain... at 98%
5wej
RCSB PDB
PDBbind
188aa, >5WEJ_1|Chains... at 98%
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RCSB PDB
PDBbind
188aa, >6BID_1|Chain... at 98%
6bic
RCSB PDB
PDBbind
188aa, >6BIC_1|Chains... at 98%
6bib
RCSB PDB
PDBbind
188aa, >6BIB_1|Chains... at 98%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1a07
RCSB PDB
PDBbind
4-mer
1a08
RCSB PDB
PDBbind
4-mer
1a09
RCSB PDB
PDBbind
4-mer
1a1e
RCSB PDB
PDBbind
4-mer
1a2c
RCSB PDB
PDBbind
4-mer
1aq7
RCSB PDB
PDBbind
4-mer
1e5j
RCSB PDB
PDBbind
4-mer
1ez9
RCSB PDB
PDBbind
4-mer
1gvk
RCSB PDB
PDBbind
4-mer
1ibc
RCSB PDB
PDBbind
4-mer
1is0
RCSB PDB
PDBbind
4-mer
1jyq
RCSB PDB
PDBbind
4-mer
1lkk
RCSB PDB
PDBbind
4-mer
1lkl
RCSB PDB
PDBbind
4-mer
1m21
RCSB PDB
PDBbind
4-mer
1n51
RCSB PDB
PDBbind
4-mer
1pop
RCSB PDB
PDBbind
4-mer
1ppi
RCSB PDB
PDBbind
4-mer
1s3k
RCSB PDB
PDBbind
4-mer
1tl9
RCSB PDB
PDBbind
4-mer
1ukt
RCSB PDB
PDBbind
4-mer
1y3p
RCSB PDB
PDBbind
4-mer
2i3h
RCSB PDB
PDBbind
4-mer
2n7b
RCSB PDB
PDBbind
4-mer
2psx
RCSB PDB
PDBbind
4-mer
2vsl
RCSB PDB
PDBbind
4-mer
2x6w
RCSB PDB
PDBbind
4-mer
2x6y
RCSB PDB
PDBbind
4-mer
2x85
RCSB PDB
PDBbind
4-mer
2xe4
RCSB PDB
PDBbind
4-mer
3che
RCSB PDB
PDBbind
4-mer
3d3x
RCSB PDB
PDBbind
4-mer
3jzg
RCSB PDB
PDBbind
4-mer
3k0k
RCSB PDB
PDBbind
4-mer
3k16
RCSB PDB
PDBbind
4-mer
3mp6
RCSB PDB
PDBbind
4-mer
3nii
RCSB PDB
PDBbind
4-mer
3nij
RCSB PDB
PDBbind
4-mer
3nik
RCSB PDB
PDBbind
4-mer
3nil
RCSB PDB
PDBbind
4-mer
3nim
RCSB PDB
PDBbind
4-mer
3ny3
RCSB PDB
PDBbind
4-mer
3qmk
RCSB PDB
PDBbind
4-mer
3t1n
RCSB PDB
PDBbind
4-mer
3t4p
RCSB PDB
PDBbind
4-mer
3u3z
RCSB PDB
PDBbind
4-mer
3uec
RCSB PDB
PDBbind
4-mer
3ut5
RCSB PDB
PDBbind
4-mer
3uw4
RCSB PDB
PDBbind
4-mer
3uw5
RCSB PDB
PDBbind
4-mer
3zyb
RCSB PDB
PDBbind
4-mer
4b9h
RCSB PDB
PDBbind
4-mer
4c16
RCSB PDB
PDBbind
4-mer
4c1t
RCSB PDB
PDBbind
4-mer
4dxg
RCSB PDB
PDBbind
4-mer
4fgt
RCSB PDB
PDBbind
4-mer
4fzc
RCSB PDB
PDBbind
4-mer
4fzg
RCSB PDB
PDBbind
4-mer
4gk7
RCSB PDB
PDBbind
4-mer
4hp0
RCSB PDB
PDBbind
4-mer
4i67
RCSB PDB
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4-mer
4imq
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PDBbind
4-mer
4imz
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4-mer
4in9
RCSB PDB
PDBbind
4-mer
4j44
RCSB PDB
PDBbind
4-mer
4j45
RCSB PDB
PDBbind
4-mer
4j46
RCSB PDB
PDBbind
4-mer
4j47
RCSB PDB
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4-mer
4j48
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4-mer
4k63
RCSB PDB
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4-mer
4k66
RCSB PDB
PDBbind
4-mer
4kom
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4kx8
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PDBbind
