Browse entries in the PDBbind-CN Database
HEADER 6F86_COMPLEX COMPND 6F86_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 84 GLY LEU ASP ALA VAL ARG LYS ARG PRO GLY MET TYR ILE SEQRES 2 A 84 GLY ASP THR ASP ASP GLY THR GLY LEU HIS HIS MET VAL SEQRES 3 A 84 PHE GLU VAL VAL ASP ASN ALA ILE ASP GLU ALA LEU ALA SEQRES 4 A 84 GLY HIS CYS LYS GLU ILE ILE VAL THR ILE HIS ALA ASP SEQRES 5 A 84 ASN SER VAL SER VAL GLN ASP ASP GLY ARG GLY ILE PRO SEQRES 6 A 84 THR GLY ILE HIS PRO GLU GLU GLY VAL SER ALA ALA GLU SEQRES 7 A 84 VAL ILE MET THR VAL LEU SEQRES 1 A 103 GLY VAL GLY VAL SER VAL VAL ASN ALA LEU SER GLN LYS SEQRES 2 A 103 LEU GLU LEU VAL ILE GLN ARG GLU GLY LYS ILE HIS ARG SEQRES 3 A 103 GLN ILE TYR GLU HIS GLY VAL PRO GLN ALA PRO LEU ALA SEQRES 4 A 103 VAL THR GLY GLU THR GLU LYS THR GLY THR MET VAL ARG SEQRES 5 A 103 PHE TRP PRO SER LEU GLU THR PHE THR ASN VAL THR GLU SEQRES 6 A 103 PHE GLU TYR GLU ILE LEU ALA LYS ARG LEU ARG GLU LEU SEQRES 7 A 103 SER PHE LEU ASN SER GLY VAL SER ILE ARG LEU ARG ASP SEQRES 8 A 103 LYS ARG ASP GLY LYS GLU ASP HIS PHE HIS TYR GLU HET CWW A 293 43 ATOM 1 N GLY A 15 68.595 11.574 49.740 1.00 75.53 N ATOM 2 CA GLY A 15 67.491 12.579 49.776 1.00 72.88 C ATOM 3 C GLY A 15 67.968 13.927 49.274 1.00 67.60 C ATOM 4 O GLY A 15 67.378 14.514 48.359 1.00 65.03 O ATOM 5 HN3 GLY A 15 69.377 11.898 50.344 1.00 0.00 H ATOM 6 HN2 GLY A 15 68.932 11.466 48.762 1.00 0.00 H ATOM 7 HN1 GLY A 15 68.242 10.660 50.089 1.00 0.00 H ATOM 8 N LEU A 16 69.055 14.414 49.867 1.00 66.32 N ATOM 9 CA LEU A 16 69.701 15.632 49.392 1.00 61.73 C ATOM 10 C LEU A 16 70.243 15.344 47.994 1.00 60.26 C ATOM 11 O LEU A 16 70.185 16.219 47.123 1.00 57.29 O ATOM 12 CB LEU A 16 70.821 16.089 50.338 1.00 62.29 C ATOM 13 CG LEU A 16 70.481 16.345 51.815 1.00 64.66 C ATOM 14 CD1 LEU A 16 71.758 16.406 52.650 1.00 67.06 C ATOM 15 CD2 LEU A 16 69.635 17.594 52.015 1.00 61.76 C ATOM 16 H LEU A 16 69.453 13.915 50.688 1.00 0.00 H ATOM 17 N ASP A 17 70.740 14.114 47.772 1.00 62.94 N ATOM 18 CA ASP A 17 71.136 13.656 46.437 1.00 62.49 C ATOM 19 C ASP A 17 69.989 13.820 45.436 1.00 60.97 C ATOM 20 O ASP A 17 70.194 14.347 44.348 1.00 59.10 O ATOM 21 CB ASP A 17 71.600 12.195 46.471 1.00 67.32 C ATOM 22 H ASP A 17 70.847 13.464 48.577 1.00 0.00 H ATOM 23 N ALA A 18 68.788 13.388 45.815 1.00 62.53 N ATOM 24 CA ALA A 18 67.594 13.506 44.958 1.00 62.09 C ATOM 25 C ALA A 18 67.325 14.945 44.507 1.00 57.50 C ATOM 26 O ALA A 18 67.059 15.211 43.327 1.00 56.20 O ATOM 27 CB ALA A 18 66.370 12.954 45.675 1.00 65.36 C ATOM 28 H ALA A 18 68.688 12.950 46.753 1.00 0.00 H ATOM 29 N VAL A 19 67.421 15.872 45.454 1.00 55.22 N ATOM 30 CA VAL A 19 67.165 17.278 45.168 1.00 51.74 C ATOM 31 C VAL A 19 68.266 17.828 44.255 1.00 49.48 C ATOM 32 O VAL A 19 67.972 18.569 43.315 1.00 46.67 O ATOM 33 CB VAL A 19 67.017 18.141 46.451 1.00 50.24 C ATOM 34 CG1 VAL A 19 66.687 19.585 46.082 1.00 46.66 C ATOM 35 CG2 VAL A 19 65.933 17.570 47.358 1.00 53.44 C ATOM 36 H VAL A 19 67.684 15.588 46.419 1.00 0.00 H ATOM 37 N ARG A 20 69.514 17.446 44.526 1.00 51.01 N ATOM 38 CA ARG A 20 70.639 17.810 43.650 1.00 51.21 C ATOM 39 C ARG A 20 70.576 17.219 42.229 1.00 52.80 C ATOM 40 O ARG A 20 71.061 17.845 41.290 1.00 51.14 O ATOM 41 CB ARG A 20 71.981 17.493 44.324 1.00 53.36 C ATOM 42 CG ARG A 20 72.311 18.502 45.421 1.00 52.51 C ATOM 43 CD ARG A 20 73.703 18.317 45.993 1.00 55.19 C ATOM 44 NE ARG A 20 73.640 17.896 47.394 1.00 58.09 N ATOM 45 CZ ARG A 20 73.778 16.653 47.859 1.00 62.05 C ATOM 46 NH1 ARG A 20 73.694 16.446 49.173 1.00 64.11 N ATOM 47 NH2 ARG A 20 74.013 15.615 47.046 1.00 64.31 N ATOM 48 HE ARG A 20 73.470 18.642 48.099 1.00 0.00 H ATOM 49 HH12 ARG A 20 73.799 15.485 49.556 1.00 0.00 H ATOM 50 HH11 ARG A 20 73.524 17.246 49.816 1.00 0.00 H ATOM 51 HH22 ARG A 20 74.116 14.658 47.441 1.00 0.00 H ATOM 52 HH21 ARG A 20 74.093 15.766 46.020 1.00 0.00 H ATOM 53 H ARG A 20 69.697 16.877 45.377 1.00 0.00 H ATOM 54 N LYS A 21 69.973 16.037 42.081 1.00 56.61 N ATOM 55 CA LYS A 21 69.766 15.420 40.757 1.00 59.46 C ATOM 56 C LYS A 21 68.697 16.116 39.935 1.00 57.53 C ATOM 57 O LYS A 21 68.886 16.308 38.745 1.00 57.91 O ATOM 58 CB LYS A 21 69.457 13.917 40.876 1.00 64.84 C ATOM 59 CG LYS A 21 70.649 13.046 41.253 1.00 68.21 C ATOM 60 CD LYS A 21 71.795 13.160 40.244 1.00 69.61 C ATOM 61 CE LYS A 21 72.858 14.189 40.657 1.00 67.34 C ATOM 62 NZ LYS A 21 73.810 13.624 41.649 1.00 69.91 N ATOM 63 HZ1 LYS A 21 73.289 13.330 42.500 1.00 0.00 H ATOM 64 HZ2 LYS A 21 74.292 12.801 41.235 1.00 0.00 H ATOM 65 HZ3 LYS A 21 74.513 14.347 41.904 1.00 0.00 H ATOM 66 H LYS A 21 69.638 15.534 42.928 1.00 0.00 H ATOM 67 N ARG A 22 67.584 16.493 40.552 1.00 56.39 N ATOM 68 CA ARG A 22 66.514 17.172 39.822 1.00 55.65 C ATOM 69 C ARG A 22 66.106 18.463 40.517 1.00 51.49 C ATOM 70 O ARG A 22 64.997 18.583 41.020 1.00 51.56 O ATOM 71 CB ARG A 22 65.328 16.232 39.659 1.00 60.07 C ATOM 72 CG ARG A 22 65.578 15.080 38.704 1.00 64.64 C ATOM 73 CD ARG A 22 64.255 14.551 38.183 1.00 68.98 C ATOM 74 NE ARG A 22 64.436 13.455 37.246 1.00 74.16 N ATOM 75 CZ ARG A 22 64.762 12.209 37.581 1.00 77.88 C ATOM 76 NH1 ARG A 22 64.974 11.867 38.856 1.00 77.45 N ATOM 77 NH2 ARG A 22 64.886 11.293 36.624 1.00 82.36 N ATOM 78 HE ARG A 22 64.300 13.660 36.236 1.00 0.00 H ATOM 79 HH12 ARG A 22 65.228 10.888 39.096 1.00 0.00 H ATOM 80 HH11 ARG A 22 64.885 12.580 39.607 1.00 0.00 H ATOM 81 HH22 ARG A 22 65.140 10.315 36.870 1.00 0.00 H ATOM 82 HH21 ARG A 22 64.729 11.555 35.630 1.00 0.00 H ATOM 83 H ARG A 22 67.471 16.303 41.568 1.00 0.00 H ATOM 84 N PRO A 23 67.001 19.451 40.526 1.00 48.29 N ATOM 85 CA PRO A 23 66.742 20.672 41.294 1.00 45.89 C ATOM 86 C PRO A 23 65.531 21.449 40.800 1.00 45.71 C ATOM 87 O PRO A 23 64.772 21.993 41.610 1.00 44.03 O ATOM 88 CB PRO A 23 68.033 21.476 41.111 1.00 43.79 C ATOM 89 CG PRO A 23 68.626 20.962 39.855 1.00 45.45 C ATOM 90 CD PRO A 23 68.310 19.501 39.862 1.00 48.32 C ATOM 91 N GLY A 24 65.345 21.473 39.482 1.00 47.09 N ATOM 92 CA GLY A 24 64.251 22.193 38.873 1.00 48.05 C ATOM 93 C GLY A 24 62.903 21.701 39.344 1.00 51.02 C ATOM 94 O GLY A 24 61.982 22.496 39.464 1.00 51.11 O ATOM 95 H GLY A 24 66.009 20.956 38.871 1.00 0.00 H ATOM 96 N MET A 25 62.785 20.406 39.632 1.00 54.93 N ATOM 97 CA MET A 25 61.542 19.861 40.210 1.00 58.78 C ATOM 98 C MET A 25 61.194 20.507 41.555 1.00 56.55 C ATOM 99 O MET A 25 60.020 20.761 41.852 1.00 58.40 O ATOM 100 CB MET A 25 61.637 18.349 40.444 1.00 63.67 C ATOM 101 CG MET A 25 61.664 17.491 39.195 1.00 68.14 C ATOM 102 SD MET A 25 61.112 15.787 39.472 1.00 76.06 S ATOM 103 CE MET A 25 61.652 15.410 41.145 1.00 74.79 C ATOM 104 H MET A 25 63.584 19.767 39.446 1.00 0.00 H ATOM 105 N TYR A 26 62.216 20.730 42.373 1.00 52.35 N ATOM 106 CA TYR A 26 62.028 21.218 43.734 1.00 50.94 C ATOM 107 C TYR A 26 61.990 22.742 43.829 1.00 47.60 C ATOM 108 O TYR A 26 61.162 23.300 44.553 1.00 47.77 O ATOM 109 CB TYR A 26 63.103 20.623 44.656 1.00 50.12 C ATOM 110 CG TYR A 26 62.970 19.119 44.812 1.00 53.71 C ATOM 111 CD1 TYR A 26 62.127 18.561 45.772 1.00 56.92 C ATOM 112 CD2 TYR A 26 63.679 18.251 43.983 1.00 54.53 C ATOM 113 CE1 TYR A 26 62.006 17.180 45.907 1.00 60.81 C ATOM 114 CE2 TYR A 26 63.566 16.875 44.107 1.00 58.01 C ATOM 115 CZ TYR A 26 62.729 16.346 45.067 1.00 61.41 C ATOM 116 OH TYR A 26 62.622 14.983 45.180 1.00 65.79 O ATOM 117 HH TYR A 26 61.988 14.762 45.908 1.00 0.00 H ATOM 118 H TYR A 26 63.182 20.551 42.032 1.00 0.00 H ATOM 119 N ILE A 27 62.866 23.425 43.100 1.00 44.35 N ATOM 120 CA ILE A 27 63.051 24.861 43.326 1.00 41.76 C ATOM 121 C ILE A 27 62.542 25.752 42.188 1.00 41.18 C ATOM 122 O ILE A 27 62.371 26.940 42.409 1.00 40.45 O ATOM 123 CB ILE A 27 64.542 25.143 43.665 1.00 39.96 C ATOM 124 CG1 ILE A 27 64.717 26.379 44.555 1.00 38.56 C ATOM 125 CG2 ILE A 27 65.382 25.295 42.400 1.00 39.11 C ATOM 126 CD1 ILE A 27 64.101 26.287 45.939 1.00 39.97 C ATOM 127 H ILE A 27 63.422 22.939 42.367 1.00 0.00 H ATOM 128 N GLY A 28 62.270 25.187 41.003 1.00 42.35 N ATOM 129 CA GLY A 28 61.895 25.962 39.810 1.00 41.77 C ATOM 130 C GLY A 28 63.067 26.055 38.841 1.00 40.54 C ATOM 131 O GLY A 28 64.147 25.525 39.114 1.00 39.72 O ATOM 132 H GLY A 28 62.327 24.152 40.923 1.00 0.00 H ATOM 133 N ASP A 29 62.856 26.738 37.715 1.00 40.39 N ATOM 134 CA ASP A 29 63.823 26.755 36.618 1.00 40.85 C ATOM 135 C ASP A 29 65.188 27.304 37.087 1.00 37.38 C ATOM 136 O ASP A 29 65.270 28.395 37.605 1.00 35.26 O ATOM 137 CB ASP A 29 63.279 27.575 35.431 1.00 43.50 C ATOM 138 CG ASP A 29 62.296 26.798 34.568 1.00 49.36 C ATOM 139 OD1 ASP A 29 62.386 25.544 34.469 1.00 52.90 O ATOM 140 OD2 ASP A 29 61.421 27.448 33.936 1.00 53.06 O ATOM 141 H ASP A 29 61.973 27.277 37.614 1.00 0.00 H ATOM 142 N THR A 30 66.237 26.519 36.883 1.00 37.24 N ATOM 143 CA THR A 30 67.590 26.824 37.335 1.00 35.63 C ATOM 144 C THR A 30 68.449 27.662 36.391 1.00 36.22 C ATOM 145 O THR A 30 69.620 27.970 36.702 1.00 35.85 O ATOM 146 CB THR A 30 68.356 25.510 37.549 1.00 36.70 C ATOM 147 OG1 THR A 30 68.421 24.796 36.313 1.00 38.46 O ATOM 148 CG2 THR A 30 67.684 24.665 38.633 1.00 36.84 C ATOM 149 HG1 THR A 30 68.890 25.348 35.639 1.00 0.00 H ATOM 150 H THR A 30 66.085 25.629 36.368 1.00 0.00 H ATOM 151 N ASP A 31 67.867 28.000 35.243 1.00 37.82 N ATOM 152 CA ASP A 31 68.557 28.590 34.101 1.00 39.92 C ATOM 153 C ASP A 31 68.125 30.037 33.779 1.00 39.39 C ATOM 154 O ASP A 31 68.683 30.664 32.877 1.00 40.76 O ATOM 155 CB ASP A 31 68.311 27.696 32.874 1.00 44.10 C ATOM 156 CG ASP A 31 66.796 27.486 32.564 1.00 45.73 C ATOM 157 OD1 ASP A 31 65.931 27.650 33.476 1.00 44.80 O ATOM 158 OD2 ASP A 31 66.471 27.125 31.409 1.00 50.77 O ATOM 159 H ASP A 31 66.845 27.831 35.153 1.00 0.00 H ATOM 160 N ASP A 32 67.135 30.567 34.493 1.00 37.54 N ATOM 161 CA ASP A 32 66.618 31.903 34.211 1.00 38.60 C ATOM 162 C ASP A 32 66.437 32.762 35.458 1.00 36.13 C ATOM 163 O ASP A 32 65.771 33.784 35.392 1.00 36.55 O ATOM 164 CB ASP A 32 65.278 31.776 33.483 1.00 41.37 C ATOM 165 CG ASP A 32 64.155 31.262 34.392 1.00 40.65 C ATOM 166 OD1 ASP A 32 64.401 30.677 35.474 1.00 39.07 O ATOM 167 OD2 ASP A 32 62.996 31.448 34.005 1.00 43.90 O ATOM 168 H ASP A 32 66.719 30.016 35.271 1.00 0.00 H ATOM 169 N GLY A 33 67.007 32.339 36.581 1.00 34.51 N ATOM 170 CA GLY A 33 66.884 33.039 37.851 1.00 32.80 C ATOM 171 C GLY A 33 65.635 32.778 38.687 1.00 31.64 C ATOM 172 O GLY A 33 65.548 33.299 39.762 1.00 29.92 O ATOM 173 H GLY A 33 67.569 31.464 36.551 1.00 0.00 H ATOM 174 N THR A 34 64.655 32.025 38.183 1.00 32.69 N ATOM 175 CA THR A 34 63.415 31.752 38.931 1.00 32.97 C ATOM 176 C THR A 34 63.709 31.006 40.199 1.00 31.44 C ATOM 177 O THR A 34 63.361 31.462 41.326 1.00 30.70 O ATOM 178 CB THR A 34 62.448 30.831 38.130 1.00 36.11 C ATOM 179 OG1 THR A 34 62.290 31.338 36.835 1.00 38.40 O ATOM 180 CG2 THR A 34 61.077 30.725 38.804 1.00 38.11 C ATOM 181 HG1 THR A 34 63.171 31.367 36.383 1.00 0.00 H ATOM 182 H THR A 34 64.770 31.618 37.233 1.00 0.00 H ATOM 183 N GLY A 35 64.358 29.856 40.006 1.00 30.97 N ATOM 184 CA GLY A 35 64.720 28.980 41.090 1.00 30.74 C ATOM 185 C GLY A 35 65.653 29.670 42.061 1.00 29.08 C ATOM 186 O GLY A 35 65.488 29.524 43.279 1.00 29.16 O ATOM 187 H GLY A 35 64.612 29.582 39.035 1.00 0.00 H ATOM 188 N LEU A 36 66.597 30.455 41.522 1.00 27.96 N ATOM 189 CA LEU A 36 67.578 31.160 42.348 1.00 26.93 C ATOM 190 C LEU A 36 66.871 32.017 43.388 1.00 26.60 C ATOM 191 O LEU A 36 67.180 31.957 44.599 1.00 26.46 O ATOM 192 CB LEU A 36 68.525 32.020 41.491 1.00 27.40 C ATOM 193 CG LEU A 36 69.650 32.715 42.293 1.00 27.76 C ATOM 194 CD1 LEU A 36 70.688 31.700 42.758 1.00 29.21 C ATOM 195 CD2 LEU A 36 70.319 33.814 41.490 1.00 28.61 C ATOM 196 H LEU A 36 66.633 30.566 40.489 1.00 0.00 H ATOM 197 N HIS A 37 65.911 32.789 42.927 1.00 26.59 N ATOM 198 CA HIS A 37 65.139 33.647 43.823 1.00 27.20 C ATOM 199 C HIS A 37 64.148 32.935 44.711 1.00 28.00 C ATOM 200 O HIS A 37 63.933 33.353 45.861 1.00 27.01 O ATOM 201 CB HIS A 37 64.523 34.794 43.027 1.00 27.52 C ATOM 202 CG HIS A 37 65.575 35.674 42.457 1.00 27.78 C ATOM 203 ND1 HIS A 37 66.197 35.398 41.262 1.00 28.37 N ATOM 204 CD2 HIS A 37 66.243 36.718 42.989 1.00 28.34 C ATOM 205 CE1 HIS A 37 67.139 36.285 41.035 1.00 28.79 C ATOM 206 NE2 HIS A 37 67.187 37.098 42.067 1.00 28.85 N ATOM 207 H HIS A 37 65.698 32.789 41.909 1.00 0.00 H ATOM 208 N HIS A 38 63.572 31.843 44.208 1.00 28.71 N ATOM 209 CA HIS A 38 62.724 30.973 45.040 1.00 30.32 C ATOM 210 C HIS A 38 63.454 30.523 46.310 1.00 30.70 C ATOM 211 O HIS A 38 62.825 30.351 47.369 1.00 31.25 O ATOM 212 CB HIS A 38 62.235 29.742 44.259 1.00 31.84 C ATOM 213 CG HIS A 38 61.104 29.008 44.920 1.00 34.68 C ATOM 214 ND1 HIS A 38 60.760 27.716 44.587 1.00 36.76 N ATOM 215 CD2 HIS A 38 60.244 29.382 45.898 1.00 36.58 C ATOM 216 CE1 HIS A 38 59.736 27.328 45.325 1.00 39.50 C ATOM 217 NE2 HIS A 38 59.405 28.321 46.130 1.00 39.25 N ATOM 218 H HIS A 38 63.725 31.601 43.208 1.00 0.00 H ATOM 219 N MET A 39 64.765 30.306 46.193 1.00 32.04 N ATOM 220 CA MET A 39 65.635 29.915 47.332 1.00 31.19 C ATOM 221 C MET A 39 65.535 30.914 48.464 1.00 29.08 C ATOM 222 O MET A 39 65.438 30.541 49.611 1.00 29.46 O ATOM 223 CB MET A 39 67.124 29.846 46.939 1.00 30.79 C ATOM 224 CG MET A 39 67.483 28.868 45.833 1.00 33.52 C ATOM 225 SD MET A 39 67.897 27.218 46.423 1.00 35.29 S ATOM 226 CE MET A 39 69.615 27.528 46.854 1.00 33.78 C ATOM 227 H MET A 39 65.201 30.416 45.255 1.00 0.00 H ATOM 228 N VAL A 40 65.589 32.191 48.114 1.00 28.62 N ATOM 229 CA VAL A 40 65.462 33.255 49.079 1.00 27.88 C ATOM 230 C VAL A 40 64.062 33.229 49.691 1.00 28.17 C ATOM 231 O VAL A 40 63.913 33.299 50.913 1.00 26.17 O ATOM 232 CB VAL A 40 65.698 34.648 48.468 1.00 28.71 C ATOM 233 CG1 VAL A 40 65.465 35.726 49.522 1.00 29.05 C ATOM 234 