Browse entries in the PDBbind-CN Database
HEADER 5W0E_COMPLEX COMPND 5W0E_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 114 LYS ILE PHE LYS PRO GLU GLU LEU ARG GLN ALA LEU MET SEQRES 2 A 114 PRO THR LEU GLU ALA LEU TYR ARG GLN ASP PRO GLU SER SEQRES 3 A 114 LEU PRO PHE ARG GLN PRO VAL ASP PRO GLN LEU LEU GLY SEQRES 4 A 114 ILE PRO ASP TYR PHE ASP ILE VAL LYS ASN PRO MET ASP SEQRES 5 A 114 LEU SER THR ILE LYS ARG LYS LEU ASP THR GLY GLN TYR SEQRES 6 A 114 GLN GLU PRO TRP GLN TYR VAL ASP ASP VAL TRP LEU MET SEQRES 7 A 114 PHE ASN ASN ALA TRP LEU TYR ASN ARG LYS THR SER ARG SEQRES 8 A 114 VAL TYR LYS PHE CYS SER LYS LEU ALA GLU VAL PHE GLU SEQRES 9 A 114 GLN GLU ILE ASP PRO VAL MET GLN SER LEU HET UNN A 248 71 ATOM 1 N LYS A1083 -32.678 0.605 -22.043 1.00 60.87 N ATOM 2 CA LYS A1083 -31.321 1.139 -22.080 1.00 58.47 C ATOM 3 C LYS A1083 -30.325 0.091 -21.610 1.00 54.08 C ATOM 4 O LYS A1083 -30.100 -0.073 -20.412 1.00 53.25 O ATOM 5 CB LYS A1083 -31.214 2.384 -21.203 1.00 59.47 C ATOM 6 CG LYS A1083 -30.225 3.417 -21.718 1.00 59.75 C ATOM 7 CD LYS A1083 -30.515 4.785 -21.125 1.00 60.06 C ATOM 8 CE LYS A1083 -32.010 5.086 -21.146 1.00 61.59 C ATOM 9 NZ LYS A1083 -32.595 4.989 -22.515 1.00 63.20 N ATOM 10 HZ1 LYS A1083 -32.122 5.671 -23.142 1.00 0.00 H ATOM 11 HZ2 LYS A1083 -32.457 4.026 -22.882 1.00 0.00 H ATOM 12 HZ3 LYS A1083 -33.612 5.203 -22.472 1.00 0.00 H ATOM 13 HN3 LYS A1083 -32.913 0.327 -21.069 1.00 0.00 H ATOM 14 HN2 LYS A1083 -32.740 -0.225 -22.667 1.00 0.00 H ATOM 15 HN1 LYS A1083 -33.345 1.334 -22.367 1.00 0.00 H ATOM 16 N ILE A1084 -29.733 -0.623 -22.560 1.00 49.89 N ATOM 17 CA ILE A1084 -28.794 -1.697 -22.265 1.00 45.26 C ATOM 18 C ILE A1084 -27.414 -1.265 -22.738 1.00 40.18 C ATOM 19 O ILE A1084 -27.273 -0.666 -23.810 1.00 41.24 O ATOM 20 CB ILE A1084 -29.231 -3.019 -22.924 1.00 47.51 C ATOM 21 CG1 ILE A1084 -30.759 -3.129 -22.938 1.00 49.92 C ATOM 22 CG2 ILE A1084 -28.644 -4.205 -22.178 1.00 47.44 C ATOM 23 CD1 ILE A1084 -31.385 -3.215 -21.553 1.00 50.38 C ATOM 24 H ILE A1084 -29.948 -0.407 -23.554 1.00 0.00 H ATOM 25 N PHE A1085 -26.399 -1.559 -21.934 1.00 35.72 N ATOM 26 CA PHE A1085 -25.028 -1.171 -22.228 1.00 34.28 C ATOM 27 C PHE A1085 -24.211 -2.407 -22.565 1.00 35.49 C ATOM 28 O PHE A1085 -24.198 -3.375 -21.798 1.00 38.48 O ATOM 29 CB PHE A1085 -24.401 -0.464 -21.030 1.00 30.58 C ATOM 30 CG PHE A1085 -25.029 0.857 -20.713 1.00 29.64 C ATOM 31 CD1 PHE A1085 -24.589 2.012 -21.338 1.00 30.60 