4-mer
4lkd
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4lke
RCSB PDB
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4-mer
4lkf
RCSB PDB
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4-mer
4mbp
RCSB PDB
PDBbind
4-mer
4q4i
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PDBbind
4-mer
4trw
RCSB PDB
PDBbind
4-mer
4trz
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PDBbind
4-mer
4x0z
RCSB PDB
PDBbind
4-mer
4x14
RCSB PDB
PDBbind
4-mer
4z7n
RCSB PDB
PDBbind
4-mer
4z7o
RCSB PDB
PDBbind
4-mer
5ab1
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PDBbind
4-mer
5ajc
RCSB PDB
PDBbind
4-mer
5azf
RCSB PDB
PDBbind
4-mer
5btv
RCSB PDB
PDBbind
4-mer
5e6o
RCSB PDB
PDBbind
4-mer
5efj
RCSB PDB
PDBbind
4-mer
5f2u
RCSB PDB
PDBbind
4-mer
5f90
RCSB PDB
PDBbind
4-mer
5izj
RCSB PDB
PDBbind
4-mer
5jop
RCSB PDB
PDBbind
4-mer
5jy0
RCSB PDB
PDBbind
4-mer
5tdb
RCSB PDB
PDBbind
4-mer
5vi6
RCSB PDB
PDBbind
4-mer
5wxp
RCSB PDB
PDBbind
4-mer
5yzd
RCSB PDB
PDBbind
4-mer
5zmq
RCSB PDB
PDBbind
4-mer
5zms
RCSB PDB
PDBbind
4-mer
6cct
RCSB PDB
PDBbind
4-mer
6ccu
RCSB PDB
PDBbind
4-mer
6cd8
RCSB PDB
PDBbind
4-mer
6cd9
RCSB PDB
PDBbind
4-mer
6cdc
RCSB PDB
PDBbind
4-mer
6m8w
RCSB PDB
PDBbind
4-mer
6m8y
RCSB PDB
PDBbind
4-mer
6m9f
RCSB PDB
PDBbind
4-mer
6msy
RCSB PDB
PDBbind
4-mer
6mu3
RCSB PDB
PDBbind
4-mer
6pu3
RCSB PDB
PDBbind
4-mer
6prg
RCSB PDB
PDBbind
4-mer
6n3f
RCSB PDB
PDBbind
4-mer
6jjn
RCSB PDB
PDBbind
4-mer
6jjm
RCSB PDB
PDBbind
4-mer
6hop
RCSB PDB
PDBbind
4-mer
Entry Information
PDB ID
4inh
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Genome polyprotein
Ligand Name
4-mer
EC.Number
E.C.3.4.22.66
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Ki=0.56uM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) J.Virol. Vol. 87: pp. 4281-4292
Ligand Properties
Formula
C
2
4
H
3
6
N
4
O
7
Molecular Weight
492.565
Exact Mass
492.258
No. of atoms
71
No. of bonds
71
Polar Surface Area
154.14
LOGP Value
2.55 (
Computed with XLOGP3
)
2.44 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 6
No. of Rotatable Bonds: 17
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 1
Canonical SMILES
CC(C[C@@H](C(=O)N[C@H](C(=O)O)CCC(=O)N(C)C)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C)C
InChI String
InChI=1S/C24H36N4O7/c1-15(2)13-19(22(31)26-18(23(32)33)11-12-20(29)28(4)5)27-21(30)16(3)25-24(34)35-14-17-9-7-6-8-10-17/h6-10,15-16,18-19H,11-14H2,1-5H3,(H,25,34)(H,26,31)(H,27,30)(H,32,33)/t16-,18-,19-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q83883
Entrez Gene ID
NCBI Entrez Gene ID:
1491970
ASD
Information of known allosteric effects of PDB entries
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