CG2 VAL A 40 67.116 34.771 47.923 1.00 29.20 C ATOM 235 H VAL A 40 65.727 32.433 47.112 1.00 0.00 H ATOM 236 N PHE A 41 63.053 33.117 48.843 1.00 29.57 N ATOM 237 CA PHE A 41 61.676 33.160 49.333 1.00 31.25 C ATOM 238 C PHE A 41 61.336 32.002 50.283 1.00 30.32 C ATOM 239 O PHE A 41 60.556 32.208 51.187 1.00 29.31 O ATOM 240 CB PHE A 41 60.656 33.270 48.184 1.00 35.00 C ATOM 241 CG PHE A 41 60.918 34.426 47.228 1.00 36.92 C ATOM 242 CD1 PHE A 41 61.357 35.668 47.695 1.00 36.58 C ATOM 243 CD2 PHE A 41 60.717 34.272 45.858 1.00 41.07 C ATOM 244 CE1 PHE A 41 61.605 36.715 46.816 1.00 38.32 C ATOM 245 CE2 PHE A 41 60.952 35.325 44.962 1.00 43.02 C ATOM 246 CZ PHE A 41 61.405 36.550 45.450 1.00 41.14 C ATOM 247 H PHE A 41 63.239 32.998 47.827 1.00 0.00 H ATOM 248 N GLU A 42 61.912 30.819 50.079 1.00 30.33 N ATOM 249 CA GLU A 42 61.699 29.685 50.988 1.00 31.83 C ATOM 250 C GLU A 42 62.261 29.981 52.386 1.00 29.05 C ATOM 251 O GLU A 42 61.608 29.693 53.394 1.00 28.56 O ATOM 252 CB GLU A 42 62.297 28.378 50.428 1.00 34.27 C ATOM 253 CG GLU A 42 61.552 27.831 49.205 1.00 38.66 C ATOM 254 CD GLU A 42 60.143 27.322 49.529 1.00 42.46 C ATOM 255 OE1 GLU A 42 59.884 26.905 50.700 1.00 43.88 O ATOM 256 OE2 GLU A 42 59.286 27.342 48.618 1.00 47.19 O ATOM 257 H GLU A 42 62.531 30.694 49.252 1.00 0.00 H ATOM 258 N VAL A 43 63.439 30.595 52.441 1.00 27.11 N ATOM 259 CA VAL A 43 64.003 30.974 53.715 1.00 26.43 C ATOM 260 C VAL A 43 63.131 32.040 54.404 1.00 26.25 C ATOM 261 O VAL A 43 62.770 31.893 55.551 1.00 26.39 O ATOM 262 CB VAL A 43 65.469 31.425 53.590 1.00 25.57 C ATOM 263 CG1 VAL A 43 66.032 31.773 54.974 1.00 25.47 C ATOM 264 CG2 VAL A 43 66.298 30.303 52.956 1.00 26.27 C ATOM 265 H VAL A 43 63.956 30.803 51.563 1.00 0.00 H ATOM 266 N VAL A 44 62.790 33.088 53.675 1.00 26.51 N ATOM 267 CA VAL A 44 61.911 34.124 54.166 1.00 27.75 C ATOM 268 C VAL A 44 60.561 33.569 54.682 1.00 29.09 C ATOM 269 O VAL A 44 60.099 33.962 55.763 1.00 28.62 O ATOM 270 CB VAL A 44 61.708 35.249 53.107 1.00 28.97 C ATOM 271 CG1 VAL A 44 60.625 36.224 53.541 1.00 30.03 C ATOM 272 CG2 VAL A 44 63.008 36.019 52.892 1.00 28.62 C ATOM 273 H VAL A 44 63.169 33.170 52.710 1.00 0.00 H ATOM 274 N ASP A 45 59.965 32.633 53.947 1.00 30.99 N ATOM 275 CA ASP A 45 58.695 32.000 54.378 1.00 33.56 C ATOM 276 C ASP A 45 58.758 31.372 55.780 1.00 32.44 C ATOM 277 O ASP A 45 57.786 31.444 56.529 1.00 31.71 O ATOM 278 CB ASP A 45 58.205 30.968 53.352 1.00 36.75 C ATOM 279 CG ASP A 45 57.605 31.614 52.085 1.00 40.59 C ATOM 280 OD1 ASP A 45 57.566 32.871 51.949 1.00 41.43 O ATOM 281 OD2 ASP A 45 57.179 30.834 51.188 1.00 45.43 O ATOM 282 H ASP A 45 60.400 32.339 53.049 1.00 0.00 H ATOM 283 N ASN A 46 59.909 30.810 56.134 1.00 31.50 N ATOM 284 CA ASN A 46 60.122 30.302 57.472 1.00 32.39 C ATOM 285 C ASN A 46 60.081 31.397 58.535 1.00 30.62 C ATOM 286 O ASN A 46 59.547 31.171 59.610 1.00 30.89 O ATOM 287 CB ASN A 46 61.468 29.550 57.583 1.00 33.84 C ATOM 288 CG ASN A 46 61.341 28.067 57.322 1.00 37.05 C ATOM 289 OD1 ASN A 46 60.392 27.610 56.706 1.00 39.40 O ATOM 290 ND2 ASN A 46 62.281 27.298 57.856 1.00 39.77 N ATOM 291 HD22 ASN A 46 63.074 27.729 58.373 1.00 0.00 H ATOM 292 HD21 ASN A 46 62.225 26.264 57.757 1.00 0.00 H ATOM 293 H ASN A 46 60.674 30.734 55.434 1.00 0.00 H ATOM 294 N ALA A 47 60.679 32.548 58.246 1.00 28.33 N ATOM 295 CA ALA A 47 60.613 33.696 59.131 1.00 28.65 C ATOM 296 C ALA A 47 59.203 34.292 59.208 1.00 29.26 C ATOM 297 O ALA A 47 58.768 34.708 60.267 1.00 29.36 O ATOM 298 CB ALA A 47 61.618 34.761 58.705 1.00 28.08 C ATOM 299 H ALA A 47 61.212 32.629 57.356 1.00 0.00 H ATOM 300 N ILE A 48 58.513 34.344 58.069 1.00 29.48 N ATOM 301 CA ILE A 48 57.127 34.808 58.014 1.00 30.97 C ATOM 302 C ILE A 48 56.248 33.933 58.907 1.00 32.20 C ATOM 303 O ILE A 48 55.420 34.452 59.630 1.00 32.87 O ATOM 304 CB ILE A 48 56.552 34.802 56.564 1.00 32.02 C ATOM 305 CG1 ILE A 48 57.226 35.883 55.703 1.00 31.29 C ATOM 306 CG2 ILE A 48 55.019 34.983 56.540 1.00 33.95 C ATOM 307 CD1 ILE A 48 56.856 37.298 56.048 1.00 32.46 C ATOM 308 H ILE A 48 58.977 34.044 57.188 1.00 0.00 H ATOM 309 N ASP A 49 56.444 32.623 58.852 1.00 32.75 N ATOM 310 CA ASP A 49 55.703 31.700 59.721 1.00 34.53 C ATOM 311 C ASP A 49 55.938 32.006 61.192 1.00 33.31 C ATOM 312 O ASP A 49 55.003 31.969 61.978 1.00 33.90 O ATOM 313 CB ASP A 49 56.077 30.261 59.427 1.00 36.09 C ATOM 314 CG ASP A 49 55.467 29.755 58.143 1.00 39.26 C ATOM 315 OD1 ASP A 49 54.559 30.414 57.579 1.00 41.48 O ATOM 316 OD2 ASP A 49 55.888 28.667 57.701 1.00 41.70 O ATOM 317 H ASP A 49 57.138 32.241 58.178 1.00 0.00 H ATOM 318 N GLU A 50 57.178 32.328 61.547 1.00 31.34 N ATOM 319 CA GLU A 50 57.461 32.791 62.901 1.00 31.93 C ATOM 320 C GLU A 50 56.749 34.119 63.236 1.00 32.67 C ATOM 321 O GLU A 50 56.343 34.315 64.399 1.00 33.87 O ATOM 322 CB GLU A 50 58.976 32.908 63.144 1.00 30.46 C ATOM 323 CG GLU A 50 59.383 33.279 64.564 1.00 31.03 C ATOM 324 CD GLU A 50 59.170 32.180 65.600 1.00 32.91 C ATOM 325 OE1 GLU A 50 58.511 31.163 65.316 1.00 34.59 O ATOM 326 OE2 GLU A 50 59.683 32.306 66.732 1.00 32.56 O ATOM 327 H GLU A 50 57.951 32.249 60.855 1.00 0.00 H ATOM 328 N ALA A 51 56.640 35.024 62.255 1.00 32.66 N ATOM 329 CA ALA A 51 55.822 36.245 62.394 1.00 34.37 C ATOM 330 C ALA A 51 54.335 35.961 62.565 1.00 36.99 C ATOM 331 O ALA A 51 53.686 36.574 63.418 1.00 39.41 O ATOM 332 CB ALA A 51 56.032 37.188 61.209 1.00 34.49 C ATOM 333 H ALA A 51 57.150 34.861 61.363 1.00 0.00 H ATOM 334 N LEU A 52 53.793 35.040 61.771 1.00 37.73 N ATOM 335 CA LEU A 52 52.384 34.636 61.895 1.00 40.70 C ATOM 336 C LEU A 52 52.074 33.997 63.240 1.00 41.79 C ATOM 337 O LEU A 52 50.956 34.121 63.734 1.00 44.63 O ATOM 338 CB LEU A 52 52.001 33.659 60.781 1.00 42.20 C ATOM 339 CG LEU A 52 51.900 34.297 59.397 1.00 43.40 C ATOM 340 CD1 LEU A 52 52.021 33.230 58.308 1.00 44.97 C ATOM 341 CD2 LEU A 52 50.609 35.090 59.243 1.00 45.69 C ATOM 342 H LEU A 52 54.384 34.593 61.041 1.00 0.00 H ATOM 343 N ALA A 53 53.049 33.294 63.814 1.00 40.42 N ATOM 344 CA ALA A 53 52.918 32.739 65.166 1.00 42.13 C ATOM 345 C ALA A 53 52.984 33.816 66.257 1.00 42.57 C ATOM 346 O ALA A 53 52.759 33.518 67.428 1.00 43.63 O ATOM 347 CB ALA A 53 53.990 31.691 65.409 1.00 41.73 C ATOM 348 H ALA A 53 53.931 33.133 63.287 1.00 0.00 H ATOM 349 N GLY A 54 53.327 35.052 65.877 1.00 41.46 N ATOM 350 CA GLY A 54 53.308 36.192 66.787 1.00 41.82 C ATOM 351 C GLY A 54 54.628 36.441 67.502 1.00 40.99 C ATOM 352 O GLY A 54 54.676 37.227 68.441 1.00 41.73 O ATOM 353 H GLY A 54 53.620 35.207 64.891 1.00 0.00 H ATOM 354 N HIS A 55 55.703 35.798 67.060 1.00 38.65 N ATOM 355 CA HIS A 55 56.975 35.866 67.763 1.00 39.39 C ATOM 356 C HIS A 55 58.089 36.595 66.999 1.00 38.38 C ATOM 357 O HIS A 55 59.183 36.720 67.525 1.00 40.96 O ATOM 358 CB HIS A 55 57.411 34.447 68.173 1.00 40.01 C ATOM 359 CG HIS A 55 56.510 33.818 69.191 1.00 42.44 C ATOM 360 ND1 HIS A 55 56.626 34.059 70.546 1.00 44.83 N ATOM 361 CD2 HIS A 55 55.462 32.975 69.047 1.00 43.28 C ATOM 362 CE1 HIS A 55 55.696 33.378 71.190 1.00 46.67 C ATOM 363 NE2 HIS A 55 54.975 32.715 70.302 1.00 45.85 N ATOM 364 H HIS A 55 55.634 35.232 66.190 1.00 0.00 H ATOM 365 N CYS A 56 57.813 37.123 65.807 1.00 36.64 N ATOM 366 CA CYS A 56 58.837 37.826 65.015 1.00 35.27 C ATOM 367 C CYS A 56 58.232 39.118 64.511 1.00 34.59 C ATOM 368 O CYS A 56 57.158 39.090 63.898 1.00 34.95 O ATOM 369 CB CYS A 56 59.320 36.951 63.859 1.00 34.15 C ATOM 370 SG CYS A 56 60.167 37.819 62.507 1.00 34.45 S ATOM 371 H CYS A 56 56.849 37.036 65.426 1.00 0.00 H ATOM 372 N LYS A 57 58.901 40.240 64.770 1.00 34.50 N ATOM 373 CA LYS A 57 58.433 41.558 64.313 1.00 35.44 C ATOM 374 C LYS A 57 59.208 42.108 63.100 1.00 34.69 C ATOM 375 O LYS A 57 58.691 42.949 62.387 1.00 35.02 O ATOM 376 CB LYS A 57 58.488 42.564 65.460 1.00 38.10 C ATOM 377 CG LYS A 57 57.622 42.192 66.662 1.00 39.94 C ATOM 378 H LYS A 57 59.785 40.183 65.314 1.00 0.00 H ATOM 379 N GLU A 58 60.445 41.663 62.887 1.00 33.47 N ATOM 380 CA GLU A 58 61.288 42.204 61.816 1.00 34.05 C ATOM 381 C GLU A 58 62.107 41.125 61.098 1.00 30.81 C ATOM 382 O GLU A 58 62.634 40.179 61.702 1.00 29.07 O ATOM 383 CB GLU A 58 62.199 43.320 62.315 1.00 37.90 C ATOM 384 CG GLU A 58 62.937 44.011 61.159 1.00 40.42 C ATOM 385 CD GLU A 58 63.417 45.408 61.486 1.00 45.34 C ATOM 386 OE1 GLU A 58 64.615 45.546 61.832 1.00 48.47 O ATOM 387 OE2 GLU A 58 62.613 46.371 61.376 1.00 48.18 O ATOM 388 H GLU A 58 60.824 40.911 63.497 1.00 0.00 H ATOM 389 N ILE A 59 62.168 41.253 59.784 1.00 28.30 N ATOM 390 CA ILE A 59 62.941 40.330 58.959 1.00 26.83 C ATOM 391 C ILE A 59 63.860 41.207 58.139 1.00 26.44 C ATOM 392 O ILE A 59 63.416 42.215 57.580 1.00 27.54 O ATOM 393 CB ILE A 59 61.998 39.439 58.093 1.00 27.45 C ATOM 394 CG1 ILE A 59 61.192 38.501 58.991 1.00 27.70 C ATOM 395 CG2 ILE A 59 62.780 38.572 57.105 1.00 26.44 C ATOM 396 CD1 ILE A 59 60.002 37.897 58.293 1.00 29.43 C ATOM 397 H ILE A 59 61.652 42.031 59.326 1.00 0.00 H ATOM 398 N ILE A 60 65.145 40.893 58.139 1.00 25.45 N ATOM 399 CA ILE A 60 66.107 41.654 57.348 1.00 25.41 C ATOM 400 C ILE A 60 66.691 40.717 56.328 1.00 24.42 C ATOM 401 O ILE A 60 67.258 39.675 56.691 1.00 24.12 O ATOM 402 CB ILE A 60 67.232 42.233 58.195 1.00 25.53 C ATOM 403 CG1 ILE A 60 66.649 43.053 59.347 1.00 26.79 C ATOM 404 CG2 ILE A 60 68.146 43.103 57.336 1.00 25.52 C ATOM 405 CD1 ILE A 60 67.680 43.380 60.400 1.00 26.87 C ATOM 406 H ILE A 60 65.475 40.091 58.712 1.00 0.00 H ATOM 407 N VAL A 61 66.556 41.091 55.055 1.00 24.22 N ATOM 408 CA VAL A 61 67.120 40.328 53.966 1.00 23.79 C ATOM 409 C VAL A 61 68.261 41.148 53.380 1.00 23.63 C ATOM 410 O VAL A 61 68.055 42.310 53.000 1.00 24.04 O ATOM 411 CB VAL A 61 66.058 40.047 52.886 1.00 24.63 C ATOM 412 CG1 VAL A 61 66.657 39.242 51.737 1.00 24.64 C ATOM 413 CG2 VAL A 61 64.844 39.354 53.476 1.00 25.40 C ATOM 414 H VAL A 61 66.027 41.960 54.839 1.00 0.00 H ATOM 415 N THR A 62 69.456 40.556 53.318 1.00 23.23 N ATOM 416 CA THR A 62 70.634 41.230 52.836 1.00 23.18 C ATOM 417 C THR A 62 71.244 40.479 51.672 1.00 23.57 C ATOM 418 O THR A 62 71.500 39.281 51.785 1.00 23.08 O ATOM 419 CB THR A 62 71.683 41.369 53.969 1.00 22.71 C ATOM 420 OG1 THR A 62 71.071 42.059 55.048 1.00 23.16 O ATOM 421 CG2 THR A 62 72.928 42.135 53.495 1.00 22.50 C ATOM 422 HG1 THR A 62 70.288 41.543 55.366 1.00 0.00 H ATOM 423 H THR A 62 69.540 39.568 53.631 1.00 0.00 H ATOM 424 N ILE A 63 71.456 41.185 50.555 1.00 24.27 N ATOM 425 CA ILE A 63 72.219 40.690 49.423 1.00 24.66 C ATOM 426 C ILE A 63 73.651 41.146 49.676 1.00 24.62 C ATOM 427 O ILE A 63 73.953 42.343 49.645 1.00 24.38 O ATOM 428 CB ILE A 63 71.736 41.263 48.064 1.00 25.79 C ATOM 429 CG1 ILE A 63 70.256 40.965 47.833 1.00 26.46 C ATOM 430 CG2 ILE A 63 72.588 40.694 46.944 1.00 26.21 C ATOM 431 CD1 ILE A 63 69.609 41.731 46.699 1.00 27.31 C ATOM 432 H ILE A 63 71.052 42.141 50.494 1.00 0.00 H ATOM 433 N HIS A 64 74.527 40.194 49.960 1.00 24.17 N ATOM 434 CA HIS A 64 75.919 40.497 50.262 1.00 24.00 C ATOM 435 C HIS A 64 76.698 40.645 48.974 1.00 24.64 C ATOM 436 O HIS A 64 76.198 40.311 47.913 1.00 24.42 O ATOM 437 CB HIS A 64 76.501 39.392 51.162 1.00 24.29 C ATOM 438 CG HIS A 64 75.799 39.293 52.484 1.00 23.63 C ATOM 439 ND1 HIS A 64 76.094 40.121 53.542 1.00 23.28 N ATOM 440 CD2 HIS A 64 74.777 38.506 52.894 1.00 23.53 C ATOM 441 CE1 HIS A 64 75.294 39.844 54.559 1.00 23.27 C ATOM 442 NE2 HIS A 64 74.475 38.870 54.187 1.00 23.35 N ATOM 443 H HIS A 64 74.212 39.203 49.968 1.00 0.00 H ATOM 444 N ALA A 65 77.937 41.096 49.078 1.00 24.41 N ATOM 445 CA ALA A 65 78.793 41.298 47.905 1.00 25.58 C ATOM 446 C ALA A 65 79.652 40.076 47.481 1.00 26.12 C ATOM 447 O ALA A 65 80.520 40.210 46.630 1.00 26.08 O ATOM 448 CB ALA A 65 79.689 42.499 48.160 1.00 25.85 C ATOM 449 H ALA A 65 78.316 41.314 50.022 1.00 0.00 H ATOM 450 N ASP A 66 79.421 38.919 48.115 1.00 25.75 N ATOM 451 CA ASP A 66 80.132 37.676 47.853 1.00 26.37 C ATOM 452 C ASP A 66 79.178 36.575 47.333 1.00 26.26 C ATOM 453 O ASP A 66 79.417 35.381 47.568 1.00 26.26 O ATOM 454 CB ASP A 66 80.777 37.174 49.152 1.00 26.70 C ATOM 455 CG ASP A 66 79.734 36.742 50.213 1.00 25.97 C ATOM 456 OD1 ASP A 66 78.511 36.999 50.064 1.00 25.98 O ATOM 457 OD2 ASP A 66 80.138 36.122 51.194 1.00 26.36 O ATOM 458 H ASP A 66 78.681 38.908 48.846 1.00 0.00 H ATOM 459 N ASN A 67 78.096 36.983 46.683 1.00 25.59 N ATOM 460 CA ASN A 67 77.139 36.038 46.043 1.00 26.21 C ATOM 461 C ASN A 67 76.372 35.190 47.102 1.00 25.66 C ATOM 462 O ASN A 67 75.964 34.088 46.836 1.00 26.53 O ATOM 463 CB ASN A 67 77.866 35.185 44.999 1.00 27.64 C ATOM 464 CG ASN A 67 76.948 34.491 44.002 1.00 28.87 C ATOM 465 OD1 ASN A 67 77.363 33.503 43.446 1.00 31.06 O ATOM 466 ND2 ASN A 67 75.710 34.953 43.810 1.00 28.27 N ATOM 467 HD22 ASN A 67 75.391 35.808 44.309 1.00 0.00 H ATOM 468 HD21 ASN A 67 75.065 34.458 43.162 1.00 0.00 H ATOM 469 H ASN A 67 77.908 38.004 46.618 1.00 0.00 H ATOM 470 N SER A 68 76.162 35.743 48.285 1.00 24.44 N ATOM 471 CA SER A 68 75.293 35.113 49.297 1.00 24.17 C ATOM 472 C SER A 68 74.155 36.035 49.614 1.00 23.43 C ATOM 473 O SER A 68 74.234 37.227 49.319 1.00 22.56 O ATOM 474 CB SER A 68 76.043 34.723 50.570 1.00 24.06 C ATOM 475 OG SER A 68 76.604 35.834 51.258 1.00 23.33 O ATOM 476 HG SER A 68 77.246 36.298 50.664 1.00 0.00 H ATOM 477 H SER A 68 76.623 36.648 48.508 1.00 0.00 H ATOM 478 N VAL A 69 73.066 35.458 50.119 1.00 23.42 N ATOM 479 CA VAL A 69 71.976 36.196 50.723 1.00 23.48 C ATOM 480 C VAL A 69 71.802 35.715 52.188 1.00 22.74 C ATOM 481 O VAL A 69 71.967 34.521 52.497 1.00 22.10 O ATOM 482 CB VAL A 69 70.644 36.037 49.931 1.00 25.33 C ATOM 483 CG1 VAL A 69 69.392 36.365 50.746 1.00 25.98 C ATOM 484 CG2 VAL A 69 70.641 37.002 48.780 1.00 26.67 C ATOM 485 H VAL A 69 72.994 