C ATOM 32 CD2 PHE A1085 -26.058 0.946 -19.790 1.00 31.09 C ATOM 33 CE1 PHE A1085 -25.167 3.239 -21.046 1.00 30.97 C ATOM 34 CE2 PHE A1085 -26.643 2.171 -19.496 1.00 31.88 C ATOM 35 CZ PHE A1085 -26.193 3.316 -20.125 1.00 31.82 C ATOM 36 H PHE A1085 -26.592 -2.088 -21.059 1.00 0.00 H ATOM 37 N LYS A1086 -23.529 -2.367 -23.704 1.00 33.19 N ATOM 38 CA LYS A1086 -22.627 -3.446 -24.057 1.00 30.67 C ATOM 39 C LYS A1086 -21.375 -3.360 -23.189 1.00 26.01 C ATOM 40 O LYS A1086 -20.974 -2.267 -22.772 1.00 22.79 O ATOM 41 CB LYS A1086 -22.239 -3.348 -25.528 1.00 31.59 C ATOM 42 CG LYS A1086 -23.435 -3.375 -26.460 1.00 33.90 C ATOM 43 CD LYS A1086 -23.038 -3.207 -27.911 1.00 37.51 C ATOM 44 CE LYS A1086 -24.215 -3.538 -28.814 1.00 42.53 C ATOM 45 NZ LYS A1086 -23.931 -3.249 -30.245 1.00 45.72 N ATOM 46 HZ1 LYS A1086 -23.714 -2.238 -30.357 1.00 0.00 H ATOM 47 HZ2 LYS A1086 -23.117 -3.816 -30.557 1.00 0.00 H ATOM 48 HZ3 LYS A1086 -24.764 -3.492 -30.818 1.00 0.00 H ATOM 49 H LYS A1086 -23.643 -1.557 -24.346 1.00 0.00 H ATOM 50 N PRO A1087 -20.756 -4.501 -22.875 1.00 23.65 N ATOM 51 CA PRO A1087 -19.555 -4.466 -22.022 1.00 23.43 C ATOM 52 C PRO A1087 -18.454 -3.572 -22.562 1.00 21.01 C ATOM 53 O PRO A1087 -17.795 -2.872 -21.783 1.00 18.83 O ATOM 54 CB PRO A1087 -19.121 -5.941 -21.972 1.00 24.75 C ATOM 55 CG PRO A1087 -20.358 -6.713 -22.281 1.00 26.38 C ATOM 56 CD PRO A1087 -21.151 -5.875 -23.237 1.00 26.16 C ATOM 57 N GLU A1088 -18.247 -3.569 -23.880 1.00 23.32 N ATOM 58 CA GLU A1088 -17.189 -2.754 -24.467 1.00 24.10 C ATOM 59 C GLU A1088 -17.555 -1.278 -24.470 1.00 24.27 C ATOM 60 O GLU A1088 -16.670 -0.421 -24.389 1.00 21.74 O ATOM 61 CB GLU A1088 -16.846 -3.247 -25.878 1.00 27.20 C ATOM 62 CG GLU A1088 -15.673 -2.518 -26.534 1.00 27.10 C ATOM 63 CD GLU A1088 -14.358 -2.693 -25.782 1.00 26.13 C ATOM 64 OE1 GLU A1088 -14.295 -3.483 -24.810 1.00 25.18 O ATOM 65 OE2 GLU A1088 -13.369 -2.029 -26.161 1.00 25.68 O ATOM 66 H GLU A1088 -18.847 -4.154 -24.496 1.00 0.00 H ATOM 67 N GLU A1089 -18.847 -0.970 -24.550 1.00 24.73 N ATOM 68 CA GLU A1089 -19.294 0.412 -24.424 1.00 26.43 C ATOM 69 C GLU A1089 -18.962 0.956 -23.041 1.00 23.23 C ATOM 70 O GLU A1089 -18.427 2.064 -22.900 1.00 22.12 O ATOM 71 CB GLU A1089 -20.797 0.455 -24.698 1.00 31.88 C ATOM 72 CG GLU A1089 -21.506 1.749 -24.372 1.00 36.93 C ATOM 73 CD GLU A1089 -22.995 1.633 -24.635 1.00 41.60 C ATOM 74 OE1 GLU A1089 -23.425 0.551 -25.101 1.00 43.44 O ATOM 75 OE2 GLU A1089 -23.734 2.609 -24.376 1.00 42.96 O ATOM 76 H GLU A1089 -19.546 -1.724 -24.704 1.00 0.00 H ATOM 77 N LEU A1090 -19.238 0.174 -21.998 1.00 20.56 N ATOM 78 CA LEU A1090 -18.886 0.621 -20.657 1.00 20.12 C ATOM 79 C LEU A1090 -17.381 0.698 -20.484 1.00 19.41 C ATOM 80 O LEU A1090 -16.870 1.633 -19.866 1.00 18.67 O ATOM 81 CB LEU A1090 -19.489 -0.300 -19.604 1.00 21.14 C ATOM 82 CG LEU A1090 -21.009 -0.341 -19.574 1.00 21.48 C ATOM 83 CD1 LEU A1090 -21.477 -1.532 -18.756 1.00 22.94 C ATOM 84 CD2 LEU A1090 -21.541 0.960 -19.001 1.00 22.36 C ATOM 85 H LEU A1090 -19.700 -0.747 -22.140 1.00 0.00 H ATOM 86 N ARG A1091 -16.647 -0.276 -21.021 1.00 20.83 N ATOM 87 CA ARG A1091 -15.201 -0.265 -20.844 1.00 18.78 C ATOM 88 C ARG A1091 -14.580 0.961 -21.504 1.00 18.54 C ATOM 89 O ARG A1091 -13.773 1.659 -20.884 1.00 18.90 O ATOM 90 CB ARG A1091 -14.594 -1.562 -21.382 1.00 21.60 C ATOM 91 CG ARG A1091 -13.185 -1.809 -20.894 1.00 22.48 C ATOM 92 CD ARG A1091 -12.633 -3.110 -21.447 1.00 24.56 C ATOM 93 NE ARG A1091 -12.335 -3.010 -22.873 1.00 27.15 N ATOM 94 CZ ARG A1091 -11.209 -2.491 -23.356 1.00 29.05 C ATOM 95 NH1 ARG A1091 -10.284 -2.032 -22.523 1.00 29.92 N ATOM 96 NH2 ARG A1091 -11.005 -2.425 -24.662 1.00 29.23 N ATOM 97 HE ARG A1091 -13.042 -3.364 -23.549 1.00 0.00 H ATOM 98 HH12 ARG A1091 -9.403 -1.626 -22.897 1.00 0.00 H ATOM 99 HH11 ARG A1091 -10.440 -2.078 -21.496 1.00 0.00 H ATOM 100 HH22 ARG A1091 -10.122 -2.018 -25.030 1.00 0.00 H ATOM 101 HH21 ARG A1091 -11.728 -2.780 -25.320 1.00 0.00 H ATOM 102 H ARG A1091 -17.103 -1.038 -21.562 1.00 0.00 H ATOM 103 N GLN A1092 -14.984 1.264 -22.745 1.00 18.63 N ATOM 104 CA GLN A1092 -14.425 2.408 -23.466 1.00 19.36 C ATOM 105 C GLN A1092 -14.762 3.723 -22.778 1.00 20.49 C ATOM 106 O GLN A1092 -13.925 4.632 -22.710 1.00 21.16 O ATOM 107 CB GLN A1092 -14.933 2.427 -24.906 1.00 19.94 C ATOM 108 CG GLN A1092 -14.328 1.361 -25.794 1.00 22.82 C ATOM 109 CD GLN A1092 -12.845 1.571 -26.026 1.00 25.79 C ATOM 110 OE1 GLN A1092 -12.373 2.703 -26.111 1.00 24.75 O ATOM 111 NE2 GLN A1092 -12.100 0.475 -26.130 1.00 26.74 N ATOM 112 HE22 GLN A1092 -12.542 -0.463 -26.052 1.00 0.00 H ATOM 113 HE21 GLN A1092 -11.076 0.556 -26.290 1.00 0.00 H ATOM 114 H GLN A1092 -15.708 0.675 -23.204 1.00 0.00 H ATOM 115 N ALA A1093 -15.987 3.853 -22.275 1.00 19.31 N ATOM 116 CA ALA A1093 -16.370 5.100 -21.625 1.00 18.08 C ATOM 117 C ALA A1093 -15.756 5.211 -20.243 1.00 18.31 C ATOM 118 O ALA A1093 -15.324 6.299 -19.833 