34.421 50.077 1.00 0.00 H ATOM 486 N SER A 70 71.486 36.657 53.063 1.00 22.52 N ATOM 487 CA SER A 70 71.152 36.332 54.458 1.00 22.53 C ATOM 488 C SER A 70 69.752 36.787 54.756 1.00 22.90 C ATOM 489 O SER A 70 69.286 37.820 54.264 1.00 22.52 O ATOM 490 CB SER A 70 72.175 36.867 55.448 1.00 22.53 C ATOM 491 OG SER A 70 72.219 38.278 55.460 1.00 23.97 O ATOM 492 HG SER A 70 71.330 38.633 55.714 1.00 0.00 H ATOM 493 H SER A 70 71.474 37.651 52.757 1.00 0.00 H ATOM 494 N VAL A 71 69.060 35.980 55.553 1.00 23.32 N ATOM 495 CA VAL A 71 67.745 36.320 56.042 1.00 24.00 C ATOM 496 C VAL A 71 67.871 36.209 57.584 1.00 24.74 C ATOM 497 O VAL A 71 68.276 35.156 58.078 1.00 23.46 O ATOM 498 CB VAL A 71 66.660 35.370 55.501 1.00 24.23 C ATOM 499 CG1 VAL A 71 65.303 35.725 56.058 1.00 24.81 C ATOM 500 CG2 VAL A 71 66.636 35.355 53.962 1.00 25.16 C ATOM 501 H VAL A 71 69.480 35.071 55.834 1.00 0.00 H ATOM 502 N GLN A 72 67.573 37.308 58.291 1.00 25.11 N ATOM 503 CA GLN A 72 67.676 37.368 59.747 1.00 25.95 C ATOM 504 C GLN A 72 66.308 37.751 60.271 1.00 26.00 C ATOM 505 O GLN A 72 65.709 38.706 59.777 1.00 27.07 O ATOM 506 CB GLN A 72 68.733 38.390 60.186 1.00 27.49 C ATOM 507 CG GLN A 72 68.765 38.711 61.700 1.00 29.32 C ATOM 508 CD GLN A 72 69.547 37.713 62.558 1.00 30.60 C ATOM 509 OE1 GLN A 72 70.791 37.695 62.506 1.00 32.79 O ATOM 510 NE2 GLN A 72 68.827 36.894 63.405 1.00 30.01 N ATOM 511 HE22 GLN A 72 67.788 36.942 63.416 1.00 0.00 H ATOM 512 HE21 GLN A 72 69.324 36.229 64.032 1.00 0.00 H ATOM 513 H GLN A 72 67.254 38.156 57.780 1.00 0.00 H ATOM 514 N ASP A 73 65.814 37.022 61.259 1.00 25.03 N ATOM 515 CA ASP A 73 64.587 37.388 61.959 1.00 25.31 C ATOM 516 C ASP A 73 64.872 37.610 63.458 1.00 25.34 C ATOM 517 O ASP A 73 65.966 37.282 63.947 1.00 23.94 O ATOM 518 CB ASP A 73 63.459 36.374 61.710 1.00 26.17 C ATOM 519 CG ASP A 73 63.671 35.020 62.409 1.00 26.75 C ATOM 520 OD1 ASP A 73 64.069 35.008 63.614 1.00 26.82 O ATOM 521 OD2 ASP A 73 63.385 33.967 61.764 1.00 26.79 O ATOM 522 H ASP A 73 66.318 36.159 61.546 1.00 0.00 H ATOM 523 N ASP A 74 63.900 38.169 64.159 1.00 25.98 N ATOM 524 CA ASP A 74 64.017 38.426 65.618 1.00 27.34 C ATOM 525 C ASP A 74 63.041 37.543 66.396 1.00 27.32 C ATOM 526 O ASP A 74 62.511 37.946 67.431 1.00 28.05 O ATOM 527 CB ASP A 74 63.824 39.928 65.942 1.00 29.23 C ATOM 528 CG ASP A 74 62.484 40.464 65.465 1.00 31.57 C ATOM 529 OD1 ASP A 74 61.666 39.681 64.909 1.00 31.95 O ATOM 530 OD2 ASP A 74 62.213 41.668 65.668 1.00 34.23 O ATOM 531 H ASP A 74 63.022 38.439 63.672 1.00 0.00 H ATOM 532 N GLY A 75 62.804 36.337 65.884 1.00 26.46 N ATOM 533 CA GLY A 75 61.904 35.376 66.515 1.00 26.78 C ATOM 534 C GLY A 75 62.530 34.605 67.671 1.00 26.22 C ATOM 535 O GLY A 75 63.567 34.997 68.212 1.00 25.38 O ATOM 536 H GLY A 75 63.279 36.069 64.999 1.00 0.00 H ATOM 537 N ARG A 76 61.908 33.485 68.013 1.00 26.03 N ATOM 538 CA ARG A 76 62.359 32.660 69.131 1.00 26.62 C ATOM 539 C ARG A 76 63.675 31.928 68.903 1.00 25.68 C ATOM 540 O ARG A 76 64.279 31.468 69.864 1.00 25.53 O ATOM 541 CB ARG A 76 61.293 31.644 69.498 1.00 27.42 C ATOM 542 CG ARG A 76 60.074 32.317 70.089 1.00 29.16 C ATOM 543 CD ARG A 76 58.919 31.351 70.176 1.00 30.37 C ATOM 544 NE ARG A 76 58.421 30.986 68.858 1.00 30.59 N ATOM 545 CZ ARG A 76 57.348 30.224 68.640 1.00 32.53 C ATOM 546 NH1 ARG A 76 56.657 29.712 69.655 1.00 33.71 N ATOM 547 NH2 ARG A 76 56.954 29.962 67.389 1.00 32.86 N ATOM 548 HE ARG A 76 58.937 31.344 68.029 1.00 0.00 H ATOM 549 HH12 ARG A 76 55.823 29.120 69.470 1.00 0.00 H ATOM 550 HH11 ARG A 76 56.951 29.904 70.634 1.00 0.00 H ATOM 551 HH22 ARG A 76 56.117 29.368 67.221 1.00 0.00 H ATOM 552 HH21 ARG A 76 57.484 30.353 66.584 1.00 0.00 H ATOM 553 H ARG A 76 61.074 33.185 67.469 1.00 0.00 H ATOM 554 N GLY A 77 64.100 31.810 67.651 1.00 24.99 N ATOM 555 CA GLY A 77 65.233 30.981 67.293 1.00 25.16 C ATOM 556 C GLY A 77 64.756 29.565 66.966 1.00 25.85 C ATOM 557 O GLY A 77 63.859 29.028 67.596 1.00 26.03 O ATOM 558 H GLY A 77 63.602 32.331 66.901 1.00 0.00 H ATOM 559 N ILE A 78 65.353 28.978 65.945 1.00 26.00 N ATOM 560 CA ILE A 78 65.233 27.563 65.725 1.00 27.18 C ATOM 561 C ILE A 78 65.710 26.804 67.004 1.00 27.39 C ATOM 562 O ILE A 78 66.700 27.186 67.632 1.00 26.92 O ATOM 563 CB ILE A 78 66.021 27.141 64.461 1.00 27.14 C ATOM 564 CG1 ILE A 78 65.268 27.612 63.185 1.00 27.58 C ATOM 565 CG2 ILE A 78 66.183 25.633 64.398 1.00 27.92 C ATOM 566 CD1 ILE A 78 66.005 27.336 61.892 1.00 28.29 C ATOM 567 H ILE A 78 65.921 29.550 65.288 1.00 0.00 H ATOM 568 N PRO A 79 65.016 25.726 67.366 1.00 28.32 N ATOM 569 CA PRO A 79 65.448 24.939 68.535 1.00 29.11 C ATOM 570 C PRO A 79 66.846 24.340 68.381 1.00 29.35 C ATOM 571 O PRO A 79 67.253 23.930 67.298 1.00 28.59 O ATOM 572 CB PRO A 79 64.397 23.834 68.645 1.00 30.19 C ATOM 573 CG PRO A 79 63.616 23.871 67.372 1.00 30.82 C ATOM 574 CD PRO A 79 63.769 25.222 66.763 1.00 29.67 C ATOM 575 N THR A 80 67.579 24.344 69.480 1.00 30.36 N ATOM 576 CA THR A 80 68.973 23.975 69.494 1.00 31.24 C ATOM 577 C THR A 80 69.223 22.706 70.304 1.00 32.44 C ATOM 578 O THR A 80 70.359 22.242 70.369 1.00 33.33 O ATOM 579 CB THR A 80 69.801 25.139 70.065 1.00 32.22 C ATOM 580 OG1 THR A 80 69.317 25.474 71.361 1.00 32.76 O ATOM 581 CG2 THR A 80 69.659 26.387 69.181 1.00 31.19 C ATOM 582 HG1 THR A 80 69.850 26.223 71.728 1.00 0.00 H ATOM 583 H THR A 80 67.131 24.626 70.375 1.00 0.00 H ATOM 584 N GLY A 81 68.183 22.102 70.881 1.00 32.28 N ATOM 585 CA GLY A 81 68.377 20.881 71.652 1.00 32.70 C ATOM 586 C GLY A 81 68.887 19.715 70.830 1.00 33.87 C ATOM 587 O GLY A 81 68.759 19.697 69.599 1.00 33.54 O ATOM 588 H GLY A 81 67.229 22.504 70.780 1.00 0.00 H ATOM 589 N ILE A 82 69.442 18.729 71.527 1.00 34.42 N ATOM 590 CA ILE A 82 69.990 17.539 70.934 1.00 36.18 C ATOM 591 C ILE A 82 69.120 16.387 71.379 1.00 35.87 C ATOM 592 O ILE A 82 68.667 16.367 72.527 1.00 35.15 O ATOM 593 CB ILE A 82 71.428 17.234 71.440 1.00 38.50 C ATOM 594 CG1 ILE A 82 72.299 18.478 71.457 1.00 39.44 C ATOM 595 CG2 ILE A 82 72.096 16.184 70.570 1.00 40.61 C ATOM 596 CD1 ILE A 82 72.378 19.211 70.135 1.00 39.87 C ATOM 597 H ILE A 82 69.482 18.823 72.562 1.00 0.00 H ATOM 598 N HIS A 83 68.913 15.432 70.482 1.00 35.56 N ATOM 599 CA HIS A 83 68.292 14.187 70.839 1.00 36.59 C ATOM 600 C HIS A 83 69.403 13.336 71.460 1.00 38.51 C ATOM 601 O HIS A 83 70.357 12.988 70.757 1.00 38.65 O ATOM 602 CB HIS A 83 67.720 13.497 69.611 1.00 36.92 C ATOM 603 CG HIS A 83 66.887 12.304 69.927 1.00 37.71 C ATOM 604 ND1 HIS A 83 67.357 11.233 70.652 1.00 39.03 N ATOM 605 CD2 HIS A 83 65.599 12.020 69.633 1.00 37.88 C ATOM 606 CE1 HIS A 83 66.404 10.330 70.773 1.00 40.04 C ATOM 607 NE2 HIS A 83 65.321 10.790 70.172 1.00 39.29 N ATOM 608 H HIS A 83 69.207 15.588 69.497 1.00 0.00 H ATOM 609 N PRO A 84 69.271 12.972 72.759 1.00 39.94 N ATOM 610 CA PRO A 84 70.371 12.270 73.462 1.00 42.03 C ATOM 611 C PRO A 84 70.844 10.951 72.848 1.00 44.94 C ATOM 612 O PRO A 84 72.044 10.717 72.849 1.00 47.16 O ATOM 613 CB PRO A 84 69.806 12.018 74.860 1.00 42.15 C ATOM 614 CG PRO A 84 68.736 13.027 75.030 1.00 40.45 C ATOM 615 CD PRO A 84 68.136 13.213 73.663 1.00 39.49 C ATOM 616 N GLU A 85 69.950 10.080 72.378 1.00 46.40 N ATOM 617 CA GLU A 85 70.376 8.831 71.687 1.00 49.44 C ATOM 618 C GLU A 85 70.913 9.017 70.261 1.00 49.27 C ATOM 619 O GLU A 85 71.722 8.224 69.808 1.00 51.58 O ATOM 620 CB GLU A 85 69.268 7.771 71.612 1.00 51.57 C ATOM 621 CG GLU A 85 68.801 7.191 72.927 1.00 53.20 C ATOM 622 CD GLU A 85 67.577 7.910 73.429 1.00 52.54 C ATOM 623 OE1 GLU A 85 66.427 7.424 73.218 1.00 54.28 O ATOM 624 OE2 GLU A 85 67.789 8.994 73.989 1.00 51.94 O ATOM 625 H GLU A 85 68.936 10.277 72.496 1.00 0.00 H ATOM 626 N GLU A 86 70.438 10.014 69.532 1.00 47.00 N ATOM 627 CA GLU A 86 70.906 10.230 68.167 1.00 47.06 C ATOM 628 C GLU A 86 72.117 11.140 68.111 1.00 45.97 C ATOM 629 O GLU A 86 72.915 11.027 67.191 1.00 47.60 O ATOM 630 CB GLU A 86 69.807 10.828 67.311 1.00 46.04 C ATOM 631 CG GLU A 86 68.529 10.011 67.302 1.00 46.78 C ATOM 632 CD GLU A 86 67.398 10.741 66.616 1.00 45.55 C ATOM 633 OE1 GLU A 86 67.472 11.969 66.399 1.00 44.20 O ATOM 634 OE2 GLU A 86 66.419 10.078 66.299 1.00 47.15 O ATOM 635 H GLU A 86 69.723 10.651 69.937 1.00 0.00 H ATOM 636 N GLY A 87 72.235 12.060 69.059 1.00 43.86 N ATOM 637 CA GLY A 87 73.329 13.026 69.061 1.00 43.03 C ATOM 638 C GLY A 87 73.274 14.024 67.921 1.00 41.55 C ATOM 639 O GLY A 87 74.305 14.499 67.458 1.00 42.48 O ATOM 640 H GLY A 87 71.529 12.094 69.822 1.00 0.00 H ATOM 641 N VAL A 88 72.068 14.350 67.478 1.00 39.63 N ATOM 642 CA VAL A 88 71.868 15.315 66.425 1.00 37.84 C ATOM 643 C VAL A 88 70.917 16.387 66.929 1.00 35.31 C ATOM 644 O VAL A 88 69.915 16.075 67.575 1.00 34.70 O ATOM 645 CB VAL A 88 71.219 14.654 65.211 1.00 38.99 C ATOM 646 CG1 VAL A 88 71.005 15.712 64.119 1.00 38.10 C ATOM 647 CG2 VAL A 88 72.053 13.459 64.744 1.00 41.46 C ATOM 648 H VAL A 88 71.237 13.894 67.905 1.00 0.00 H ATOM 649 N SER A 89 71.220 17.641 66.612 1.00 33.33 N ATOM 650 CA SER A 89 70.406 18.727 67.046 1.00 31.38 C ATOM 651 C SER A 89 69.146 18.809 66.232 1.00 30.66 C ATOM 652 O SER A 89 69.105 18.366 65.074 1.00 31.37 O ATOM 653 CB SER A 89 71.148 20.048 66.965 1.00 30.85 C ATOM 654 OG SER A 89 71.404 20.442 65.632 1.00 30.91 O ATOM 655 HG SER A 89 71.957 19.753 65.186 1.00 0.00 H ATOM 656 H SER A 89 72.065 17.833 66.038 1.00 0.00 H ATOM 657 N ALA A 90 68.124 19.413 66.832 1.00 28.75 N ATOM 658 CA ALA A 90 66.914 19.751 66.111 1.00 28.48 C ATOM 659 C ALA A 90 67.168 20.615 64.862 1.00 28.01 C ATOM 660 O ALA A 90 66.545 20.409 63.816 1.00 28.34 O ATOM 661 CB ALA A 90 65.939 20.441 67.037 1.00 27.83 C ATOM 662 H ALA A 90 68.195 19.648 67.843 1.00 0.00 H ATOM 663 N ALA A 91 68.069 21.573 65.002 1.00 27.09 N ATOM 664 CA ALA A 91 68.401 22.506 63.950 1.00 27.03 C ATOM 665 C ALA A 91 68.896 21.709 62.736 1.00 28.34 C ATOM 666 O ALA A 91 68.399 21.895 61.640 1.00 28.75 O ATOM 667 CB ALA A 91 69.469 23.477 64.431 1.00 26.42 C ATOM 668 H ALA A 91 68.562 21.659 65.913 1.00 0.00 H ATOM 669 N GLU A 92 69.789 20.757 62.966 1.00 29.25 N ATOM 670 CA GLU A 92 70.310 19.951 61.907 1.00 31.03 C ATOM 671 C GLU A 92 69.220 19.153 61.201 1.00 32.50 C ATOM 672 O GLU A 92 69.249 19.023 59.975 1.00 33.26 O ATOM 673 CB GLU A 92 71.392 19.023 62.428 1.00 32.41 C ATOM 674 CG GLU A 92 72.066 18.207 61.344 1.00 34.03 C ATOM 675 CD GLU A 92 73.285 17.444 61.823 1.00 35.65 C ATOM 676 OE1 GLU A 92 74.095 17.955 62.632 1.00 34.87 O ATOM 677 OE2 GLU A 92 73.455 16.307 61.351 1.00 37.98 O ATOM 678 H GLU A 92 70.118 20.593 63.939 1.00 0.00 H ATOM 679 N VAL A 93 68.270 18.624 61.968 1.00 32.58 N ATOM 680 CA VAL A 93 67.155 17.879 61.402 1.00 34.35 C ATOM 681 C VAL A 93 66.346 18.778 60.470 1.00 33.87 C ATOM 682 O VAL A 93 66.051 18.407 59.349 1.00 34.60 O ATOM 683 CB VAL A 93 66.221 17.310 62.499 1.00 34.53 C ATOM 684 CG1 VAL A 93 64.933 16.768 61.904 1.00 36.20 C ATOM 685 CG2 VAL A 93 66.934 16.202 63.256 1.00 35.63 C ATOM 686 H VAL A 93 68.326 18.746 62.999 1.00 0.00 H ATOM 687 N ILE A 94 66.013 19.954 60.963 1.00 32.54 N ATOM 688 CA ILE A 94 65.269 20.941 60.186 1.00 33.14 C ATOM 689 C ILE A 94 65.988 21.300 58.874 1.00 33.73 C ATOM 690 O ILE A 94 65.359 21.394 57.836 1.00 34.48 O ATOM 691 CB ILE A 94 65.000 22.186 61.047 1.00 31.49 C ATOM 692 CG1 ILE A 94 63.976 21.832 62.132 1.00 32.43 C ATOM 693 CG2 ILE A 94 64.478 23.367 60.226 1.00 31.00 C ATOM 694 CD1 ILE A 94 64.050 22.749 63.338 1.00 31.33 C ATOM 695 H ILE A 94 66.289 20.187 61.938 1.00 0.00 H ATOM 696 N MET A 95 67.303 21.468 58.942 1.00 33.71 N ATOM 697 CA MET A 95 68.101 21.885 57.778 1.00 35.13 C ATOM 698 C MET A 95 68.425 20.758 56.770 1.00 36.89 C ATOM 699 O MET A 95 68.867 21.054 55.657 1.00 37.13 O ATOM 700 CB MET A 95 69.408 22.522 58.256 1.00 34.73 C ATOM 701 CG MET A 95 69.249 23.782 59.128 1.00 34.17 C ATOM 702 SD MET A 95 68.331 25.215 58.449 1.00 36.59 S ATOM 703 CE MET A 95 69.112 25.208 56.837 1.00 36.09 C ATOM 704 H MET A 95 67.785 21.299 59.848 1.00 0.00 H ATOM 705 N THR A 96 68.249 19.491 57.155 1.00 38.39 N ATOM 706 CA THR A 96 68.725 18.354 56.349 1.00 41.53 C ATOM 707 C THR A 96 67.679 17.375 55.861 1.00 44.18 C ATOM 708 O THR A 96 67.963 16.677 54.914 1.00 47.03 O ATOM 709 CB THR A 96 69.840 17.539 57.056 1.00 41.94 C ATOM 710 OG1 THR A 96 69.376 17.053 58.326 1.00 41.50 O ATOM 711 CG2 THR A 96 71.058 18.397 57.252 1.00 40.83 C ATOM 712 HG1 THR A 96 69.123 17.820 58.899 1.00 0.00 H ATOM 713 H THR A 96 67.760 19.301 58.053 1.00 0.00 H ATOM 714 N VAL A 97 66.493 17.344 56.454 1.00 45.19 N ATOM 715 CA VAL A 97 65.450 16.358 56.119 1.00 49.34 C ATOM 716 C VAL A 97 64.343 16.955 55.258 1.00 51.58 C ATOM 717 O VAL A 97 63.859 18.045 55.566 1.00 51.66 O ATOM 718 CB VAL A 97 64.772 15.842 57.422 1.00 48.96 C ATOM 719 CG1 VAL A 97 63.573 14.934 57.120 1.00 51.07 C ATOM 720 CG2 VAL A 97 65.805 15.138 58.290 1.00 48.97 C ATOM 721 H VAL A 97 66.289 18.049 57.191 1.00 0.00 H ATOM 722 N LEU A 98 63.919 16.230 54.220 1.00 56.66 N ATOM 723 CA LEU A 98 62.731 16.595 53.436 1.00 58.92 C ATOM 724 C LEU A 98 61.470 16.125 54.153 1.00 61.61 C ATOM 725 O LEU A 98 60.566 16.922 54.415 1.00 64.21 O ATOM 726 CB LEU A 98 62.765 15.956 52.057 1.00 62.22 C ATOM 727 CG LEU A 98 64.016 16.100 51.187 1.00 62.39 C ATOM 728 CD1 LEU A 98 63.742 15.456 49.835 1.00 65.75 C ATOM 729 CD2 LEU A 98 64.437 17.553 51.037 1.00 60.02 C ATOM 730 H LEU A 98 64.449 15.375 53.957 1.00 0.00 H TER 731 LEU A 98 ATOM 732 N GLY A 117 55.989 25.970 50.244 1.00 68.68 N ATOM 733 CA GLY A 117 56.643 25.410 51.421 1.00 65.21 C ATOM 734 C GLY A 117 57.380 24.145 51.040 1.00 65.04 C ATOM 735 O GLY A 117 57.127 23.079 51.607 1.00 67.13 O ATOM 736 HN3 GLY A 117 55.313 25.278 49.862 1.00 0.00 H ATOM 737 HN2 GLY A 117 56.705 26.191 49.523 