1.00 19.55 O ATOM 119 CB ALA A1093 -17.893 5.203 -21.532 1.00 20.19 C ATOM 120 H ALA A1093 -16.667 3.069 -22.345 1.00 0.00 H ATOM 121 N LEU A1094 -15.725 4.113 -19.490 1.00 16.40 N ATOM 122 CA LEU A1094 -15.406 4.234 -18.074 1.00 16.16 C ATOM 123 C LEU A1094 -13.940 3.993 -17.756 1.00 16.37 C ATOM 124 O LEU A1094 -13.425 4.593 -16.807 1.00 16.08 O ATOM 125 CB LEU A1094 -16.289 3.299 -17.228 1.00 15.94 C ATOM 126 CG LEU A1094 -17.790 3.578 -17.341 1.00 18.10 C ATOM 127 CD1 LEU A1094 -18.585 2.474 -16.675 1.00 17.29 C ATOM 128 CD2 LEU A1094 -18.094 4.903 -16.681 1.00 17.24 C ATOM 129 H LEU A1094 -15.926 3.182 -19.907 1.00 0.00 H ATOM 130 N MET A1095 -13.263 3.113 -18.491 1.00 18.48 N ATOM 131 CA MET A1095 -11.850 2.868 -18.207 1.00 19.76 C ATOM 132 C MET A1095 -11.010 4.142 -18.173 1.00 17.62 C ATOM 133 O MET A1095 -10.156 4.257 -17.276 1.00 17.54 O ATOM 134 CB MET A1095 -11.253 1.804 -19.143 1.00 21.82 C ATOM 135 CG MET A1095 -9.852 1.351 -18.730 1.00 23.52 C ATOM 136 SD MET A1095 -9.844 0.412 -17.193 1.00 23.22 S ATOM 137 CE MET A1095 -10.517 -1.163 -17.721 1.00 24.82 C ATOM 138 H MET A1095 -13.737 2.603 -19.263 1.00 0.00 H ATOM 139 N PRO A1096 -11.198 5.120 -19.066 1.00 17.86 N ATOM 140 CA PRO A1096 -10.426 6.363 -18.945 1.00 15.98 C ATOM 141 C PRO A1096 -10.609 7.068 -17.621 1.00 16.30 C ATOM 142 O PRO A1096 -9.655 7.683 -17.131 1.00 17.00 O ATOM 143 CB PRO A1096 -10.943 7.211 -20.111 1.00 17.94 C ATOM 144 CG PRO A1096 -11.353 6.204 -21.154 1.00 19.49 C ATOM 145 CD PRO A1096 -11.917 5.045 -20.350 1.00 17.54 C ATOM 146 N THR A1097 -11.794 6.995 -17.007 1.00 15.23 N ATOM 147 CA THR A1097 -11.960 7.628 -15.708 1.00 15.34 C ATOM 148 C THR A1097 -11.186 6.881 -14.637 1.00 15.37 C ATOM 149 O THR A1097 -10.710 7.502 -13.681 1.00 15.64 O ATOM 150 CB THR A1097 -13.435 7.781 -15.318 1.00 14.46 C ATOM 151 OG1 THR A1097 -14.028 6.506 -15.018 1.00 14.75 O ATOM 152 CG2 THR A1097 -14.223 8.443 -16.421 1.00 16.29 C ATOM 153 HG1 THR A1097 -13.970 5.921 -15.814 1.00 0.00 H ATOM 154 H THR A1097 -12.588 6.492 -17.453 1.00 0.00 H ATOM 155 N LEU A1098 -11.054 5.554 -14.761 1.00 14.30 N ATOM 156 CA LEU A1098 -10.238 4.822 -13.798 1.00 15.55 C ATOM 157 C LEU A1098 -8.762 5.124 -14.013 1.00 16.03 C ATOM 158 O LEU A1098 -8.007 5.277 -13.041 1.00 15.35 O ATOM 159 CB LEU A1098 -10.505 3.319 -13.941 1.00 15.76 C ATOM 160 CG LEU A1098 -10.097 2.489 -12.727 1.00 15.97 C ATOM 161 CD1 LEU A1098 -10.939 2.843 -11.531 1.00 16.07 C ATOM 162 CD2 LEU