1.00 0.00 H ATOM 738 HN1 GLY A 117 55.484 26.839 50.510 1.00 0.00 H ATOM 739 N VAL A 118 58.275 24.266 50.059 1.00 62.40 N ATOM 740 CA VAL A 118 59.149 23.160 49.640 1.00 60.69 C ATOM 741 C VAL A 118 60.251 22.924 50.712 1.00 56.41 C ATOM 742 O VAL A 118 60.721 21.798 50.880 1.00 57.50 O ATOM 743 CB VAL A 118 59.690 23.388 48.191 1.00 62.70 C ATOM 744 CG1 VAL A 118 61.039 24.110 48.171 1.00 60.32 C ATOM 745 CG2 VAL A 118 59.745 22.069 47.423 1.00 65.98 C ATOM 746 H VAL A 118 58.358 25.180 49.570 1.00 0.00 H ATOM 747 N GLY A 119 60.643 23.979 51.434 1.00 50.36 N ATOM 748 CA GLY A 119 61.350 23.835 52.721 1.00 46.58 C ATOM 749 C GLY A 119 62.826 24.205 52.669 1.00 43.04 C ATOM 750 O GLY A 119 63.493 24.027 51.652 1.00 43.47 O ATOM 751 H GLY A 119 60.443 24.935 51.076 1.00 0.00 H ATOM 752 N VAL A 120 63.346 24.692 53.788 1.00 38.93 N ATOM 753 CA VAL A 120 64.718 25.158 53.848 1.00 36.98 C ATOM 754 C VAL A 120 65.762 24.052 53.532 1.00 36.71 C ATOM 755 O VAL A 120 66.862 24.350 53.081 1.00 34.73 O ATOM 756 CB VAL A 120 65.020 25.872 55.198 1.00 35.16 C ATOM 757 CG1 VAL A 120 65.163 24.872 56.341 1.00 35.48 C ATOM 758 CG2 VAL A 120 66.282 26.693 55.101 1.00 34.47 C ATOM 759 H VAL A 120 62.756 24.741 54.643 1.00 0.00 H ATOM 760 N SER A 121 65.425 22.791 53.772 1.00 30.07 N ATOM 761 CA SER A 121 66.356 21.696 53.518 1.00 30.83 C ATOM 762 C SER A 121 66.719 21.585 52.035 1.00 31.84 C ATOM 763 O SER A 121 67.835 21.188 51.697 1.00 31.65 O ATOM 764 CB SER A 121 65.782 20.378 54.025 1.00 32.92 C ATOM 765 OG SER A 121 64.574 20.087 53.352 1.00 33.92 O ATOM 766 HG SER A 121 64.209 19.230 53.687 1.00 0.00 H ATOM 767 H SER A 121 64.479 22.579 54.148 1.00 0.00 H ATOM 768 N VAL A 122 65.763 21.940 51.164 1.00 32.72 N ATOM 769 CA VAL A 122 65.984 22.035 49.710 1.00 32.81 C ATOM 770 C VAL A 122 66.992 23.161 49.382 1.00 31.18 C ATOM 771 O VAL A 122 67.908 22.956 48.605 1.00 30.28 O ATOM 772 CB VAL A 122 64.650 22.261 48.942 1.00 33.90 C ATOM 773 CG1 VAL A 122 64.887 22.658 47.474 1.00 34.65 C ATOM 774 CG2 VAL A 122 63.779 21.021 49.028 1.00 35.92 C ATOM 775 H VAL A 122 64.816 22.160 51.534 1.00 0.00 H ATOM 776 N VAL A 123 66.821 24.314 50.014 1.00 29.81 N ATOM 777 CA VAL A 123 67.741 25.440 49.850 1.00 29.54 C ATOM 778 C VAL A 123 69.180 25.008 50.193 1.00 28.37 C ATOM 779 O VAL A 123 70.145 25.300 49.469 1.00 27.55 O ATOM 780 CB VAL A 123 67.314 26.633 50.738 1.00 29.30 C ATOM 781 CG1 VAL A 123 68.326 27.762 50.637 1.00 28.60 C ATOM 782 CG2 VAL A 123 65.879 27.086 50.364 1.00 31.21 C ATOM 783 H VAL A 123 66.004 24.422 50.649 1.00 0.00 H ATOM 784 N ASN A 124 69.284 24.296 51.309 1.00 27.90 N ATOM 785 CA ASN A 124 70.535 23.779 51.812 1.00 27.52 C ATOM 786 C ASN A 124 71.186 22.834 50.809 1.00 28.95 C ATOM 787 O ASN A 124 72.382 22.975 50.506 1.00 28.89 O ATOM 788 CB ASN A 124 70.284 23.053 53.152 1.00 28.01 C ATOM 789 CG ASN A 124 71.539 22.918 53.993 1.00 27.67 C ATOM 790 OD1 ASN A 124 72.537 23.547 53.711 1.00 27.40 O ATOM 791 ND2 ASN A 124 71.493 22.069 55.006 1.00 28.64 N ATOM 792 HD22 ASN A 124 70.615 21.551 55.211 1.00 0.00 H ATOM 793 HD21 ASN A 124 72.335 21.919 55.598 1.00 0.00 H ATOM 794 H ASN A 124 68.418 24.100 51.850 1.00 0.00 H ATOM 795 N ALA A 125 70.389 21.885 50.288 1.00 30.04 N ATOM 796 CA ALA A 125 70.853 20.935 49.287 1.00 31.46 C ATOM 797 C ALA A 125 71.411 21.610 48.046 1.00 30.96 C ATOM 798 O ALA A 125 72.360 21.109 47.452 1.00 31.09 O ATOM 799 CB ALA A 125 69.741 19.980 48.869 1.00 33.64 C ATOM 800 H ALA A 125 69.403 21.827 50.613 1.00 0.00 H ATOM 801 N LEU A 126 70.828 22.740 47.658 1.00 29.60 N ATOM 802 CA LEU A 126 71.252 23.435 46.454 1.00 29.87 C ATOM 803 C LEU A 126 72.190 24.609 46.701 1.00 28.79 C ATOM 804 O LEU A 126 72.352 25.475 45.825 1.00 28.12 O ATOM 805 CB LEU A 126 70.024 23.870 45.664 1.00 30.28 C ATOM 806 CG LEU A 126 69.062 22.743 45.253 1.00 31.84 C ATOM 807 CD1 LEU A 126 67.867 23.315 44.502 1.00 32.31 C ATOM 808 CD2 LEU A 126 69.749 21.698 44.394 1.00 33.74 C ATOM 809 H LEU A 126 70.053 23.135 48.228 1.00 0.00 H ATOM 810 N SER A 127 72.825 24.627 47.875 1.00 28.28 N ATOM 811 CA SER A 127 73.773 25.684 48.256 1.00 27.72 C ATOM 812 C SER A 127 75.151 25.101 48.391 1.00 29.06 C ATOM 813 O SER A 127 75.330 24.119 49.098 1.00 30.20 O ATOM 814 CB SER A 127 73.376 26.286 49.583 1.00 25.76 C ATOM 815 OG SER A 127 72.201 27.065 49.427 1.00 25.12 O ATOM 816 HG SER A 127 71.467 26.490 49.096 1.00 0.00 H ATOM 817 H SER A 127 72.641 23.858 48.551 1.00 0.00 H ATOM 818 N GLN A 128 76.144 25.717 47.758 1.00 30.41 N ATOM 819 CA GLN A 128 77.539 25.286 47.968 1.00 32.25 C ATOM 820 C GLN A 128 77.906 25.431 49.436 1.00 30.38 C ATOM 821 O GLN A 128 78.659 24.634 49.962 1.00 30.41 O ATOM 822 CB GLN A 128 78.560 25.976 47.043 1.00 35.64 C ATOM 823 CG GLN A 128 78.422 27.480 46.930 1.00 37.06 C ATOM 824 CD GLN A 128 79.650 28.164 46.326 1.00 40.85 C ATOM 825 OE1 GLN A 128 80.766 27.647 46.413 1.00 44.08 O ATOM 826 NE2 GLN A 128 79.441 29.333 45.714 1.00 40.90 N ATOM 827 HE22 GLN A 128 78.481 29.730 45.666 1.00 0.00 H ATOM 828 HE21 GLN A 128 80.238 29.846 45.286 1.00 0.00 H ATOM 829 H GLN A 128 75.937 26.506 47.112 1.00 0.00 H ATOM 830 N LYS A 129 77.322 26.426 50.090 1.00 28.03 N ATOM 831 CA LYS A 129 77.507 26.629 51.510 1.00 27.49 C ATOM 832 C LYS A 129 76.254 27.272 52.119 1.00 24.83 C ATOM 833 O LYS A 129 75.603 28.098 51.494 1.00 24.01 O ATOM 834 CB LYS A 129 78.766 27.484 51.740 1.00 28.50 C ATOM 835 CG LYS A 129 79.170 27.607 53.202 1.00 28.60 C ATOM 836 CD LYS A 129 80.346 28.587 53.428 1.00 30.22 C ATOM 837 CE LYS A 129 81.686 28.028 53.049 1.00 32.80 C ATOM 838 NZ LYS A 129 82.734 29.094 53.002 1.00 34.26 N ATOM 839 HZ1 LYS A 129 82.466 29.811 52.298 1.00 0.00 H ATOM 840 HZ2 LYS A 129 82.816 29.539 53.938 1.00 0.00 H ATOM 841 HZ3 LYS A 129 83.646 28.670 52.737 1.00 0.00 H ATOM 842 H LYS A 129 76.710 27.082 49.564 1.00 0.00 H ATOM 843 N LEU A 130 75.948 26.899 53.352 1.00 24.72 N ATOM 844 CA LEU A 130 74.885 27.525 54.102 1.00 23.30 C ATOM 845 C LEU A 130 75.316 27.638 55.567 1.00 23.22 C ATOM 846 O LEU A 130 75.829 26.683 56.153 1.00 23.88 O ATOM 847 CB LEU A 130 73.575 26.721 53.968 1.00 23.27 C ATOM 848 CG LEU A 130 72.344 27.330 54.677 1.00 23.19 C ATOM 849 CD1 LEU A 130 71.048 26.965 53.972 1.00 23.55 C ATOM 850 CD2 LEU A 130 72.246 26.937 56.153 1.00 22.92 C ATOM 851 H LEU A 130 76.491 26.130 53.795 1.00 0.00 H ATOM 852 N GLU A 131 75.059 28.806 56.139 1.00 22.24 N ATOM 853 CA GLU A 131 75.437 29.138 57.503 1.00 22.13 C ATOM 854 C GLU A 131 74.151 29.434 58.271 1.00 21.42 C ATOM 855 O GLU A 131 73.358 30.282 57.854 1.00 21.22 O ATOM 856 CB GLU A 131 76.337 30.369 57.524 1.00 22.57 C ATOM 857 CG GLU A 131 76.551 30.957 58.914 1.00 22.83 C ATOM 858 CD GLU A 131 77.331 32.256 58.882 1.00 24.60 C ATOM 859 OE1 GLU A 131 77.407 32.879 57.777 1.00 25.74 O ATOM 860 OE2 GLU A 131 77.889 32.635 59.949 1.00 23.54 O ATOM 861 H GLU A 131 74.558 29.526 55.580 1.00 0.00 H ATOM 862 N LEU A 132 73.957 28.701 59.358 1.00 21.55 N ATOM 863 CA LEU A 132 72.867 28.924 60.315 1.00 21.48 C ATOM 864 C LEU A 132 73.429 29.489 61.609 1.00 21.48 C ATOM 865 O LEU A 132 74.312 28.877 62.195 1.00 21.09 O ATOM 866 CB LEU A 132 72.176 27.596 60.639 1.00 22.31 C ATOM 867 CG LEU A 132 71.006 27.564 61.642 1.00 22.52 C ATOM 868 CD1 LEU A 132 69.852 28.492 61.273 1.00 22.26 C ATOM 869 CD2 LEU A 132 70.512 26.143 61.792 1.00 23.50 C ATOM 870 H LEU A 132 74.618 27.920 59.544 1.00 0.00 H ATOM 871 N VAL A 133 72.865 30.614 62.063 1.00 20.96 N ATOM 872 CA VAL A 133 73.171 31.183 63.360 1.00 20.93 C ATOM 873 C VAL A 133 71.868 31.440 64.120 1.00 20.77 C ATOM 874 O VAL A 133 70.992 32.153 63.643 1.00 21.00 O ATOM 875 CB VAL A 133 73.981 32.486 63.230 1.00 21.35 C ATOM 876 CG1 VAL A 133 74.226 33.109 64.611 1.00 22.33 C ATOM 877 CG2 VAL A 133 75.291 32.231 62.531 1.00 21.53 C ATOM 878 H VAL A 133 72.175 31.103 61.457 1.00 0.00 H ATOM 879 N ILE A 134 71.750 30.823 65.287 1.00 20.38 N ATOM 880 CA ILE A 134 70.603 30.941 66.133 1.00 20.86 C ATOM 881 C ILE A 134 70.998 31.660 67.426 1.00 21.25 C ATOM 882 O ILE A 134 71.997 31.325 68.041 1.00 21.05 O ATOM 883 CB ILE A 134 70.066 29.543 66.502 1.00 21.77 C ATOM 884 CG1 ILE A 134 69.640 28.793 65.226 1.00 21.63 C ATOM 885 CG2 ILE A 134 68.906 29.658 67.469 1.00 22.97 C ATOM 886 CD1 ILE A 134 69.505 27.296 65.394 1.00 22.50 C ATOM 887 H ILE A 134 72.535 30.220 65.605 1.00 0.00 H ATOM 888 N GLN A 135 70.195 32.654 67.791 1.00 21.65 N ATOM 889 CA GLN A 135 70.257 33.315 69.086 1.00 22.31 C ATOM 890 C GLN A 135 69.044 32.896 69.923 1.00 23.03 C ATOM 891 O GLN A 135 67.882 33.204 69.598 1.00 22.50 O ATOM 892 CB GLN A 135 70.255 34.819 68.874 1.00 22.80 C ATOM 893 CG GLN A 135 71.500 35.286 68.152 1.00 23.02 C ATOM 894 CD GLN A 135 71.484 36.776 67.912 1.00 24.47 C ATOM 895 OE1 GLN A 135 71.863 37.545 68.768 1.00 27.10 O ATOM 896 NE2 GLN A 135 71.034 37.176 66.750 1.00 25.91 N ATOM 897 HE22 GLN A 135 70.719 36.478 66.046 1.00 0.00 H ATOM 898 HE21 GLN A 135 70.991 38.192 66.531 1.00 0.00 H ATOM 899 H GLN A 135 69.479 32.979 67.110 1.00 0.00 H ATOM 900 N ARG A 136 69.318 32.193 70.999 1.00 23.62 N ATOM 901 CA ARG A 136 68.269 31.580 71.787 1.00 26.13 C ATOM 902 C ARG A 136 68.787 31.239 73.169 1.00 26.91 C ATOM 903 O ARG A 136 69.937 30.790 73.328 1.00 25.35 O ATOM 904 CB ARG A 136 67.775 30.322 71.065 1.00 26.79 C ATOM 905 CG ARG A 136 66.622 29.638 71.703 1.00 29.03 C ATOM 906 CD ARG A 136 66.165 28.448 70.873 1.00 30.36 C ATOM 907 NE ARG A 136 65.285 27.640 71.704 1.00 33.48 N ATOM 908 CZ ARG A 136 64.042 27.955 72.022 1.00 36.34 C ATOM 909 NH1 ARG A 136 63.450 29.047 71.537 1.00 37.17 N ATOM 910 NH2 ARG A 136 63.360 27.150 72.836 1.00 39.45 N ATOM 911 HE ARG A 136 65.664 26.746 72.076 1.00 0.00 H ATOM 912 HH12 ARG A 136 62.470 29.270 71.805 1.00 0.00 H ATOM 913 HH11 ARG A 136 63.968 29.676 70.891 1.00 0.00 H ATOM 914 HH22 ARG A 136 62.380 27.383 73.097 1.00 0.00 H ATOM 915 HH21 ARG A 136 63.807 26.289 73.211 1.00 0.00 H ATOM 916 H ARG A 136 70.309 32.074 71.291 1.00 0.00 H ATOM 917 N GLU A 137 67.927 31.487 74.148 1.00 29.79 N ATOM 918 CA GLU A 137 68.179 31.183 75.565 1.00 33.16 C ATOM 919 C GLU A 137 69.541 31.752 76.033 1.00 30.84 C ATOM 920 O GLU A 137 70.245 31.122 76.788 1.00 30.88 O ATOM 921 CB GLU A 137 68.050 29.655 75.824 1.00 36.84 C ATOM 922 CG GLU A 137 66.630 29.112 75.618 1.00 41.64 C ATOM 923 CD GLU A 137 66.545 27.581 75.574 1.00 46.45 C ATOM 924 OE1 GLU A 137 65.681 27.031 74.848 1.00 52.97 O ATOM 925 OE2 GLU A 137 67.330 26.908 76.277 1.00 51.09 O ATOM 926 H GLU A 137 67.017 31.924 73.898 1.00 0.00 H ATOM 927 N GLY A 138 69.902 32.948 75.564 1.00 28.97 N ATOM 928 CA GLY A 138 71.154 33.602 75.991 1.00 27.64 C ATOM 929 C GLY A 138 72.429 33.178 75.259 1.00 25.86 C ATOM 930 O GLY A 138 73.495 33.707 75.562 1.00 24.64 O ATOM 931 H GLY A 138 69.285 33.431 74.880 1.00 0.00 H ATOM 932 N LYS A 139 72.322 32.301 74.252 1.00 24.54 N ATOM 933 CA LYS A 139 73.496 31.717 73.571 1.00 23.58 C ATOM 934 C LYS A 139 73.386 31.840 72.068 1.00 21.95 C ATOM 935 O LYS A 139 72.283 31.852 71.515 1.00 20.79 O ATOM 936 CB LYS A 139 73.659 30.249 73.906 1.00 25.63 C ATOM 937 CG LYS A 139 73.804 29.919 75.393 1.00 28.20 C ATOM 938 CD LYS A 139 74.312 28.501 75.588 1.00 30.54 C ATOM 939 CE LYS A 139 74.858 28.229 76.987 1.00 33.96 C ATOM 940 NZ LYS A 139 73.735 27.790 77.835 1.00 36.28 N ATOM 941 HZ1 LYS A 139 73.014 28.539 77.869 1.00 0.00 H ATOM 942 HZ2 LYS A 139 73.319 26.924 77.436 1.00 0.00 H ATOM 943 HZ3 LYS A 139 74.082 27.598 78.796 1.00 0.00 H ATOM 944 H LYS A 139 71.372 32.019 73.936 1.00 0.00 H ATOM 945 N ILE A 140 74.528 31.990 71.424 1.00 21.38 N ATOM 946 CA ILE A 140 74.614 31.968 69.957 1.00 21.03 C ATOM 947 C ILE A 140 75.016 30.548 69.560 1.00 21.78 C ATOM 948 O ILE A 140 75.985 30.006 70.113 1.00 22.14 O ATOM 949 CB ILE A 140 75.623 32.982 69.389 1.00 20.65 C ATOM 950 CG1 ILE A 140 75.405 34.381 69.984 1.00 21.57 C ATOM 951 CG2 ILE A 140 75.504 33.019 67.879 1.00 20.21 C ATOM 952 CD1 ILE A 140 76.446 35.417 69.599 1.00 22.32 C ATOM 953 H ILE A 140 75.399 32.129 71.975 1.00 0.00 H ATOM 954 N HIS A 141 74.287 29.960 68.602 1.00 21.95 N ATOM 955 CA HIS A 141 74.607 28.636 68.047 1.00 22.77 C ATOM 956 C HIS A 141 74.820 28.756 66.564 1.00 22.11 C ATOM 957 O HIS A 141 74.132 29.543 65.906 1.00 21.61 O ATOM 958 CB HIS A 141 73.507 27.605 68.288 1.00 23.81 C ATOM 959 CG HIS A 141 73.086 27.471 69.716 1.00 25.72 C ATOM 960 ND1 HIS A 141 73.389 26.361 70.483 1.00 27.91 N ATOM 961 CD2 HIS A 141 72.340 28.284 70.495 1.00 25.88 C ATOM 962 CE1 HIS A 141 72.848 26.507 71.678 1.00 28.97 C ATOM 963 NE2 HIS A 141 72.210 27.665 71.711 1.00 27.58 N ATOM 964 H HIS A 141 73.455 30.464 68.233 1.00 0.00 H ATOM 965 N ARG A 142 75.783 27.992 66.040 1.00 22.42 N ATOM 966 CA ARG A 142 76.148 28.067 64.627 1.00 21.96 C ATOM 967 C ARG A 142 76.473 26.712 64.048 1.00 23.01 C ATOM 968 O ARG A 142 77.110 25.896 64.704 1.00 24.03 O ATOM 969 CB ARG A 142 77.365 28.983 64.424 1.00 22.25 C ATOM 970 CG ARG A 142 77.797 29.221 62.972 1.00 21.93 C ATOM 971 CD ARG A 142 78.679 30.461 62.935 1.00 22.29 C ATOM 972 NE ARG A 142 79.221 30.905 61.645 1.00 22.22 N ATOM 973 CZ ARG A 142 80.438 30.622 61.184 1.00 23.81 C ATOM 974 NH1 ARG A 142 81.264 29.798 61.814 1.00 25.34 N ATOM 975 NH2 ARG A 142 80.836 31.149 60.045 1.00 24.36 N ATOM 976 HE ARG A 142 78.605 31.487 61.043 1.00 0.00 H ATOM 977 HH12 ARG A 142 82.206 29.604 61.419 1.00 0.00 H ATOM 978 HH11 ARG A 142 80.969 29.346 62.703 1.00 0.00 H ATOM 979 HH22 ARG A 142 81.784 30.935 59.676 1.00 0.00 H ATOM 980 HH21 ARG A 142 80.202 31.780 59.514 1.00 0.00 H ATOM 981 H ARG A 142 76.288 27.324 66.656 1.00 0.00 H ATOM 982 N GLN A 143 76.057 26.516 62.794 1.00 23.28 N ATOM 983 CA GLN A 143 76.440 25.349 62.009 1.00 24.68 C ATOM 984 C GLN A 143 76.620 25.729 60.556 1.00 24.16 C ATOM 985 O GLN A 143 75.906 26.594 60.033 1.00 22.81 O ATOM 986 CB GLN A 143 75.357 24.249 62.169 1.00 25.52 C ATOM 987 CG GLN A 143 75.732 22.890 61.600 1.00 27.31 C ATOM 988 CD GLN A 143 74.782 21.774 62.032 1.00 28.09 C ATOM 989 OE1 GLN A 143 73.569 21.968 62.091 1.00 27.83 O ATOM 990 NE2 GLN A 143 75.330 20.611 62.348 1.00 29.90 N ATOM 991 HE22 GLN A 143 76.361 20.488 62.285 1.00 0.00 H ATOM 992 HE21 GLN A 143 74.730 19.821 62.660 1.00 0.00 H ATOM 993 H GLN A 143 75.434 27.226 62.359 1.00 0.00 H ATOM 994 N ILE A 144 77.576 25.071 59.910 1.00 25.41 N ATOM 995 CA ILE A 144 77.894 25.290 58.527 1.00 26.36 C ATOM 996 C ILE A 144 77.580 24.016 57.760 1.00 26.89 C ATOM 997 O ILE A 144 77.936 22.933 58.179 1.00 28.07 O ATOM 998 CB ILE A 144 79.406 25.613 58.345 1.00 28.19 C ATOM 999 CG1 ILE A 144 79.814 26.853 59.141 1.00 28.35 C ATOM 1000 CG2 ILE A 144 79.792 25.754 56.869 1.00 29.00 C ATOM 1001 CD1 ILE A 144 78.948 28.074 58.916 1.00 27.70 C ATOM 1002 H ILE A 144 78.124 24.359 60.434 1.00 0.00 H ATOM 1003 N TYR A 145 76.947 24.161 56.610 1.00 27.10 N ATOM 1004 CA TYR A 145 76.732 23.053 55.693 1.00 28.36 C ATOM 1005 C TYR A 145 77.380 23.356 54.334 1.00 28.61 C ATOM 1006 O TYR A 145 77.509 24.525 53.925 1.00 26.59 O ATOM 1007 CB TYR A 145 75.240 22.761 55.506 1.00 29.07 C ATOM 1008 CG TYR A 145 74.435 22.757 56.753 1.00 29.86 C ATOM 1009 CD1 TYR A 145 74.067 23.952 57.339 1.00 29.71 C ATOM 1010 CD2 TYR A 145 74.041 21.563 57.384 1.00 32.48 C ATOM 1011 CE1 TYR A 145 73.343 23.992 58.495 1.00 30.02 C ATOM 1012 CE2 TYR A 145 73.305 21.598 58.571 1.00 32.71 C ATOM 1013 CZ TYR A 145 72.958 22.828 59.105 1.00 32.11 C ATOM 1014 OH TYR A 145 72.227 22.959 60.271 1.00 34.61 O ATOM 1015 HH TYR A 145 72.719 22.533 61.017 1.00 0.00 H ATOM 1016 H TYR A 145 76.589 25.102 56.351 1.00 0.00 H ATOM 1017 N GLU A 146 77.796 22.295 53.657 1.00 29.95 N ATOM 1018 CA GLU A 146 78.195 22.385 52.239 1.00 32.10 C ATOM 1019 C GLU A 146 77.418 21.380 51.437 1.00 32.08 C ATOM 1020 O GLU A 146 77.444 20.190 51.750 1.00 32.69 O ATOM 1021 CB GLU A 146 79.688 22.167 52.071 1.00 35.01 C ATOM 1022 CG GLU A 146 80.499 23.313 52.645 1.00 35.67 C ATOM 1023 CD GLU A 146 81.998 23.132 52.485 1.00 39.06 C ATOM 1024 OE1 GLU A 146 82.454 22.786 51.393 1.00 42.13 O ATOM 1025 OE2 GLU A 146 82.732 23.364 53.453 1.00 42.13 O ATOM 1026 H GLU A 146 77.842 21.374 54.138 1.00 0.00 H ATOM 1027 N HIS A 147 76.682 21.867 50.447 1.00 31.92 N ATOM 1028 CA HIS A 147 75.763 21.040 49.656 1.00 33.53 C ATOM 1029 C HIS A 147 74.832 20.214 50.568 1.00 33.87 C ATOM 1030 O HIS A 147 74.568 19.038 50.306 1.00 35.53 O ATOM 1031 CB HIS A 147 76.539 20.154 48.678 1.00 36.55 C ATOM 1032 CG HIS A 147 77.350 20.920 47.674 1.00 37.89 C ATOM 1033 ND1 HIS A 147 76.783 21.580 46.604 1.00 37.93 N ATOM 1034 CD2 HIS A 147 78.685 21.120 47.575 1.00 39.46 C ATOM 1035 CE1 HIS A 147 77.737 22.156 45.894 1.00 39.43 C ATOM 1036 NE2 HIS A 147 78.898 21.898 46.466 1.00 39.92 N ATOM 1037 H HIS A 147 76.759 22.879 50.221 1.00 0.00 H ATOM 1038 N GLY A 148 74.355 20.841 51.646 1.00 31.97 N ATOM 1039 CA GLY A 148 73.464 20.184 52.588 1.00 32.18 C ATOM 1040 C GLY A 148 74.090 19.335 53.681 1.00 32.98 C ATOM 1041 O GLY A 148 73.384 18.915 54.609 1.00 33.00 O ATOM 1042 H GLY A 148 74.629 21.830 51.817 1.00 0.00 H ATOM 1043 N VAL A 149 75.397 19.096 53.593 1.00 33.31 N ATOM 1044 CA VAL A 149 76.103 18.180 54.492 1.00 34.46 C ATOM 1045 C VAL A 149 76.706 19.041 55.591 1.00 33.06 C ATOM 1046 O VAL A 149 77.480 19.947 55.307 1.00 31.97 O ATOM 1047 CB VAL A 149 77.226 17.377 53.771 1.00 36.85 C ATOM 1048 CG1 VAL A 149 77.874 16.366 54.713 1.00 38.98 C ATOM 1049 CG2 VAL A 149 76.676 16.642 52.548 1.00 38.18 C ATOM 1050 H VAL A 149 75.941 19.582 52.852 1.00 0.00 H ATOM 1051 N PRO A 150 76.339 18.773 56.845 1.00 33.13 N ATOM 1052 CA PRO A 150 76.877 19.547 57.945 1.00 32.16 C ATOM 1053 C PRO A 150 78.366 19.305 58.096 1.00 33.99 C ATOM 1054 O PRO A 150 78.833 18.183 57.941 1.00 36.82 O ATOM 1055 CB PRO A 150 76.122 19.023 59.161 1.00 32.37 C ATOM 1056 CG PRO A 150 75.704 17.671 58.802 1.00 34.71 C ATOM 1057 CD PRO A 150 75.607 17.582 57.307 1.00 34.74 C ATOM 1058 N GLN A 151 79.106 20.352 58.403 1.00 33.58 N ATOM 1059 CA GLN A 151 80.560 20.256 58.458 1.00 35.66 C ATOM 1060 C GLN A 151 81.046 19.939 59.843 1.00 35.64 C ATOM 1061 O GLN A 151 82.091 19.345 59.987 1.00 36.40 O ATOM 1062 CB GLN A 151 81.191 21.532 57.888 1.00 35.95 C ATOM 1063 CG GLN A 151 80.843 21.706 56.413 1.00 36.60 C ATOM 1064 CD GLN A 151 81.269 20.509 55.575 1.00 40.17 C ATOM 1065 OE1 GLN A 151 82.460 20.247 55.449 1.00 44.35 O ATOM 1066 NE2 GLN A 151 80.302 19.755 55.020 1.00 40.13 N ATOM 1067 HE22 GLN A 151 79.303 20.012 55.151 1.00 0.00 H ATOM 1068 HE21 GLN A 151 80.554 18.916 54.460 1.00 0.00 H ATOM 1069 H GLN A 151 78.645 21.261 58.609 1.00 0.00 H ATOM 1070 N ALA A 152 80.267 20.332 60.852 1.00 33.56 N ATOM 1071 CA ALA A 152 80.551 20.014 62.223 1.00 34.41 C ATOM 1072 C ALA A 152 79.227 20.123 62.987 1.00 33.01 C ATOM 1073 O ALA A 152 78.297 20.764 62.504 1.00 31.39 O ATOM 1074 CB ALA A 152 81.558 20.998 62.776 1.00 34.13 C ATOM 1075 H ALA A 152 79.418 20.893 60.636 1.00 0.00 H ATOM 1076 N PRO A 153 79.140 19.531 64.184 1.00 34.38 N ATOM 1077 CA PRO A 153 77.889 19.691 64.954 1.00 33.35 C ATOM 1078 C PRO A 153 77.556 21.149 65.267 1.00 31.34 C ATOM 1079 O PRO A 153 78.458 22.003 65.327 1.00 31.07 O ATOM 1080 CB PRO A 153 78.163 18.891 66.238 1.00 35.35 C ATOM 1081 CG PRO A 153 79.207 17.900 65.848 1.00 37.68 C ATOM 1082 CD PRO A 153 80.065 18.574 64.816 1.00 36.91 C ATOM 1083 N LEU A 154 76.266 21.444 65.444 1.00 30.55 N ATOM 1084 CA LEU A 154 75.835 22.743 65.958 1.00 28.38 C ATOM 1085 C LEU A 154 76.647 23.073 67.210 1.00 29.12 C ATOM 1086 O LEU A 154 76.753 22.263 68.113 1.00 30.76 O ATOM 1087 CB LEU A 154 74.341 22.730 66.297 1.00 28.41 C ATOM 1088 CG LEU A 154 73.695 24.051 66.729 1.00 26.93 C ATOM 1089 CD1 LEU A 154 73.542 25.000 65.563 1.00 25.54 C ATOM 1090 CD2 LEU A 154 72.351 23.820 67.419 1.00 28.00 C ATOM 1091 H LEU A 154 75.547 20.730 65.210 1.00 0.00 H ATOM 1092 N ALA A 155 77.218 24.271 67.252 1.00 27.83 N ATOM 1093 CA ALA A 155 78.133 24.631 68.334 1.00 28.03 C ATOM 1094 C ALA A 155 77.772 25.993 68.905 1.00 26.30 C ATOM 1095 O ALA A 155 77.313 26.871 68.187 1.00 24.64 O ATOM 1096 CB ALA A 155 79.572 24.637 67.797 1.00 29.04 C ATOM 1097 H ALA A 155 77.011 24.964 66.504 1.00 0.00 H ATOM 1098 N VAL A 156 78.035 26.179 70.185 1.00 26.60 N ATOM 1099 CA VAL A 156 77.884 27.493 70.804 1.00 26.44 C ATOM 1100 C VAL A 156 79.061 28.418 70.447 1.00 25.97 C ATOM 1101 O VAL A 156 80.211 28.040 70.609 1.00 27.42 O ATOM 1102 CB VAL A 156 77.719 27.372 72.320 1.00 27.80 C ATOM 1103 CG1 VAL A 156 77.702 28.758 72.972 1.00 27.69 C ATOM 1104 CG2 VAL A 156 76.434 26.570 72.640 1.00 28.07 C ATOM 1105 H VAL A 156 78.355 25.376 70.763 1.00 0.00 H ATOM 1106 N THR A 157 78.757 29.638 70.021 1.00 24.37 N ATOM 1107 CA THR A 157 79.777 30.607 69.593 1.00 25.26 C ATOM 1108 C THR A 157 79.753 31.951 70.306 1.00 25.33 C ATOM 1109 O THR A 157 80.410 32.896 69.864 1.00 25.21 O ATOM 1110 CB THR A 157 79.610 30.905 68.098 1.00 24.51 C ATOM 1111 OG1 THR A 157 78.276 31.364 67.870 1.00 23.15 O ATOM 1112 CG2 THR A 157 79.897 29.647 67.260 1.00 25.34 C ATOM 1113 HG1 THR A 157 78.156 31.560 66.907 1.00 0.00 H ATOM 1114 H THR A 157 77.757 29.920 69.989 1.00 0.00 H ATOM 1115 N GLY A 158 78.984 32.058 71.383 1.00 25.31 N ATOM 1116 CA GLY A 158 78.915 33.308 72.141 1.00 25.80 C ATOM 1117 C GLY A 158 77.647 33.393 72.977 1.00 25.85 C ATOM 1118 O GLY A 158 76.824 32.451 73.030 1.00 25.68 O ATOM 1119 H GLY A 158 78.421 31.240 71.693 1.00 0.00 H ATOM 1120 N GLU A 159 77.499 34.526 73.627 1.00 26.16 N ATOM 1121 CA GLU A 159 76.311 34.836 74.385 1.00 26.92 C ATOM 1122 C GLU A 159 75.632 36.041 73.763 1.00 26.20 C ATOM 1123 O GLU A 159 76.248 36.801 73.039 1.00 25.29 O ATOM 1124 CB GLU A 159 76.658 35.092 75.854 1.00 28.48 C ATOM 1125 CG GLU A 159 77.417 33.933 76.474 1.00 29.86 C ATOM 1126 CD GLU A 159 78.923 34.014 76.255 1.00 30.97 C ATOM 1127 OE1 GLU A 159 79.521 35.087 76.520 1.00 31.87 O ATOM 1128 OE2 GLU A 159 79.516 32.985 75.843 1.00 32.11 O ATOM 1129 H GLU A 159 78.268 35.226 73.594 1.00 0.00 H ATOM 1130 N THR A 160 74.351 36.194 74.047 1.00 25.74 N ATOM 1131 CA THR A 160 73.560 37.223 73.420 1.00 26.26 C ATOM 1132 C THR A 160 72.352 37.553 74.306 1.00 27.82 C ATOM 1133 O THR A 160 71.858 36.705 75.042 1.00 27.66 O ATOM 1134 CB THR A 160 73.100 36.760 72.015 1.00 25.30 C ATOM 1135 OG1 THR A 160 72.277 37.756 71.416 1.00 25.56 O ATOM 1136 CG2 THR A 160 72.320 35.471 72.104 1.00 25.60 C ATOM 1137 HG1 THR A 160 71.989 37.449 70.520 1.00 0.00 H ATOM 1138 H THR A 160 73.904 35.558 74.738 1.00 0.00 H ATOM 1139 N GLU A 161 71.903 38.794 74.212 1.00 29.20 N ATOM 1140 CA GLU A 161 70.666 39.250 74.847 1.00 31.61 C ATOM 1141 C GLU A 161 69.472 39.234 73.869 1.00 31.60 C ATOM 1142 O GLU A 161 68.379 39.665 74.226 1.00 33.89 O ATOM 1143 CB GLU A 161 70.892 40.657 75.393 1.00 34.67 C ATOM 1144 CG GLU A 161 72.004 40.688 76.454 1.00 36.54 C ATOM 1145 CD GLU A 161 72.340 42.098 76.925 1.00 40.07 C ATOM 1146 OE1 GLU A 161 71.453 42.978 76.800 1.00 42.35 O ATOM 1147 OE2 GLU A 161 73.482 42.314 77.433 1.00 41.23 O ATOM 1148 H GLU A 161 72.457 39.479 73.659 1.00 0.00 H ATOM 1149 N LYS A 162 69.690 38.753 72.642 1.00 28.74 N ATOM 1150 CA LYS A 162 68.688 38.808 71.585 1.00 28.95 C ATOM 1151 C LYS A 162 68.289 37.401 71.190 1.00 27.23 C ATOM 1152 O LYS A 162 68.880 36.425 71.628 1.00 25.98 O ATOM 1153 CB LYS A 162 69.236 39.581 70.368 1.00 28.78 C ATOM 1154 CG LYS A 162 69.472 41.074 70.695 1.00 30.94 C ATOM 1155 H LYS A 162 70.613 38.321 72.432 1.00 0.00 H ATOM 1156 N THR A 163 67.221 37.313 70.421 1.00 26.73 N ATOM 1157 CA THR A 163 66.753 36.049 69.927 1.00 26.14 C ATOM 1158 C THR A 163 66.520 36.173 68.438 1.00 24.77 C ATOM 1159 O THR A 163 66.175 37.253 67.955 1.00 25.41 O ATOM 1160 CB THR A 163 65.450 35.563 70.605 1.00 28.28 C ATOM 1161 OG1 THR A 163 64.355 36.419 70.235 1.00 29.95 O ATOM 1162 CG2 THR A 163 65.593 35.529 72.113 1.00 29.07 C ATOM 1163 HG1 THR A 163 64.239 36.398 69.252 1.00 0.00 H ATOM 1164 H THR A 163 66.706 38.180 70.167 1.00 0.00 H ATOM 1165 N GLY A 164 66.702 35.064 67.743 1.00 22.70 N ATOM 1166 CA GLY A 164 66.289 34.965 66.341 1.00 23.04 C ATOM 1167 C GLY A 164 67.123 33.998 65.544 1.00 21.61 C ATOM 1168 O GLY A 164 68.002 33.337 66.068 1.00 21.40 O ATOM 1169 H GLY A 164 67.148 34.244 68.201 1.00 0.00 H ATOM 1170 N THR A 165 66.843 33.921 64.261 1.00 21.92 N ATOM 1171 CA THR A 165 67.483 32.961 63.414 1.00 21.99 C ATOM 1172 C THR A 165 68.044 33.727 62.223 1.00 21.50 C ATOM 1173 O THR A 165 67.374 34.617 61.695 1.00 22.43 O ATOM 1174 CB THR A 165 66.456 31.922 62.931 1.00 22.78 C ATOM 1175 OG1 THR A 165 65.861 31.271 64.049 1.00 23.69 O ATOM 1176 CG2 THR A 165 67.066 30.880 62.009 1.00 22.77 C ATOM 1177 HG1 THR A 165 65.405 31.942 64.616 1.00 0.00 H ATOM 1178 H THR A 165 66.142 34.572 63.853 1.00 0.00 H ATOM 1179 N MET A 166 69.247 33.353 61.803 1.00 20.57 N ATOM 1180 CA MET A 166 69.867 33.892 60.589 1.00 21.05 C ATOM 1181 C MET A 166 70.282 32.728 59.703 1.00 21.08 C ATOM 1182 O MET A 166 71.026 31.853 60.144 1.00 21.05 O ATOM 1183 CB MET A 166 71.098 34.735 60.959 1.00 22.18 C ATOM 1184 CG MET A 166 71.631 35.656 59.886 1.00 23.89 C ATOM 1185 SD MET A 166 72.565 34.711 58.666 1.00 26.30 S ATOM 1186 CE MET A 166 74.028 34.232 59.586 1.00 26.60 C ATOM 1187 H MET A 166 69.772 32.648 62.359 1.00 0.00 H ATOM 1188 N VAL A 167 69.812 32.727 58.460 1.00 20.95 N ATOM 1189 CA VAL A 167 70.313 31.830 57.442 1.00 21.14 C ATOM 1190 C VAL A 167 71.014 32.669 56.347 1.00 20.99 C ATOM 1191 O VAL A 167 70.445 33.592 55.797 1.00 21.40 O ATOM 1192 CB VAL A 167 69.192 30.947 56.818 1.00 22.10 C ATOM 1193 CG1 VAL A 167 69.703 30.126 55.641 1.00 22.62 C ATOM 1194 CG2 VAL A 167 68.555 30.007 57.863 1.00 23.17 C ATOM 1195 H VAL A 167 69.056 33.396 58.210 1.00 0.00 H ATOM 1196 N ARG A 168 72.239 32.291 56.041 1.00 19.99 N ATOM 1197 CA ARG A 168 72.978 32.846 54.918 1.00 20.50 C ATOM 1198 C ARG A 168 73.389 31.727 53.996 1.00 20.61 C ATOM 1199 O ARG A 168 73.937 30.725 54.445 1.00 21.01 O ATOM 1200 CB ARG A 168 74.227 33.561 55.452 1.00 20.57 C ATOM 1201 CG ARG A 168 75.041 34.310 54.419 1.00 21.31 C ATOM 1202 CD ARG A 168 76.033 35.251 55.068 1.00 21.72 C ATOM 1203 NE ARG A 168 76.892 35.911 54.098 1.00 23.00 N ATOM 1204 CZ ARG A 168 77.746 36.894 54.391 1.00 23.96 C ATOM 1205 NH1 ARG A 168 77.863 37.363 55.621 1.00 24.19 N ATOM 1206 NH2 ARG A 168 78.474 37.420 53.439 1.00 25.73 N ATOM 1207 HE ARG A 168 76.837 35.596 53.108 1.00 0.00 H ATOM 1208 HH12 ARG A 168 78.536 38.130 55.823 1.00 0.00 H ATOM 1209 HH11 ARG A 168 77.282 36.965 56.387 1.00 0.00 H ATOM 1210 HH22 ARG A 168 79.142 38.186 53.658 1.00 0.00 H ATOM 1211 HH21 ARG A 168 78.384 37.072 52.463 1.00 0.00 H ATOM 1212 H ARG A 168 72.697 31.565 56.628 1.00 0.00 H ATOM 1213 N PHE A 169 73.180 31.883 52.697 1.00 21.47 N ATOM 1214 CA PHE A 169 73.575 30.819 51.784 1.00 22.18 C ATOM 1215 C PHE A 169 74.186 31.341 50.504 1.00 23.36 C ATOM 1216 O PHE A 169 73.854 32.429 50.050 1.00 23.85 O ATOM 1217 CB PHE A 169 72.386 29.873 51.477 1.00 22.85 C ATOM 1218 CG PHE A 169 71.310 30.497 50.674 1.00 23.42 C ATOM 1219 CD1 PHE A 169 70.348 31.280 51.284 1.00 23.69 C ATOM 1220 CD2 PHE A 169 71.278 30.341 49.261 1.00 25.20 C ATOM 1221 CE1 PHE A 169 69.335 31.874 50.523 1.00 24.52 C ATOM 1222 CE2 PHE A 169 70.267 30.915 48.516 1.00 26.09 C ATOM 1223 CZ PHE A 169 69.298 31.697 49.153 1.00 25.64 C ATOM 1224 H PHE A 169 72.740 32.753 52.334 1.00 0.00 H ATOM 1225 N TRP A 170 75.073 30.516 49.958 1.00 23.68 N ATOM 1226 CA TRP A 170 75.782 30.746 48.750 1.00 25.06 