A1098 -10.222 1.010 -13.041 1.00 17.34 C ATOM 163 H LEU A1098 -11.529 5.050 -15.537 1.00 0.00 H ATOM 164 N GLU A1099 -8.341 5.236 -15.275 1.00 16.81 N ATOM 165 CA GLU A1099 -6.952 5.584 -15.553 1.00 17.66 C ATOM 166 C GLU A1099 -6.600 6.953 -14.989 1.00 17.28 C ATOM 167 O GLU A1099 -5.475 7.155 -14.515 1.00 18.04 O ATOM 168 CB GLU A1099 -6.658 5.495 -17.056 1.00 20.43 C ATOM 169 CG GLU A1099 -6.791 4.074 -17.595 1.00 24.62 C ATOM 170 CD GLU A1099 -6.725 3.990 -19.114 1.00 30.55 C ATOM 171 OE1 GLU A1099 -6.405 2.899 -19.635 1.00 33.82 O ATOM 172 OE2 GLU A1099 -7.000 4.999 -19.799 1.00 32.29 O ATOM 173 H GLU A1099 -9.004 5.075 -16.060 1.00 0.00 H ATOM 174 N ALA A1100 -7.560 7.887 -14.985 1.00 17.08 N ATOM 175 CA ALA A1100 -7.325 9.198 -14.394 1.00 17.74 C ATOM 176 C ALA A1100 -6.971 9.075 -12.921 1.00 15.99 C ATOM 177 O ALA A1100 -6.138 9.833 -12.408 1.00 16.56 O ATOM 178 CB ALA A1100 -8.560 10.079 -14.563 1.00 19.29 C ATOM 179 H ALA A1100 -8.485 7.674 -15.409 1.00 0.00 H ATOM 180 N LEU A1101 -7.593 8.129 -12.223 1.00 13.48 N ATOM 181 CA LEU A1101 -7.236 7.898 -10.826 1.00 13.01 C ATOM 182 C LEU A1101 -5.835 7.312 -10.714 1.00 15.71 C ATOM 183 O LEU A1101 -5.015 7.794 -9.923 1.00 17.76 O ATOM 184 CB LEU A1101 -8.264 6.987 -10.166 1.00 14.69 C ATOM 185 CG LEU A1101 -9.684 7.557 -10.177 1.00 14.51 C ATOM 186 CD1 LEU A1101 -10.574 6.622 -9.374 1.00 14.89 C ATOM 187 CD2 LEU A1101 -9.741 9.008 -9.674 1.00 16.06 C ATOM 188 H LEU A1101 -8.334 7.554 -12.672 1.00 0.00 H ATOM 189 N TYR A1102 -5.537 6.284 -11.518 1.00 15.43 N ATOM 190 CA TYR A1102 -4.209 5.675 -11.480 1.00 16.97 C ATOM 191 C TYR A1102 -3.117 6.697 -11.737 1.00 17.06 C ATOM 192 O TYR A1102 -2.025 6.594 -11.167 1.00 18.47 O ATOM 193 CB TYR A1102 -4.086 4.589 -12.545 1.00 18.17 C ATOM 194 CG TYR A1102 -4.566 3.208 -12.154 1.00 18.23 C ATOM 195 CD1 TYR A1102 -3.757 2.349 -11.432 1.00 19.35 C ATOM 196 CD2 TYR A1102 -5.823 2.749 -12.551 1.00 17.57 C ATOM 197 CE1 TYR A1102 -4.185 1.072 -11.094 1.00 17.81 C ATOM 198 CE2 TYR A1102 -6.254 1.484 -12.216 1.00 16.99 C ATOM 199 CZ TYR A1102 -5.434 0.654 -11.487 1.00 17.62 C ATOM 200 OH TYR A1102 -5.866 -0.606 -11.167 1.00 19.01 O ATOM 201 HH TYR A1102 -5.165 -1.071 -10.645 1.00 0.00 H ATOM 202 H TYR A1102 -6.255 5.916 -12.174 1.00 0.00 H ATOM 203 N ARG A1103 -3.380 7.691 -12.585 1.00 18.83 N ATOM 204 CA ARG A1103 -2.341 8.667 -12.899 1.00 18.05 C ATOM 205 C ARG A1103 -2.008 9.584 -11.731 1.00 17.53 C ATOM 206 O ARG A1103 -1.005 10.304 -11.797 1.00 23.28 O ATOM 207 CB ARG A1103 -2.718 9.501 -14.130 1.00 21.05 C ATOM 208 CG ARG A1103 -2.628 8.742 -15.439 1.00 24.59 C ATOM 209 CD ARG A1103 -2.700 9.711 -16.619 1.00 27.75 C ATOM 210 NE ARG A1103 -3.971 10.429 -16.637 1.00 31.52 N ATOM 211 CZ ARG A1103 -5.038 10.041 -17.329 1.00 30.95 C ATOM 212 NH1 ARG A1103 -4.988 8.937 -18.063 1.00 31.29 N ATOM 213 NH2 ARG A1103 -6.150 10.759 -17.290 1.00 31.06 N ATOM 214 HE ARG A1103 -4.047 11.299 -16.073 1.00 0.00 H ATOM 215 HH12 ARG A1103 -5.823 8.634 -18.604 1.00 0.00 H ATOM 216 HH11 ARG A1103 -4.114 8.375 -18.097 1.00 0.00 H ATOM 217 HH22 ARG A1103 -6.984 10.455 -17.831 1.00 0.00 H ATOM 218 HH21 ARG A1103 -6.189 11.627 -16.718 1.00 0.00 H ATOM 219 H ARG A1103 -4.321 7.771 -13.021 1.00 0.00 H ATOM 220 N GLN A1104 -2.804 9.583 -10.674 1.00 15.91 N ATOM 221 CA GLN A1104 -2.519 10.468 -9.554 1.00 15.10 C ATOM 222 C GLN A1104 -1.430 9.835 -8.701 1.00 15.72 C ATOM 223 O GLN A1104 -1.605 8.729 -8.168 1.00 15.50 O ATOM 224 CB GLN A1104 -3.783 10.702 -8.736 1.00 16.76 C ATOM 225 CG GLN A1104 -4.985 11.174 -9.551 1.00 18.60 C ATOM 226 CD GLN A1104 -4.700 12.361 -10.428 1.00 24.80 C ATOM 227 OE1 GLN A1104 -4.235 13.388 -9.958 1.00 25.29 O ATOM 228 NE2 GLN A1104 -4.982 12.224 -11.727 1.00 25.74 N ATOM 229 HE22 GLN A1104 -5.377 11.330 -12.082 1.00 0.00 H ATOM 230 HE21 GLN A1104 -4.806 13.012 -12.383 1.00 0.00 H ATOM 231 H GLN A1104 -3.630 8.952 -10.644 1.00 0.00 H ATOM 232 N ASP A1105 -0.294 10.519 -8.609 1.00 16.75 N ATOM 233 CA ASP A1105 0.807 10.119 -7.766 1.00 19.27 C ATOM 234 C ASP A1105 1.087 11.278 -6.822 1.00 16.73 C ATOM 235 O ASP A1105 1.191 12.428 -7.274 1.00 19.31 O ATOM 236 CB ASP A1105 2.048 9.818 -8.627 1.00 22.94 C ATOM 237 CG ASP A1105 3.121 9.018 -7.878 1.00 24.72 C ATOM 238 OD1 ASP A1105 3.833 9.583 -7.014 1.00 23.42 O ATOM 239 OD2 ASP A1105 3.262 7.810 -8.167 1.00 27.50 O ATOM 240 H ASP A1105 -0.193 11.387 -9.173 1.00 0.00 H ATOM 241 N PRO A1106 1.229 11.033 -5.526 1.00 15.69 N ATOM 242 CA PRO A1106 1.262 9.713 -4.895 1.00 17.35 C ATOM 243 C PRO A1106 -0.119 9.185 -4.520 1.00 15.14 C ATOM 244 O PRO A1106 -0.233 8.108 -3.944 1.00 16.82 O ATOM 245 CB PRO A1106 2.058 9.982 -3.621 1.00 19.61 C ATOM 246 CG PRO A1106 1.684 11.391 -3.274 1.00 20.23 C ATOM 247 CD PRO A1106 1.595 12.109 -4.593 1.00 16.60 C ATOM 248 N GLU A1107 -1.173 9.930 -4.860 1.00 16.06 N ATOM 249 CA GLU A1107 -2.469 9.700 -4.226 1.00 13.83 C ATOM 250 C GLU A1107 -3.085 8.356 -4.577 1.00 13.27 C ATOM 251 O GLU A1107 -3.838 7.813 -3.772 1.00 14.61 O ATOM 252 CB GLU A1107 -3.432 10.843 -4.545 1.00 12.50 C ATOM 253 CG GLU A1107 -2.952 12.194 -4.008 1.00 14.94 C ATOM 254 CD GLU A1107 -2.200 13.010 -5.030 1.00 15.58 C ATOM 255 OE1 GLU A1107 -1.771 12.463 -6.059 1.00 16.13 O ATOM 256 OE2 GLU A1107 -2.029 14.221 -4.778 1.00 19.45 O ATOM 257 H GLU A1107 -1.071 10.676 -5.578 1.00 0.00 H ATOM 258 N SER A1108 -2.791 7.798 -5.747 1.00 13.24 N ATOM 259 CA SER A1108 -3.407 6.514 -6.061 1.00 13.00 C ATOM 260 C SER A1108 -2.661 5.331 -5.476 1.00 15.07 C ATOM 261 O SER A1108 -3.218 4.224 -5.445 1.00 14.92 O ATOM 262 CB SER A1108 -3.563 6.322 -7.568 1.00 14.31 C ATOM 263 OG SER A1108 -2.320 6.039 -8.148 1.00 16.09 O ATOM 264 HG SER A1108 -1.699 6.791 -7.978 1.00 0.00 H ATOM 265 H SER A1108 -2.143 8.261 -6.416 1.00 0.00 H ATOM 266 N LEU A1109 -1.443 5.533 -4.986 1.00 13.86 N ATOM 267 CA LEU A1109 -0.630 4.395 -4.558 1.00 15.72 C ATOM 268 C LEU A1109 -1.309 3.519 -3.509 1.00 16.34 C ATOM 269 O LEU A1109 -1.247 2.281 -3.650 1.00 16.02 O ATOM 270 CB LEU A1109 0.762 4.861 -4.111 1.00 18.30 C ATOM 271 CG LEU A1109 1.615 5.525 -5.194 1.00 19.48 C ATOM 272 CD1 LEU A1109 2.891 6.084 -4.597 1.00 19.27 C ATOM 273 CD2 LEU A1109 1.908 4.574 -6.343 1.00 22.97 C ATOM 274 H LEU A1109 -1.068 6.500 -4.907 1.00 0.00 H ATOM 275 N PRO A1110 -1.961 4.062 -2.471 1.00 13.98 N ATOM 276 CA PRO A1110 -2.637 3.197 -1.486 1.00 13.39 C ATOM 277 C PRO A1110 -3.880 2.504 -2.013 1.00 13.62 C ATOM 278 O PRO A1110 -4.433 1.652 -1.299 1.00 15.09 O ATOM 279 CB PRO A1110 -3.008 4.167 -0.341 1.00 15.42 C ATOM 280 CG PRO A1110 -2.262 5.423 -0.612 1.00 18.84 C ATOM 281 CD PRO A1110 -2.013 5.483 -2.071 1.00 15.70 C ATOM 282 N PHE A1111 -4.309 2.817 -3.236 1.00 13.71 N ATOM 283 CA PHE A1111 -5.555 2.327 -3.804 1.00 14.09 C ATOM 284 C PHE A1111 -5.352 1.319 -4.924 1.00 16.15 C ATOM 285 O PHE A1111 -6.341 0.789 -5.449 1.00 17.66 O ATOM 286 CB PHE A1111 -6.368 3.505 -4.342 1.00 14.34 C ATOM 287 CG PHE A1111 -6.850 4.424 -3.279 1.00 14.51 C ATOM 288 CD1 PHE A1111 -6.039 5.440 -2.792 1.00 14.51 C ATOM 289 CD2 PHE A1111 -8.116 4.261 -2.741 1.00 15.83 C ATOM 290 CE1 PHE A1111 -6.498 6.276 -1.799 1.00 15.81 C ATOM 291 CE2 PHE A1111 -8.580 5.095 -1.747 1.00 14.67 C ATOM 292 CZ PHE A1111 -7.771 6.103 -1.273 1.00 15.58 C ATOM 293 H PHE A1111 -3.719 3.447 -3.817 1.00 0.00 H ATOM 294 N ARG A1112 -4.109 1.020 -5.297 1.00 15.04 N ATOM 295 CA ARG A1112 -3.874 