C ATOM 1227 C TRP A 170 75.251 29.670 47.783 1.00 25.52 C ATOM 1228 O TRP A 170 75.473 28.473 47.991 1.00 25.54 O ATOM 1229 CB TRP A 170 77.270 30.543 48.990 1.00 25.70 C ATOM 1230 CG TRP A 170 77.907 31.575 49.838 1.00 25.25 C ATOM 1231 CD1 TRP A 170 78.688 32.616 49.403 1.00 26.30 C ATOM 1232 CD2 TRP A 170 77.887 31.662 51.262 1.00 24.00 C ATOM 1233 NE1 TRP A 170 79.115 33.364 50.459 1.00 25.73 N ATOM 1234 CE2 TRP A 170 78.670 32.791 51.618 1.00 24.69 C ATOM 1235 CE3 TRP A 170 77.288 30.906 52.275 1.00 23.52 C ATOM 1236 CZ2 TRP A 170 78.858 33.187 52.946 1.00 24.03 C ATOM 1237 CZ3 TRP A 170 77.464 31.293 53.588 1.00 22.92 C ATOM 1238 CH2 TRP A 170 78.258 32.430 53.915 1.00 23.07 C ATOM 1239 HE1 TRP A 170 79.687 34.230 50.394 1.00 0.00 H ATOM 1240 H TRP A 170 75.264 29.625 50.459 1.00 0.00 H ATOM 1241 N PRO A 171 74.541 30.086 46.733 1.00 26.20 N ATOM 1242 CA PRO A 171 73.894 29.107 45.866 1.00 26.92 C ATOM 1243 C PRO A 171 74.928 28.290 45.069 1.00 28.63 C ATOM 1244 O PRO A 171 76.015 28.785 44.772 1.00 28.42 O ATOM 1245 CB PRO A 171 73.036 29.977 44.959 1.00 27.28 C ATOM 1246 CG PRO A 171 73.799 31.253 44.858 1.00 28.04 C ATOM 1247 CD PRO A 171 74.337 31.456 46.244 1.00 26.91 C ATOM 1248 N SER A 172 74.574 27.040 44.779 1.00 29.73 N ATOM 1249 CA SER A 172 75.450 26.130 44.058 1.00 32.25 C ATOM 1250 C SER A 172 75.604 26.571 42.620 1.00 34.27 C ATOM 1251 O SER A 172 74.622 26.640 41.875 1.00 34.69 O ATOM 1252 CB SER A 172 74.903 24.696 44.070 1.00 32.60 C ATOM 1253 OG SER A 172 75.656 23.868 43.197 1.00 33.92 O ATOM 1254 HG SER A 172 75.289 22.949 43.218 1.00 0.00 H ATOM 1255 H SER A 172 73.637 26.702 45.079 1.00 0.00 H ATOM 1256 N LEU A 173 76.836 26.800 42.207 1.00 36.77 N ATOM 1257 CA LEU A 173 77.108 27.143 40.810 1.00 40.07 C ATOM 1258 C LEU A 173 77.209 25.908 39.917 1.00 41.23 C ATOM 1259 O LEU A 173 77.438 26.042 38.721 1.00 42.91 O ATOM 1260 CB LEU A 173 78.358 28.006 40.719 1.00 42.77 C ATOM 1261 CG LEU A 173 78.324 29.229 41.640 1.00 43.30 C ATOM 1262 CD1 LEU A 173 79.628 29.999 41.519 1.00 46.24 C ATOM 1263 CD2 LEU A 173 77.113 30.124 41.367 1.00 43.24 C ATOM 1264 H LEU A 173 77.624 26.736 42.883 1.00 0.00 H ATOM 1265 N GLU A 174 77.082 24.709 40.498 1.00 46.87 N ATOM 1266 CA GLU A 174 76.797 23.501 39.720 1.00 49.46 C ATOM 1267 C GLU A 174 75.323 23.392 39.374 1.00 46.72 C ATOM 1268 O GLU A 174 74.980 22.597 38.530 1.00 49.02 O ATOM 1269 CB GLU A 174 77.206 22.217 40.455 1.00 55.15 C ATOM 1270 CG GLU A 174 78.701 21.979 40.560 1.00 59.69 C ATOM 1271 CD GLU A 174 79.267 22.443 41.889 1.00 61.19 C ATOM 1272 OE1 GLU A 174 78.950 23.586 42.295 1.00 58.55 O ATOM 1273 OE2 GLU A 174 80.013 21.660 42.529 1.00 66.83 O ATOM 1274 H GLU A 174 77.189 24.633 41.530 1.00 0.00 H ATOM 1275 N THR A 175 74.451 24.145 40.038 1.00 42.89 N ATOM 1276 CA THR A 175 73.007 24.038 39.837 1.00 41.36 C ATOM 1277 C THR A 175 72.496 25.193 38.981 1.00 38.00 C ATOM 1278 O THR A 175 71.809 24.976 37.998 1.00 37.57 O ATOM 1279 CB THR A 175 72.257 23.983 41.202 1.00 40.98 C ATOM 1280 OG1 THR A 175 72.566 22.749 41.857 1.00 44.50 O ATOM 1281 CG2 THR A 175 70.752 24.069 41.044 1.00 39.78 C ATOM 1282 HG1 THR A 175 72.277 21.993 41.287 1.00 0.00 H ATOM 1283 H THR A 175 74.810 24.837 40.727 1.00 0.00 H ATOM 1284 N PHE A 176 72.823 26.417 39.363 1.00 35.54 N ATOM 1285 CA PHE A 176 72.254 27.588 38.719 1.00 33.36 C ATOM 1286 C PHE A 176 73.160 28.077 37.605 1.00 33.72 C ATOM 1287 O PHE A 176 74.379 28.076 37.751 1.00 34.16 O ATOM 1288 CB PHE A 176 71.958 28.675 39.752 1.00 31.02 C ATOM 1289 CG PHE A 176 71.020 28.213 40.821 1.00 31.17 C ATOM 1290 CD1 PHE A 176 69.655 28.173 40.587 1.00 30.88 C ATOM 1291 CD2 PHE A 176 71.503 27.750 42.038 1.00 32.23 C ATOM 1292 CE1 PHE A 176 68.786 27.695 41.546 1.00 31.67 C ATOM 1293 CE2 PHE A 176 70.641 27.296 43.023 1.00 32.90 C ATOM 1294 CZ PHE A 176 69.277 27.265 42.778 1.00 32.83 C ATOM 1295 H PHE A 176 73.502 26.543 40.141 1.00 0.00 H ATOM 1296 N THR A 177 72.537 28.453 36.481 1.00 33.79 N ATOM 1297 CA THR A 177 73.225 29.004 35.307 1.00 34.25 C ATOM 1298 C THR A 177 72.524 30.282 34.825 1.00 33.06 C ATOM 1299 O THR A 177 71.342 30.494 35.120 1.00 31.98 O ATOM 1300 CB THR A 177 73.277 27.971 34.148 1.00 36.79 C ATOM 1301 OG1 THR A 177 71.952 27.568 33.773 1.00 36.29 O ATOM 1302 CG2 THR A 177 74.047 26.729 34.566 1.00 39.33 C ATOM 1303 HG1 THR A 177 71.501 27.155 34.552 1.00 0.00 H ATOM 1304 H THR A 177 71.503 28.348 36.437 1.00 0.00 H ATOM 1305 N ASN A 178 73.262 31.086 34.046 1.00 33.59 N ATOM 1306 CA ASN A 178 72.816 32.340 33.377 1.00 33.45 C ATOM 1307 C ASN A 178 72.537 33.484 34.316 1.00 31.76 C ATOM 1308 O ASN A 178 73.045 34.597 34.114 1.00 31.48 O ATOM 1309 CB ASN A 178 71.578 32.129 32.508 1.00 34.71 C ATOM 1310 CG ASN A 178 71.805 31.112 31.449 1.00 37.35 C ATOM 1311 OD1 ASN A 178 72.800 31.188 30.741 1.00 38.82 O ATOM 1312 ND2 ASN A 178 70.872 30.150 31.306 1.00 38.50 N ATOM 1313 HD22 ASN A 178 70.044 30.131 31.935 1.00 0.00 H ATOM 1314 HD21 ASN A 178 70.980 29.427 30.567 1.00 0.00 H ATOM 1315 H ASN A 178 74.251 30.804 33.893 1.00 0.00 H ATOM 1316 N VAL A 179 71.673 33.227 35.289 1.00 29.66 N ATOM 1317 CA VAL A 179 71.411 34.170 36.346 1.00 28.99 C ATOM 1318 C VAL A 179 71.880 33.478 37.606 1.00 27.83 C ATOM 1319 O VAL A 179 71.213 32.577 38.096 1.00 28.23 O ATOM 1320 CB VAL A 179 69.925 34.565 36.445 1.00 28.91 C ATOM 1321 CG1 VAL A 179 69.719 35.496 37.614 1.00 29.24 C ATOM 1322 CG2 VAL A 179 69.433 35.201 35.156 1.00 30.99 C ATOM 1323 H VAL A 179 71.169 32.317 35.289 1.00 0.00 H ATOM 1324 N THR A 180 73.068 33.862 38.072 1.00 27.67 N ATOM 1325 CA THR A 180 73.693 33.290 39.275 1.00 27.37 C ATOM 1326 C THR A 180 73.855 34.329 40.343 1.00 26.45 C ATOM 1327 O THR A 180 74.388 34.042 41.428 1.00 27.59 O ATOM 1328 CB THR A 180 75.084 32.631 38.967 1.00 29.27 C ATOM 1329 OG1 THR A 180 76.012 33.600 38.494 1.00 29.76 O ATOM 1330 CG2 THR A 180 74.960 31.571 37.926 1.00 30.36 C ATOM 1331 HG1 THR A 180 76.879 33.161 38.307 1.00 0.00 H ATOM 1332 H THR A 180 73.581 34.606 37.558 1.00 0.00 H ATOM 1333 N GLU A 181 73.383 35.539 40.074 1.00 25.49 N ATOM 1334 CA GLU A 181 73.410 36.577 41.064 1.00 25.52 C ATOM 1335 C GLU A 181 71.990 37.004 41.381 1.00 25.33 C ATOM 1336 O GLU A 181 71.113 37.069 40.503 1.00 25.37 O ATOM 1337 CB GLU A 181 74.239 37.782 40.599 1.00 26.04 C ATOM 1338 CG GLU A 181 75.707 37.462 40.354 1.00 26.68 C ATOM 1339 CD GLU A 181 76.472 38.664 39.799 1.00 28.36 C ATOM 1340 OE1 GLU A 181 76.698 38.664 38.560 1.00 28.59 O ATOM 1341 OE2 GLU A 181 76.832 39.598 40.581 1.00 28.74 O ATOM 1342 H GLU A 181 72.988 35.738 39.133 1.00 0.00 H ATOM 1343 N PHE A 182 71.805 37.360 42.649 1.00 25.29 N ATOM 1344 CA PHE A 182 70.548 37.906 43.122 1.00 26.17 C ATOM 1345 C PHE A 182 70.272 39.304 42.547 1.00 27.94 C ATOM 1346 O PHE A 182 71.161 40.166 42.490 1.00 28.59 O ATOM 1347 CB PHE A 182 70.526 37.895 44.662 1.00 26.18 C ATOM 1348 CG PHE A 182 70.675 36.511 45.230 1.00 26.10 C ATOM 1349 CD1 PHE A 182 69.647 35.568 45.076 1.00 26.02 C ATOM 1350 CD2 PHE A 182 71.860 36.093 45.817 1.00 26.53 C ATOM 1351 CE1 PHE A 182 69.788 34.272 45.566 1.00 25.49 C ATOM 1352 CE2 PHE A 182 71.996 34.799 46.318 1.00 26.91 C ATOM 1353 CZ PHE A 182 70.957 33.888 46.178 1.00 26.36 C ATOM 1354 H PHE A 182 72.588 37.243 43.324 1.00 0.00 H ATOM 1355 N GLU A 183 69.010 39.525 42.179 1.00 28.27 N ATOM 1356 CA GLU A 183 68.534 40.697 41.478 1.00 30.46 C ATOM 1357 C GLU A 183 67.584 41.404 42.459 1.00 30.87 C ATOM 1358 O GLU A 183 66.586 40.827 42.916 1.00 30.90 O ATOM 1359 CB GLU A 183 67.868 40.278 40.171 1.00 32.20 C ATOM 1360 CG GLU A 183 68.823 39.443 39.307 1.00 31.99 C ATOM 1361 CD GLU A 183 68.318 39.141 37.923 1.00 35.14 C ATOM 1362 OE1 GLU A 183 69.165 38.991 37.002 1.00 36.42 O ATOM 1363 OE2 GLU A 183 67.096 39.087 37.728 1.00 37.87 O ATOM 1364 H GLU A 183 68.309 38.794 42.416 1.00 0.00 H ATOM 1365 N TYR A 184 67.939 42.626 42.825 1.00 31.51 N ATOM 1366 CA TYR A 184 67.276 43.377 43.879 1.00 32.19 C ATOM 1367 C TYR A 184 65.774 43.520 43.610 1.00 33.81 C ATOM 1368 O TYR A 184 64.993 43.362 44.507 1.00 32.73 O ATOM 1369 CB TYR A 184 67.899 44.776 44.001 1.00 34.15 C ATOM 1370 CG TYR A 184 67.393 45.601 45.138 1.00 35.62 C ATOM 1371 CD1 TYR A 184 68.012 45.533 46.375 1.00 34.55 C ATOM 1372 CD2 TYR A 184 66.299 46.472 44.998 1.00 38.56 C ATOM 1373 CE1 TYR A 184 67.570 46.281 47.440 1.00 36.47 C ATOM 1374 CE2 TYR A 184 65.843 47.220 46.082 1.00 40.42 C ATOM 1375 CZ TYR A 184 66.496 47.124 47.295 1.00 39.34 C ATOM 1376 OH TYR A 184 66.111 47.832 48.421 1.00 41.42 O ATOM 1377 HH TYR A 184 65.182 47.588 48.662 1.00 0.00 H ATOM 1378 H TYR A 184 68.737 43.074 42.331 1.00 0.00 H ATOM 1379 N GLU A 185 65.382 43.841 42.376 1.00 36.17 N ATOM 1380 CA GLU A 185 63.959 44.152 42.119 1.00 39.76 C ATOM 1381 C GLU A 185 63.061 42.916 42.291 1.00 37.34 C ATOM 1382 O GLU A 185 61.931 43.047 42.773 1.00 38.57 O ATOM 1383 CB GLU A 185 63.713 44.821 40.766 1.00 44.46 C ATOM 1384 CG GLU A 185 64.566 46.046 40.422 1.00 48.73 C ATOM 1385 CD GLU A 185 64.704 47.092 41.531 1.00 52.50 C ATOM 1386 OE1 GLU A 185 63.704 47.400 42.267 1.00 55.14 O ATOM 1387 OE2 GLU A 185 65.844 47.643 41.645 1.00 54.47 O ATOM 1388 H GLU A 185 66.073 43.872 41.599 1.00 0.00 H ATOM 1389 N ILE A 186 63.579 41.732 41.983 1.00 34.26 N ATOM 1390 CA ILE A 186 62.824 40.497 42.215 1.00 33.79 C ATOM 1391 C ILE A 186 62.534 40.282 43.676 1.00 33.11 C ATOM 1392 O ILE A 186 61.397 39.992 44.048 1.00 33.83 O ATOM 1393 CB ILE A 186 63.493 39.246 41.644 1.00 31.89 C ATOM 1394 CG1 ILE A 186 63.543 39.366 40.131 1.00 33.41 C ATOM 1395 CG2 ILE A 186 62.700 37.977 42.013 1.00 31.51 C ATOM 1396 CD1 ILE A 186 64.325 38.274 39.473 1.00 32.02 C ATOM 1397 H ILE A 186 64.533 41.681 41.572 1.00 0.00 H ATOM 1398 N LEU A 187 63.540 40.500 44.516 1.00 28.32 N ATOM 1399 CA LEU A 187 63.326 40.379 45.939 1.00 27.81 C ATOM 1400 C LEU A 187 62.458 41.518 46.445 1.00 27.19 C ATOM 1401 O LEU A 187 61.622 41.305 47.307 1.00 27.48 O ATOM 1402 CB LEU A 187 64.655 40.318 46.707 1.00 27.80 C ATOM 1403 CG LEU A 187 65.578 39.168 46.299 1.00 28.38 C ATOM 1404 CD1 LEU A 187 66.832 39.270 47.136 1.00 28.66 C ATOM 1405 CD2 LEU A 187 64.944 37.794 46.442 1.00 29.59 C ATOM 1406 H LEU A 187 64.479 40.757 44.150 1.00 0.00 H ATOM 1407 N ALA A 188 62.664 42.729 45.941 1.00 26.94 N ATOM 1408 CA ALA A 188 61.906 43.864 46.437 1.00 27.16 C ATOM 1409 C ALA A 188 60.394 43.725 46.175 1.00 28.08 C ATOM 1410 O ALA A 188 59.563 44.047 47.048 1.00 27.05 O ATOM 1411 CB ALA A 188 62.429 45.177 45.858 1.00 27.75 C ATOM 1412 H ALA A 188 63.370 42.865 45.189 1.00 0.00 H ATOM 1413 N LYS A 189 60.042 43.259 44.977 1.00 29.98 N ATOM 1414 CA LYS A 189 58.641 43.091 44.609 1.00 32.00 C ATOM 1415 C LYS A 189 57.950 42.129 45.572 1.00 31.94 C ATOM 1416 O LYS A 189 56.878 42.446 46.098 1.00 31.31 O ATOM 1417 CB LYS A 189 58.499 42.578 43.160 1.00 34.82 C ATOM 1418 CG LYS A 189 57.052 42.446 42.670 1.00 37.66 C ATOM 1419 CD LYS A 189 56.906 41.447 41.529 1.00 40.62 C ATOM 1420 CE LYS A 189 55.471 41.327 41.031 1.00 43.47 C ATOM 1421 NZ LYS A 189 54.552 40.666 42.007 1.00 43.94 N ATOM 1422 HZ1 LYS A 189 54.894 39.704 42.206 1.00 0.00 H ATOM 1423 HZ2 LYS A 189 54.530 41.217 42.889 1.00 0.00 H ATOM 1424 HZ3 LYS A 189 53.595 40.619 41.603 1.00 0.00 H ATOM 1425 H LYS A 189 60.782 43.010 44.290 1.00 0.00 H ATOM 1426 N ARG A 190 58.578 40.975 45.800 1.00 32.13 N ATOM 1427 CA ARG A 190 57.998 39.920 46.594 1.00 32.58 C ATOM 1428 C ARG A 190 58.010 40.217 48.104 1.00 31.24 C ATOM 1429 O ARG A 190 57.043 39.888 48.818 1.00 30.90 O ATOM 1430 CB ARG A 190 58.716 38.605 46.311 1.00 34.80 C ATOM 1431 CG ARG A 190 58.144 37.374 47.029 1.00 37.43 C ATOM 1432 CD ARG A 190 56.651 37.175 46.727 1.00 39.49 C ATOM 1433 NE ARG A 190 56.118 36.003 47.402 1.00 42.02 N ATOM 1434 CZ ARG A 190 54.830 35.801 47.709 1.00 44.38 C ATOM 1435 NH1 ARG A 190 53.877 36.693 47.404 1.00 44.57 N ATOM 1436 NH2 ARG A 190 54.482 34.678 48.325 1.00 46.21 N ATOM 1437 HE ARG A 190 56.794 35.259 47.669 1.00 0.00 H ATOM 1438 HH12 ARG A 190 52.887 36.503 47.658 1.00 0.00 H ATOM 1439 HH11 ARG A 190 54.128 37.575 46.914 1.00 0.00 H ATOM 1440 HH22 ARG A 190 53.486 34.506 48.570 1.00 0.00 H ATOM 1441 HH21 ARG A 190 55.205 33.970 48.563 1.00 0.00 H ATOM 1442 H ARG A 190 59.522 40.830 45.389 1.00 0.00 H ATOM 1443 N LEU A 191 59.096 40.808 48.597 1.00 28.99 N ATOM 1444 CA LEU A 191 59.162 41.189 50.006 1.00 27.85 C ATOM 1445 C LEU A 191 58.135 42.266 50.340 1.00 27.58 C ATOM 1446 O LEU A 191 57.519 42.208 51.399 1.00 26.94 O ATOM 1447 CB LEU A 191 60.579 41.644 50.393 1.00 27.04 C ATOM 1448 CG LEU A 191 61.640 40.519 50.330 1.00 27.26 C ATOM 1449 CD1 LEU A 191 63.012 41.072 50.688 1.00 27.11 C ATOM 1450 CD2 LEU A 191 61.297 39.320 51.207 1.00 28.01 C ATOM 1451 H LEU A 191 59.906 41.000 47.973 1.00 0.00 H ATOM 1452 N ARG A 192 57.966 43.251 49.447 1.00 28.03 N ATOM 1453 CA ARG A 192 56.899 44.240 49.589 1.00 28.47 C ATOM 1454 C ARG A 192 55.541 43.532 49.726 1.00 28.91 C ATOM 1455 O ARG A 192 54.800 43.784 50.678 1.00 28.66 O ATOM 1456 CB ARG A 192 56.855 45.220 48.411 1.00 28.95 C ATOM 1457 CG ARG A 192 55.714 46.226 48.559 1.00 30.07 C ATOM 1458 CD ARG A 192 55.676 47.300 47.484 1.00 31.38 C ATOM 1459 NE ARG A 192 56.774 48.280 47.519 1.00 31.82 N ATOM 1460 CZ ARG A 192 56.825 49.382 48.283 1.00 33.17 C ATOM 1461 NH1 ARG A 192 55.867 49.694 49.170 1.00 33.89 N ATOM 1462 NH2 ARG A 192 57.862 50.188 48.172 1.00 33.89 N ATOM 1463 HE ARG A 192 57.586 48.102 46.894 1.00 0.00 H ATOM 1464 HH12 ARG A 192 55.949 50.559 49.741 1.00 0.00 H ATOM 1465 HH11 ARG A 192 55.043 49.070 49.286 1.00 0.00 H ATOM 1466 HH22 ARG A 192 57.918 51.047 48.756 1.00 0.00 H ATOM 1467 HH21 ARG A 192 58.624 49.965 47.500 1.00 0.00 H ATOM 1468 H ARG A 192 58.610 43.313 48.633 1.00 0.00 H ATOM 1469 N GLU A 193 55.245 42.641 48.787 1.00 29.94 N ATOM 1470 CA GLU A 193 54.038 41.832 48.860 1.00 32.22 C ATOM 1471 C GLU A 193 53.876 41.095 50.190 1.00 31.19 C ATOM 1472 O GLU A 193 52.797 41.093 50.771 1.00 30.89 O ATOM 1473 CB GLU A 193 54.004 40.796 47.758 1.00 34.79 C ATOM 1474 CG GLU A 193 53.753 41.380 46.395 1.00 37.57 C ATOM 1475 CD GLU A 193 53.794 40.335 45.310 1.00 41.11 C ATOM 1476 OE1 GLU A 193 54.254 39.186 45.574 1.00 43.73 O ATOM 1477 OE2 GLU A 193 53.377 40.685 44.185 1.00 44.32 O ATOM 1478 H GLU A 193 55.891 42.519 47.981 1.00 0.00 H ATOM 1479 N LEU A 194 54.938 40.439 50.644 1.00 30.37 N ATOM 1480 CA LEU A 194 54.847 39.665 51.867 1.00 30.89 C ATOM 1481 C LEU A 194 54.514 40.582 53.043 1.00 30.05 C ATOM 1482 O LEU A 194 53.736 40.185 53.921 1.00 30.93 O ATOM 1483 CB LEU A 194 56.119 38.830 52.127 1.00 31.62 C ATOM 1484 CG LEU A 194 56.348 37.640 51.189 1.00 32.43 C ATOM 1485 CD1 LEU A 194 57.790 37.171 51.340 1.00 32.95 C ATOM 1486 CD2 LEU A 194 55.359 36.504 51.446 1.00 34.52 C ATOM 1487 H LEU A 194 55.836 40.481 50.122 1.00 0.00 H ATOM 1488 N SER A 195 55.058 41.799 53.037 1.00 28.62 N ATOM 1489 CA SER A 195 54.783 42.753 54.107 1.00 29.09 C ATOM 1490 C SER A 195 53.321 43.216 54.137 1.00 29.04 C ATOM 1491 O SER A 195 52.781 43.491 55.209 1.00 29.55 O ATOM 1492 CB SER A 195 55.676 43.979 54.011 1.00 28.97 C ATOM 1493 OG SER A 195 55.501 44.769 55.176 1.00 30.23 O ATOM 1494 HG SER A 195 56.080 45.570 55.120 1.00 0.00 H ATOM 1495 H SER A 195 55.689 42.073 52.257 1.00 0.00 H ATOM 1496 N PHE A 196 52.680 43.318 52.972 1.00 28.88 N ATOM 1497 CA PHE A 196 51.266 43.723 52.976 1.00 29.74 C ATOM 1498 C PHE A 196 50.292 42.586 53.199 1.00 30.72 C ATOM 1499 O PHE A 196 49.200 42.811 53.713 1.00 31.85 O ATOM 1500 CB PHE A 196 50.874 44.707 51.848 1.00 30.14 C ATOM 1501 CG PHE A 196 51.037 44.231 50.410 1.00 29.93 C ATOM 1502 CD1 PHE A 196 50.419 43.075 49.925 1.00 30.47 C ATOM 1503 CD2 PHE A 196 51.647 45.081 49.487 1.00 30.15 C ATOM 1504 CE1 PHE A 196 50.505 42.732 48.580 1.00 31.10 C ATOM 1505 CE2 PHE A 196 51.722 44.747 48.130 1.00 30.46 C ATOM 1506 CZ PHE A 196 51.156 43.574 47.682 1.00 31.07 C ATOM 1507 H PHE A 196 53.171 43.115 52.078 1.00 0.00 H ATOM 1508 N LEU A 197 50.715 41.374 52.865 1.00 31.27 N ATOM 1509 CA LEU A 197 49.974 40.173 53.175 1.00 32.84 C ATOM 1510 C LEU A 197 50.070 39.749 54.645 1.00 33.80 C ATOM 1511 O LEU A 197 49.243 38.961 55.091 1.00 34.13 O ATOM 1512 CB LEU A 197 50.456 39.027 52.280 1.00 33.66 C ATOM 1513 CG LEU A 197 50.170 39.290 50.794 1.00 34.28 C ATOM 1514 CD1 LEU A 197 50.855 38.224 49.937 1.00 35.39 C ATOM 1515 CD2 LEU A 197 48.657 39.346 50.498 1.00 35.07 C ATOM 1516 H LEU A 197 51.619 41.284 52.358 1.00 0.00 H ATOM 1517 N ASN A 198 51.083 40.239 55.367 1.00 37.54 N ATOM 1518 CA ASN A 198 51.298 39.912 56.787 1.00 37.94 C ATOM 1519 C ASN A 198 51.471 41.232 57.540 1.00 39.70 C ATOM 1520 O ASN A 198 52.555 41.557 58.019 1.00 38.66 O ATOM 1521 CB ASN A 198 52.555 39.052 56.918 1.00 35.68 C ATOM 1522 CG ASN A 198 52.437 37.733 56.184 1.00 35.46 C ATOM 1523 OD1 ASN A 198 51.820 36.793 56.681 1.00 36.92 O ATOM 1524 ND2 ASN A 198 53.024 37.653 54.999 1.00 34.26 N ATOM 1525 HD22 ASN A 198 53.536 38.473 54.616 1.00 0.00 H ATOM 1526 HD21 ASN A 198 52.973 36.770 54.452 1.00 0.00 H ATOM 1527 H ASN A 198 51.753 40.884 54.902 1.00 0.00 H ATOM 1528 N SER A 199 50.384 41.986 57.630 1.00 42.54 N ATOM 1529 CA SER A 199 50.406 43.378 58.106 1.00 45.48 C ATOM 1530 C SER A 199 50.978 43.414 59.521 1.00 45.37 C ATOM 1531 O SER A 199 50.686 42.544 60.326 1.00 45.49 O ATOM 1532 CB SER A 199 48.975 43.985 58.081 1.00 49.52 C ATOM 1533 OG SER A 199 48.963 45.406 58.136 1.00 52.99 O ATOM 1534 HG SER A 199 49.399 45.706 58.972 1.00 0.00 H ATOM 1535 H SER A 199 49.471 41.573 57.350 1.00 0.00 H ATOM 1536 N GLY A 200 51.829 44.397 59.793 1.00 45.71 N ATOM 1537 CA GLY A 200 52.523 44.489 61.069 1.00 46.30 C ATOM 1538 C GLY A 200 53.964 44.025 61.033 1.00 43.75 C ATOM 1539 O GLY A 200 54.749 44.491 61.855 1.00 46.07 O ATOM 1540 H GLY A 200 52.005 45.124 59.071 1.00 0.00 H ATOM 1541 N VAL A 201 54.325 43.113 60.121 1.00 39.94 N ATOM 1542 CA VAL A 201 55.719 42.668 59.995 1.00 37.66 C ATOM 1543 C VAL A 201 56.563 43.702 59.247 1.00 36.29 C ATOM 1544 O VAL A 201 56.154 44.235 58.232 1.00 37.22 O ATOM 1545 CB VAL A 201 55.859 41.274 59.331 1.00 36.00 C ATOM 1546 CG1 VAL A 201 55.654 41.321 57.831 1.00 35.65 C ATOM 1547 CG2 VAL A 201 57.230 40.682 59.615 1.00 35.21 C ATOM 1548 H VAL A 201 53.603 42.712 59.489 1.00 0.00 H ATOM 1549 N SER A 202 57.743 43.970 59.764 1.00 34.69 N ATOM 1550 CA SER A 202 58.661 44.892 59.160 1.00 33.87 C ATOM 1551 C SER A 202 59.615 44.006 58.349 1.00 31.28 C ATOM 1552 O SER A 202 60.184 43.040 58.889 1.00 30.53 O ATOM 1553 CB SER A 202 59.375 45.703 60.242 1.00 35.62 C ATOM 1554 OG SER A 202 60.520 46.352 59.726 1.00 35.41 O ATOM 1555 HG SER A 202 60.250 46.966 58.998 1.00 0.00 H ATOM 1556 H SER A 202 58.021 43.494 60.646 1.00 0.00 H ATOM 1557 N ILE A 203 59.739 44.289 57.057 1.00 29.44 N ATOM 1558 CA ILE A 203 60.696 43.598 56.229 1.00 27.93 C ATOM 1559 C ILE A 203 61.659 44.612 55.639 1.00 28.23 C ATOM 1560 O ILE A 203 61.238 45.576 54.961 1.00 29.34 O ATOM 1561 CB ILE A 203 60.072 42.772 55.091 1.00 27.16 C ATOM 1562 CG1 ILE A 203 59.085 41.734 55.639 1.00 27.51 C ATOM 1563 CG2 ILE A 203 61.179 42.050 54.333 1.00 26.02 C ATOM 1564 CD1 ILE A 203 58.400 40.890 54.582 1.00 27.48 C ATOM 1565 H ILE A 203 59.135 45.023 56.635 1.00 0.00 H ATOM 1566 N ARG A 204 62.945 44.406 55.915 1.00 27.46 N ATOM 1567 CA ARG A 204 63.985 45.286 55.382 1.00 27.67 C ATOM 1568 C ARG A 204 64.781 44.537 54.340 1.00 25.43 C ATOM 1569 O ARG A 204 65.116 43.372 54.539 1.00 24.17 O ATOM 1570 CB ARG A 204 64.899 45.797 56.491 1.00 29.10 C ATOM 1571 CG ARG A 204 64.222 46.751 57.424 1.00 32.28 C ATOM 1572 CD ARG A 204 65.157 47.170 58.541 1.00 34.42 C ATOM 1573 NE ARG A 204 64.436 48.045 59.450 1.00 38.07 N ATOM 1574 CZ ARG A 204 64.221 49.349 59.256 1.00 40.48 C ATOM 1575 NH1 ARG A 204 64.676 49.985 58.172 1.00 40.36 N ATOM 1576 NH2 ARG A 204 63.520 50.023 60.159 1.00 43.49 N ATOM 1577 HE ARG A 204 64.057 47.622 60.321 1.00 0.00 H ATOM 1578 HH12 ARG A 204 64.492 51.001 58.050 1.00 0.00 H ATOM 1579 HH11 ARG A 204 65.214 49.464 57.451 1.00 0.00 H ATOM 1580 HH22 ARG A 204 63.342 51.039 60.026 1.00 0.00 H ATOM 1581 HH21 ARG A 204 63.149 49.535 60.999 1.00 0.00 H ATOM 1582 H ARG A 204 63.215 43.605 56.521 1.00 0.00 H ATOM 1583 N LEU A 205 65.082 45.214 53.229 1.00 25.26 N ATOM 1584 CA LEU A 205 65.903 44.668 52.172 1.00 24.34 C ATOM 1585 C LEU A 205 67.128 45.556 52.010 1.00 25.22 C ATOM 1586 O LEU A 205 66.988 46.780 51.920 1.00 26.54 O ATOM 1587 CB LEU A 205 65.115 44.587 50.878 1.00 25.11 C ATOM 1588 CG LEU A 205 65.918 44.070 49.663 1.00 25.00 C ATOM 1589 CD1 LEU A 205 66.377 42.644 49.887 1.00 23.87 C ATOM 1590 CD2 LEU A 205 65.090 44.219 48.396 1.00 26.53 C ATOM 1591 H LEU A 205 64.709 46.178 53.119 1.00 0.00 H ATOM 1592 N ARG A 206 68.313 44.943 52.008 1.00 25.04 N ATOM 1593 CA ARG A 206 69.595 45.663 51.960 1.00 25.97 C ATOM 1594 C ARG A 206 70.483 45.044 50.905 1.00 25.41 C ATOM 1595 O ARG A 206 70.638 43.830 50.883 1.00 25.38 O ATOM 1596 CB ARG A 206 70.320 45.580 53.316 1.00 26.73 C ATOM 1597 CG ARG A 206 69.447 45.861 54.529 1.00 27.90 C ATOM 1598 CD ARG A 206 70.206 45.607 55.810 1.00 29.23 C ATOM 1599 NE ARG A 206 69.643 46.343 56.933 1.00 31.92 N ATOM 1600 CZ ARG A 206 70.005 46.166 58.194 1.00 33.59 C ATOM 1601 NH1 ARG A 206 70.929 45.268 58.493 1.00 33.56 N ATOM 1602 NH2 ARG A 206 69.434 46.881 59.152 1.00 36.17 N ATOM 1603 HE ARG A 206 68.910 47.053 56.732 1.00 0.00 H ATOM 1604 HH12 ARG A 206 71.216 45.127 59.483 1.00 0.00 H ATOM 1605 HH11 ARG A 206 71.369 44.703 57.738 1.00 0.00 H ATOM 1606 HH22 ARG A 206 69.717 46.743 60.143 1.00 0.00 H ATOM 1607 HH21 ARG A 206 68.702 47.580 58.913 1.00 0.00 H ATOM 1608 H ARG A 206 68.331 43.904 52.042 1.00 0.00 H ATOM 1609 N ASP A 207 71.085 45.866 50.043 1.00 26.15 N ATOM 1610 CA ASP A 207 72.039 45.369 49.019 1.00 26.37 C ATOM 1611 C ASP A 207 73.447 45.921 49.334 1.00 26.88 C ATOM 1612 O ASP A 207 73.711 47.106 49.118 1.00 27.76 O ATOM 1613 CB ASP A 207 71.586 45.806 47.622 1.00 27.30 C ATOM 1614 CG ASP A 207 72.313 45.056 46.478 1.00 28.10 C ATOM 1615 OD1 ASP A 207 73.485 44.662 46.639 1.00 27.80 O ATOM 1616 OD2 ASP A 207 71.672 44.813 45.411 1.00 28.67 O ATOM 1617 H ASP A 207 70.880 46.885 50.090 1.00 0.00 H ATOM 1618 N LYS A 208 74.354 45.056 49.788 1.00 27.05 N ATOM 1619 CA LYS A 208 75.743 45.459 50.053 1.00 28.41 C ATOM 1620 C LYS A 208 76.529 45.806 48.806 1.00 28.71 C ATOM 1621 O LYS A 208 77.606 46.408 48.911 1.00 29.28 O ATOM 1622 CB LYS A 208 76.503 44.366 50.797 1.00 30.28 C ATOM 1623 CG LYS A 208 75.898 43.936 52.124 1.00 30.61 C ATOM 1624 CD LYS A 208 75.524 45.090 53.033 1.00 33.23 C ATOM 1625 CE LYS A 208 76.739 45.841 53.503 1.00 36.21 C ATOM 1626 NZ LYS A 208 76.374 46.861 54.538 1.00 39.14 N ATOM 1627 HZ1 LYS A 208 75.699 47.540 54.131 1.00 0.00 H ATOM 1628 HZ2 LYS A 208 75.940 46.385 55.354 1.00 0.00 H ATOM 1629 HZ3 LYS A 208 77.231 47.364 54.844 1.00 0.00 H ATOM 1630 H LYS A 208 74.072 44.070 49.959 1.00 0.00 H ATOM 1631 N ARG A 209 76.026 45.449 47.631 1.00 27.32 N ATOM 1632 CA ARG A 209 76.755 45.764 46.412 1.00 28.97 C ATOM 1633 C ARG A 209 76.647 47.245 46.009 1.00 30.91 C ATOM 1634 O ARG A 209 77.483 47.732 45.245 1.00 32.38 O ATOM 1635 CB ARG A 209 76.308 44.863 45.263 1.00 28.60 C ATOM 1636 CG ARG A 209 76.438 43.371 45.569 1.00 27.64 C ATOM 1637 CD ARG A 209 75.788 42.486 44.531 1.00 28.05 C ATOM 1638 NE ARG A 209 74.354 42.771 44.484 1.00 27.66 N ATOM 1639 CZ ARG A 209 73.454 42.062 43.802 1.00 27.94 C ATOM 1640 NH1 ARG A 209 73.796 40.980 43.105 1.00 28.81 N ATOM 1641 NH2 ARG A 209 72.198 42.471 43.827 1.00 27.75 N ATOM 1642 HE ARG A 209 74.010 43.590 45.024 1.00 0.00 H ATOM 1643 HH12 ARG A 209 73.071 40.447 42.583 1.00 0.00 H ATOM 1644 HH11 ARG A 209 74.788 40.668 43.083 1.00 0.00 H ATOM 1645 HH22 ARG A 209 71.469 41.943 43.307 1.00 0.00 H ATOM 1646 HH21 ARG A 209 71.939 43.321 44.367 1.00 0.00 H ATOM 1647 H ARG A 209 75.116 44.947 47.582 1.00 0.00 H ATOM 1648 N ASP A 210 75.629 47.952 46.502 1.00 31.28 N ATOM 1649 CA ASP A 210 75.475 49.372 46.185 1.00 33.74 C ATOM 1650 C ASP A 210 74.851 50.248 47.271 1.00 34.62 C ATOM 1651 O ASP A 210 74.537 51.392 47.003 1.00 36.68 O ATOM 1652 CB ASP A 210 74.676 49.504 44.899 1.00 35.96 C ATOM 1653 CG ASP A 210 73.263 48.977 45.023 1.00 35.60 C ATOM 1654 OD1 ASP A 210 72.895 48.489 46.108 1.00 34.98 O ATOM 1655 OD2 ASP A 210 72.504 49.064 44.023 1.00 37.46 O ATOM 1656 H ASP A 210 74.934 47.487 47.121 1.00 0.00 H ATOM 1657 N GLY A 211 74.682 49.728 48.484 1.00 33.06 N ATOM 1658 CA GLY A 211 74.082 50.489 49.574 1.00 35.06 C ATOM 1659 C GLY A 211 72.586 50.745 49.543 1.00 35.98 C ATOM 1660 O GLY A 211 72.078 51.410 50.419 1.00 37.75 O ATOM 1661 H GLY A 211 74.987 48.749 48.660 1.00 0.00 H ATOM 1662 N LYS A 212 71.886 50.185 48.561 1.00 36.07 N ATOM 1663 CA LYS A 212 70.446 50.354 48.409 1.00 37.68 C ATOM 1664 C LYS A 212 69.749 49.667 49.574 1.00 35.51 C ATOM 1665 O LYS A 212 70.121 48.573 49.965 1.00 30.77 O ATOM 1666 CB LYS A 212 69.984 49.728 47.072 1.00 39.04 C ATOM 1667 CG LYS A 212 68.734 50.292 46.417 1.00 43.28 C ATOM 1668 CD LYS A 212 68.505 49.614 45.050 1.00 44.62 C ATOM 1669 CE LYS A 212 67.880 50.522 44.022 1.00 49.51 C ATOM 1670 NZ LYS A 212 66.408 50.683 44.214 1.00 52.13 N ATOM 1671 HZ1 LYS A 212 65.947 49.754 44.142 1.00 0.00 H ATOM 1672 HZ2 LYS A 212 66.225 51.090 45.153 1.00 0.00 H ATOM 1673 HZ3 LYS A 212 66.031 51.317 43.480 1.00 0.00 H ATOM 1674 H LYS A 212 72.391 49.597 47.867 1.00 0.00 H ATOM 1675 N GLU A 213 68.731 50.314 50.120 1.00 35.97 N ATOM 1676 CA GLU A 213 67.973 49.726 51.211 1.00 36.18 C ATOM 1677 C GLU A 213 66.501 50.114 51.082 1.00 34.55 C ATOM 1678 O GLU A 213 66.195 51.201 50.622 1.00 34.15 O ATOM 1679 CB GLU A 213 68.579 50.166 52.537 1.00 39.31 C ATOM 1680 CG GLU A 213 67.788 49.719 53.754 1.00 42.13 C ATOM 1681 CD GLU A 213 68.605 49.651 55.048 1.00 46.18 C ATOM 1682 OE1 GLU A 213 69.789 50.087 55.051 1.00 51.21 O ATOM 1683 OE2 GLU A 213 68.072 49.116 56.054 1.00 47.67 O ATOM 1684 H GLU A 213 68.471 51.256 49.763 1.00 0.00 H ATOM 1685 N ASP A 214 65.607 49.188 51.413 1.00 32.81 N ATOM 1686 CA ASP A 214 64.169 49.445 51.443 1.00 32.49 C ATOM 1687 C ASP A 214 63.599 48.931 52.755 1.00 30.97 C ATOM 1688 O ASP A 214 64.138 47.984 53.324 1.00 30.07 O ATOM 1689 CB ASP A 214 63.465 48.763 50.260 1.00 32.96 C ATOM 1690 CG ASP A 214 63.413 49.640 49.026 1.00 35.77 C ATOM 1691 OD1 ASP A 214 62.770 50.720 49.100 1.00 37.56 O ATOM 1692 OD2 ASP A 214 64.014 49.258 47.996 1.00 36.19 O ATOM 1693 H ASP A 214 65.946 48.237 51.662 1.00 0.00 H ATOM 1694 N HIS A 215 62.537 49.580 53.227 1.00 30.46 N ATOM 1695 CA HIS A 215 61.785 49.163 54.423 1.00 30.73 C ATOM 1696 C HIS A 215 60.294 48.963 54.035 1.00 30.16 C ATOM 1697 O HIS A 215 59.619 49.933 53.689 1.00 30.97 O ATOM 1698 CB HIS A 215 61.925 50.204 55.544 1.00 32.12 C ATOM 1699 CG HIS A 215 61.254 49.807 56.839 1.00 33.34 C ATOM 1700 ND1 HIS A 215 60.918 50.721 57.816 1.00 35.17 N ATOM 1701 CD2 HIS A 215 60.852 48.600 57.309 1.00 33.23 C ATOM 1702 CE1 HIS A 215 60.346 50.098 58.833 1.00 35.30 C ATOM 1703 NE2 HIS A 215 60.296 48.810 58.552 1.00 34.36 N ATOM 1704 H HIS A 215 62.219 50.432 52.722 1.00 0.00 H ATOM 1705 N PHE A 216 59.823 47.718 54.053 1.00 28.74 N ATOM 1706 CA PHE A 216 58.436 47.385 53.765 1.00 28.69 C ATOM 1707 C PHE A 216 57.669 47.046 55.061 1.00 29.43 C ATOM 1708 O PHE A 216 57.969 46.061 55.718 1.00 28.26 O ATOM 1709 CB PHE A 216 58.374 46.193 52.793 1.00 28.70 C ATOM 1710 CG PHE A 216 59.246 46.354 51.578 1.00 28.23 C ATOM 1711 CD1 PHE A 216 59.048 47.419 50.695 1.00 28.81 C ATOM 1712 CD2 PHE A 216 60.270 45.454 51.309 1.00 28.02 C ATOM 1713 CE1 PHE A 216 59.852 47.571 49.558 1.00 28.70 C ATOM 1714 CE2 PHE A 216 61.078 45.611 50.183 1.00 28.36 C ATOM 1715 CZ PHE A 216 60.867 46.664 49.316 1.00 28.44 C ATOM 1716 H PHE A 216 60.479 46.945 54.284 1.00 0.00 H ATOM 1717 N HIS A 217 56.708 47.892 55.420 1.00 30.05 N ATOM 1718 CA HIS A 217 55.802 47.620 56.542 1.00 31.28 C ATOM 1719 C HIS A 217 54.505 48.358 56.292 1.00 32.28 C ATOM 1720 O HIS A 217 54.510 49.507 55.834 1.00 32.42 O ATOM 1721 CB HIS A 217 56.402 48.015 57.906 1.00 31.61 C ATOM 1722 CG HIS A 217 56.688 49.478 58.049 1.00 31.71 C ATOM 1723 ND1 HIS A 217 57.517 50.155 57.185 1.00 31.59 N ATOM 1724 CD2 HIS A 217 56.267 50.390 58.958 1.00 32.82 C ATOM 1725 CE1 HIS A 217 57.591 51.422 57.549 1.00 32.54 C ATOM 1726 NE2 HIS A 217 56.841 51.594 58.622 1.00 33.28 N ATOM 1727 H HIS A 217 56.594 48.778 54.887 1.00 0.00 H ATOM 1728 N TYR A 218 53.402 47.676 56.584 1.00 33.51 N ATOM 1729 CA TYR A 218 52.060 48.174 56.295 1.00 35.13 C ATOM 1730 C TYR A 218 51.215 48.184 57.570 1.00 37.85 C ATOM 1731 O TYR A 218 51.323 47.287 58.393 1.00 38.06 O ATOM 1732 CB TYR A 218 51.417 47.339 55.188 1.00 34.85 C ATOM 1733 CG TYR A 218 51.931 47.713 53.810 1.00 34.58 C ATOM 1734 CD1 TYR A 218 53.127 47.168 53.323 1.00 33.13 C ATOM 1735 CD2 TYR A 218 51.250 48.635 53.006 1.00 35.42 C ATOM 1736 CE1 TYR A 218 53.616 47.516 52.089 1.00 33.17 C ATOM 1737 CE2 TYR A 218 51.738 48.981 51.756 1.00 35.43 C ATOM 1738 CZ TYR A 218 52.929 48.419 51.310 1.00 34.35 C ATOM 1739 OH TYR A 218 53.441 48.733 50.083 1.00 34.63 O ATOM 1740 HH TYR A 218 53.615 49.707 50.039 1.00 0.00 H ATOM 1741 H TYR A 218 53.499 46.746 57.039 1.00 0.00 H ATOM 1742 N GLU A 219 50.426 49.242 57.712 1.00 41.05 N ATOM 1743 CA GLU A 219 49.464 49.433 58.791 1.00 45.55 C ATOM 1744 C GLU A 219 48.096 49.722 58.193 1.00 45.58 C ATOM 1745 O GLU A 219 47.144 49.071 58.590 1.00 49.98 O ATOM 1746 CB GLU A 219 49.877 50.617 59.663 1.00 48.92 C ATOM 1747 CG GLU A 219 50.633 50.217 60.919 1.00 52.72 C ATOM 1748 CD GLU A 219 51.723 51.203 61.301 1.00 56.13 C ATOM 1749 OE1 GLU A 219 51.476 52.440 61.276 1.00 60.22 O ATOM 1750 OE2 GLU A 219 52.837 50.725 61.621 1.00 58.52 O ATOM 1751 H GLU A 219 50.500 49.994 56.997 1.00 0.00 H TER 1752 GLU A 219 HETATM 1753 O HOH 1 74.566 21.614 43.141 1.00 39.95 O HETATM 1754 O HOH 2 76.767 38.624 71.388 1.00 31.55 O HETATM 1755 O HOH 3 77.502 30.926 45.357 1.00 30.77 O HETATM 1756 O HOH 4 65.489 49.583 55.775 1.00 52.68 O HETATM 1757 O HOH 5 80.775 23.664 48.876 1.00 47.21 O HETATM 1758 O HOH 6 70.628 25.529 35.201 1.00 45.47 O HETATM 1759 O HOH 7 76.881 28.022 37.130 1.00 44.74 O HETATM 1760 O HOH 8 73.617 49.632 41.751 1.00 39.92 O HETATM 1761 O HOH 9 53.005 31.817 71.733 1.00 53.00 O HETATM 1762 O HOH 10 63.561 32.413 72.184 1.00 31.68 O HETATM 1763 O HOH 11 79.217 24.174 64.099 1.00 40.67 O HETATM 1764 O HOH 12 70.462 28.132 73.593 1.00 42.57 O HETATM 1765 O HOH 13 52.820 51.190 49.429 1.00 29.39 O HETATM 1766 O HOH 14 72.700 36.437 63.784 1.00 38.92 O HETATM 1767 O HOH 15 59.373 39.110 42.624 1.00 40.42 O HETATM 1768 O HOH 16 63.705 32.786 64.973 1.00 22.63 O HETATM 1769 O HOH 17 74.293 21.885 45.799 1.00 38.49 O HETATM 1770 O HOH 18 69.404 30.854 37.188 1.00 24.32 O HETATM 1771 O HOH 19 53.727 44.949 57.410 1.00 32.37 O HETATM 1772 O HOH 20 64.435 43.053 66.203 1.00 49.86 O HETATM 1773 O HOH 21 77.617 35.246 60.482 1.00 24.88 O HETATM 1774 O HOH 22 73.535 35.117 77.845 1.00 34.12 O HETATM 1775 O HOH 23 74.781 24.082 70.217 1.00 35.37 O HETATM 1776 O HOH 24 80.633 34.574 67.775 1.00 24.93 O HETATM 1777 O HOH 25 67.579 39.008 66.450 1.00 46.20 O HETATM 1778 O HOH 26 71.987 20.371 40.692 1.00 50.51 O HETATM 1779 O HOH 27 73.847 19.388 65.102 1.00 36.57 O HETATM 1780 O HOH 28 74.766 38.059 46.784 1.00 22.78 O HETATM 1781 O HOH 29 77.827 32.371 36.876 1.00 49.27 O HETATM 1782 O HOH 30 79.277 40.307 39.608 1.00 23.75 O HETATM 1783 O HOH 31 77.654 34.171 40.599 1.00 27.05 O HETATM 1784 O HOH 32 78.035 30.700 75.615 1.00 55.90 O HETATM 1785 O HOH 33 47.852 41.337 56.827 1.00 47.74 O HETATM 1786 O HOH 34 46.732 42.338 54.811 1.00 41.09 O HETATM 1787 O HOH 35 79.054 26.321 43.751 1.00 47.86 O HETATM 1788 O HOH 36 65.366 32.475 74.223 1.00 27.53 O HETATM 1789 O HOH 37 58.378 36.122 71.010 1.00 53.50 O HETATM 1790 O HOH 38 77.797 50.001 43.717 1.00 33.97 O HETATM 1791 O HOH 39 68.735 34.856 73.954 1.00 33.40 O HETATM 1792 O HOH 40 76.700 17.106 62.943 1.00 49.49 O HETATM 1793 O HOH 41 59.101 28.791 60.931 1.00 34.48 O HETATM 1794 O HOH 42 74.202 35.913 31.959 1.00 35.47 O HETATM 1795 O HOH 43 74.964 20.257 68.819 1.00 37.10 O HETATM 1796 O HOH 44 82.410 27.712 68.941 1.00 42.60 O HETATM 1797 O HOH 45 57.159 33.964 48.982 1.00 47.64 O HETATM 1798 O HOH 46 80.125 33.252 43.220 1.00 35.92 O HETATM 1799 O HOH 47 67.247 30.005 38.731 1.00 28.64 O HETATM 1800 O HOH 48 74.722 23.666 51.984 1.00 23.37 O HETATM 1801 O HOH 49 60.747 36.398 69.814 1.00 53.01 O HETATM 1802 O HOH 50 70.630 34.748 64.665 1.00 27.25 O HETATM 1803 O HOH 51 77.635 42.162 54.729 1.00 40.29 O HETATM 1804 O HOH 52 61.755 51.821 51.703 1.00 40.64 O HETATM 1805 O HOH 53 57.061 29.809 72.451 1.00 39.08 O HETATM 1806 O HOH 54 70.176 39.868 56.612 1.00 21.16 O HETATM 1807 O HOH 55 78.883 41.779 51.661 1.00 29.43 O HETATM 1808 O HOH 56 53.069 30.938 69.183 1.00 64.64 O HETATM 1809 O HOH 57 73.040 40.095 69.274 1.00 42.76 O HETATM 1810 O HOH 58 54.986 44.480 45.401 1.00 35.48 O HETATM 1811 O HOH 59 68.212 52.987 49.201 1.00 56.65 O HETATM 1812 O HOH 60 70.223 43.824 41.541 1.00 28.55 O HETATM 1813 O HOH 61 70.379 47.046 44.117 1.00 46.61 O HETATM 1814 O HOH 62 58.722 46.742 46.038 1.00 37.57 O HETATM 1815 O HOH 63 73.200 40.645 72.389 1.00 39.35 O HETATM 1816 O HOH 64 79.374 23.455 61.524 1.00 26.93 O HETATM 1817 O HOH 65 57.960 29.014 63.432 1.00 38.24 O HETATM 1818 O HOH 66 80.911 27.908 64.000 1.00 33.45 O HETATM 1819 O HOH 67 62.195 35.240 71.807 1.00 60.14 O HETATM 1820 O HOH 68 78.940 21.288 69.837 1.00 55.36 O HETATM 1821 O HOH 69 65.747 43.353 63.458 1.00 42.01 O HETATM 1822 O HOH 70 69.880 39.790 65.994 1.00 39.67 O HETATM 1823 O HOH 71 83.630 30.194 59.774 1.00 41.37 O HETATM 1824 O HOH 72 79.181 39.999 55.981 1.00 34.33 O HETATM 1825 O HOH 73 65.795 39.825 69.392 1.00 40.09 O HETATM 1826 O HOH 74 71.716 15.261 59.133 1.00 57.17 O HETATM 1827 O HOH 75 75.185 48.932 52.678 1.00 46.21 O HETATM 1828 O HOH 76 65.545 23.913 35.488 1.00 50.52 O HETATM 1829 O HOH 77 63.208 39.900 69.664 1.00 47.56 O HETATM 1830 O HOH 78 65.183 21.623 71.249 1.00 41.56 O HETATM 1831 O HOH 79 79.165 23.871 71.863 1.00 39.10 O HETATM 1832 O HOH 80 65.784 24.586 71.961 1.00 39.98 O HETATM 1833 O HOH 81 65.553 41.003 62.434 1.00 35.32 O HETATM 1834 O HOH 82 61.406 33.890 41.167 1.00 47.56 O HETATM 1835 O HOH 83 65.972 19.581 37.066 1.00 53.19 O HETATM 1836 O HOH 84 73.976 45.422 42.809 1.00 40.80 O HETATM 1837 O HOH 85 60.791 29.953 73.082 1.00 46.29 O HETATM 1838 O HOH 86 45.367 46.693 57.269 1.00 47.29 O HETATM 1839 O HOH 87 70.679 36.838 78.086 1.00 49.05 O HETATM 1840 O HOH 88 53.906 28.745 67.830 1.00 56.14 O HETATM 1841 O HOH 89 74.296 36.297 66.319 1.00 37.17 O HETATM 1842 O HOH 90 74.543 18.262 67.306 1.00 38.99 O HETATM 1843 O HOH 91 70.987 40.905 68.030 1.00 82.42 O HETATM 1844 O HOH 92 78.957 17.011 61.642 1.00 49.33 O HETATM 1845 O HOH 93 81.835 23.737 60.544 1.00 43.45 O HETATM 1846 O HOH 94 76.899 30.315 34.703 1.00 45.32 O HETATM 1847 O HOH 95 56.352 46.466 44.183 1.00 50.98 O HETATM 1848 O HOH 96 79.470 37.781 71.073 1.00 37.32 O HETATM 1849 O HOH 97 70.322 35.385 31.325 1.00 52.86 O HETATM 1850 O HOH 98 71.054 40.870 59.052 1.00 36.05 O HETATM 1851 O HOH 99 66.336 35.282 75.347 1.00 43.96 O HETATM 1852 O HOH 100 74.106 39.457 64.860 1.00 53.53 O HETATM 1853 O HOH 101 80.160 44.024 51.755 1.00 40.80 O HETATM 1854 O HOH 102 79.698 37.177 68.479 1.00 26.42 O HETATM 1855 O HOH 103 66.400 41.959 67.982 1.00 42.78 O HETATM 1856 O HOH 104 82.538 24.586 58.104 1.00 52.86 O HETATM 1857 O HOH 105 73.632 41.933 64.025 1.00 70.50 O HETATM 1858 CAW CWW A 106 60.762 26.207 62.340 1.00 0.08 C HETATM 1859 CAV CWW A 106 60.801 24.939 62.737 1.00 0.03 C HETATM 1860 BR CWW A 106 60.192 23.434 61.758 1.00 -0.08 BR HETATM 1861 CAU CWW A 106 61.330 24.817 63.939 1.00 0.01 C HETATM 1862 NAT CWW A 106 61.644 26.041 64.312 1.00 -0.20 N HETATM 1863 NAS CWW A 106 61.278 26.921 63.338 1.00 -0.15 N HETATM 1864 CAR CWW A 106 61.514 28.223 63.509 1.00 0.14 C HETATM 1865 CAQ CWW A 106 62.083 28.972 62.460 1.00 0.03 C HETATM 1866 CAP CWW A 106 62.394 30.341 62.638 1.00 0.14 C HETATM 1867 NAY CWW A 106 62.918 31.221 61.763 1.00 -0.20 N HETATM 1868 CAZ CWW A 106 63.549 30.904 60.605 1.00 0.29 C HETATM 1869 OBB CWW A 106 63.695 29.755 60.203 1.00 -0.39 O HETATM 1870 NBA CWW A 106 64.052 31.950 59.922 1.00 -0.27 N HETATM 1871 CBC CWW A 106 64.798 31.827 58.659 1.00 0.03 C HETATM 1872 CBD CWW A 106 65.885 32.905 58.629 1.00 -0.04 C HETATM 1873 H8 CWW A 106 66.453 32.827 57.690 1.00 0.02 H HETATM 1874 H9 CWW A 106 66.565 32.764 59.482 1.00 0.02 H HETATM 1875 H10 CWW A 106 65.418 33.899 58.693 1.00 0.02 H HETATM 1876 H6 CWW A 106 64.114 31.966 57.809 1.00 0.05 H HETATM 1877 H7 CWW A 106 65.261 30.831 58.597 1.00 0.05 H HETATM 1878 H5 CWW A 106 63.910 32.867 60.296 1.00 0.19 H HETATM 1879 H4 CWW A 106 62.834 32.192 61.987 1.00 0.23 H HETATM 1880 NAO CWW A 106 62.144 30.897 63.840 1.00 -0.29 N HETATM 1881 CAN CWW A 106 61.590 30.163 64.899 1.00 0.01 C HETATM 1882 CAM CWW A 106 61.282 28.819 64.778 1.00 0.10 C HETATM 1883 CAK CWW A 106 60.682 28.144 65.890 1.00 0.23 C HETATM 1884 OAL CWW A 106 59.595 27.612 65.714 1.00 -0.38 O HETATM 1885 NAH CWW A 106 61.273 28.223 67.101 1.00 -0.23 N HETATM 1886 CAE CWW A 106 60.764 27.668 68.234 1.00 0.09 C HETATM 1887 CAF CWW A 106 59.395 27.590 68.561 1.00 -0.02 C HETATM 1888 CAA CWW A 106 58.950 27.022 69.763 1.00 -0.05 C HETATM 1889 CAB CWW A 106 59.869 26.541 70.679 1.00 -0.01 C HETATM 1890 NAC CWW A 106 61.247 26.614 70.395 1.00 -0.31 N HETATM 1891 CAD CWW A 106 61.681 27.183 69.168 1.00 0.03 C HETATM 1892 H16 CWW A 106 62.742 27.242 68.953 1.00 0.07 H HETATM 1893 H15 CWW A 106 59.529 26.109 71.613 1.00 0.07 H HETATM 1894 H14 CWW A 106 57.889 26.960 69.974 1.00 0.07 H HETATM 1895 H13 CWW A 106 58.664 27.981 67.862 1.00 0.06 H HETATM 1896 H12 CWW A 106 62.138 28.720 67.169 1.00 0.23 H HETATM 1897 H11 CWW A 106 61.397 30.663 65.841 1.00 0.08 H HETATM 1898 H3 CWW A 106 62.284 28.495 61.508 1.00 0.06 H HETATM 1899 H2 CWW A 106 61.477 23.898 64.504 1.00 0.07 H HETATM 1900 H1 CWW A 106 60.385 26.585 61.391 1.00 0.11 H CONECT 1 2 5 6 7 CONECT 5 1 CONECT 6 1 CONECT 7 1 CONECT 732 733 736 737 738 CONECT 736 732 CONECT 737 732 CONECT 738 732 CONECT 1858 1859 1863 1900 CONECT 1859 1858 1860 1861 CONECT 1860 1859 CONECT 1861 1859 1862 1899 CONECT 1862 1861 1863 CONECT 1863 1858 1862 1864 CONECT 1864 1863 1865 1882 CONECT 1865 1864 1866 1898 CONECT 1866 1865 1867 1880 CONECT 1867 1866 1868 1879 CONECT 1868 1867 1869 1870 CONECT 1869 1868 CONECT 1870 1868 1871 1878 CONECT 1871 1870 1872 1876 1877 CONECT 1872 1871 1873 1874 1875 CONECT 1873 1872 CONECT 1874 1872 CONECT 1875 1872 CONECT 1876 1871 CONECT 1877 1871 CONECT 1878 1870 CONECT 1879 1867 CONECT 1880 1866 1881 CONECT 1881 1880 1882 1897 CONECT 1882 1864 1881 1883 CONECT 1883 1882 1884 1885 CONECT 1884 1883 CONECT 1885 1883 1886 1896 CONECT 1886 1885 1887 1891 CONECT 1887 1886 1888 1895 CONECT 1888 1887 1889 1894 CONECT 1889 1888 1890 1893 CONECT 1890 1889 1891 CONECT 1891 1886 1890 1892 CONECT 1892 1891 CONECT 1893 1889 CONECT 1894 1888 CONECT 1895 1887 CONECT 1896 1885 CONECT 1897 1881 CONECT 1898 1865 CONECT 1899 1861 CONECT 1900 1858 MASTER 0 0 0 0 0 0 0 0 1898 2 51 15 END
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Structure:
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Related entries of code: 6f86
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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PDBbind
219aa, >1AJ6_1|Chain... at 93%
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PDBbind
205aa, >1KZN_1|Chain... at 100%
4duh
RCSB PDB
PDBbind
220aa, >4DUH_1|Chains... at 93%
4zvi
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PDBbind
377aa, >4ZVI_1|Chain... at 100%
5l3j
RCSB PDB
PDBbind
378aa, >5L3J_1|Chain... *
5z4h
RCSB PDB
PDBbind
207aa, >5Z4H_1|Chains... at 100%
5z4o
RCSB PDB
PDBbind
207aa, >5Z4O_1|Chains... at 100%
5z9e
RCSB PDB
PDBbind
207aa, >5Z9E_1|Chains... at 100%
6f96
RCSB PDB
PDBbind
221aa, >6F96_1|Chain... at 93%
6f94
RCSB PDB
PDBbind
221aa, >6F94_1|Chain... at 93%
6f8j
RCSB PDB
PDBbind
221aa, >6F8J_1|Chain... at 93%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6f86
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
DNA gyrase subunit B
Ligand Name
CWW
EC.Number
E.C.5.99.1.3;5.6.2.2
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
IC50=37nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Bioorg.Med.Chem. Vol. 27: pp. 3546-3550
Ligand Properties
Formula
C
1
7
H
1
6
BrN
7
O
2
Molecular Weight
430.259
Exact Mass
429.055
No. of atoms
43
No. of bonds
45
Polar Surface Area
113.83
LOGP Value
0.98 (
Computed with XLOGP3
)
3.36 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 3
Canonical SMILES
CCNC(=O)Nc1ncc(c(c1)n1ncc(c1)Br)C(=O)Nc1cccnc1
InChI String
InChI=1S/C17H16BrN7O2/c1-2-20-17(27)24-15-6-14(25-10-11(18)7-22-25)13(9-21-15)16(26)23-12-4-3-5-19-8-12/h3-10H,2H2,1H3,(H,23,26)(H2,20,21,24,27)
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):
P0AES6
Entrez Gene ID
NCBI Entrez Gene ID:
61752852
948211
ASD
Information of known allosteric effects of PDB entries
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