0.241 -6.507 1.00 16.76 C ATOM 296 C ARG A1112 -4.076 -1.256 -6.318 1.00 16.84 C ATOM 297 O ARG A1112 -4.357 -1.946 -7.304 1.00 18.13 O ATOM 298 CB ARG A1112 -2.490 0.546 -7.066 1.00 22.03 C ATOM 299 CG ARG A1112 -2.421 1.898 -7.753 1.00 22.21 C ATOM 300 CD ARG A1112 -0.998 2.290 -8.028 1.00 23.29 C ATOM 301 NE ARG A1112 -0.923 3.578 -8.701 1.00 23.02 N ATOM 302 CZ ARG A1112 0.156 4.014 -9.342 1.00 23.75 C ATOM 303 NH1 ARG A1112 1.243 3.260 -9.406 1.00 26.87 N ATOM 304 NH2 ARG A1112 0.147 5.211 -9.916 1.00 22.66 N ATOM 305 HE ARG A1112 -1.762 4.192 -8.679 1.00 0.00 H ATOM 306 HH12 ARG A1112 2.086 3.604 -9.909 1.00 0.00 H ATOM 307 HH11 ARG A1112 1.254 2.324 -8.954 1.00 0.00 H ATOM 308 HH22 ARG A1112 0.991 5.553 -10.418 1.00 0.00 H ATOM 309 HH21 ARG A1112 -0.704 5.806 -9.864 1.00 0.00 H ATOM 310 H ARG A1112 -3.304 1.343 -4.724 1.00 0.00 H ATOM 311 N GLN A1113 -3.933 -1.775 -5.107 1.00 15.53 N ATOM 312 CA GLN A1113 -4.115 -3.190 -4.815 1.00 16.10 C ATOM 313 C GLN A1113 -5.031 -3.340 -3.614 1.00 18.71 C ATOM 314 O GLN A1113 -5.219 -2.388 -2.850 1.00 16.90 O ATOM 315 CB GLN A1113 -2.759 -3.855 -4.539 1.00 17.56 C ATOM 316 CG GLN A1113 -1.865 -3.901 -5.758 1.00 21.48 C ATOM 317 CD GLN A1113 -2.343 -4.931 -6.767 1.00 27.67 C ATOM 318 OE1 GLN A1113 -2.769 -6.024 -6.395 1.00 30.48 O ATOM 319 NE2 GLN A1113 -2.289 -4.580 -8.046 1.00 28.52 N ATOM 320 HE22 GLN A1113 -1.921 -3.645 -8.313 1.00 0.00 H ATOM 321 HE21 GLN A1113 -2.615 -5.240 -8.781 1.00 0.00 H ATOM 322 H GLN A1113 -3.678 -1.139 -4.325 1.00 0.00 H ATOM 323 N PRO A1114 -5.639 -4.515 -3.422 1.00 17.14 N ATOM 324 CA PRO A1114 -6.470 -4.711 -2.229 1.00 16.49 C ATOM 325 C PRO A1114 -5.660 -4.473 -0.964 1.00 17.87 C ATOM 326 O PRO A1114 -4.505 -4.900 -0.850 1.00 20.58 O ATOM 327 CB PRO A1114 -6.931 -6.172 -2.343 1.00 17.92 C ATOM 328 CG PRO A1114 -6.862 -6.466 -3.813 1.00 20.07 C ATOM 329 CD PRO A1114 -5.690 -5.674 -4.332 1.00 18.51 C ATOM 330 N VAL A1115 -6.264 -3.758 -0.019 1.00 17.32 N ATOM 331 CA VAL A1115 -5.621 -3.631 1.284 1.00 18.99 C ATOM 332 C VAL A1115 -5.306 -5.014 1.816 1.00 19.67 C ATOM 333 O VAL A1115 -6.170 -5.895 1.848 1.00 20.81 O ATOM 334 CB VAL A1115 -6.510 -2.854 2.263 1.00 18.00 C ATOM 335 CG1 VAL A1115 -5.869 -2.840 3.664 1.00 17.56 C ATOM 336 CG2 VAL A1115 -6.754 -1.448 1.729 1.00 17.26 C ATOM 337 H VAL A1115 -7.178 -3.298 -0.206 1.00 0.00 H ATOM 338 N ASP A1116 -4.057 -5.207 2.235 1.00 17.91 N ATOM 339 CA ASP A1116 -3.577 -6.467 2.795 1.00 21.60 C ATOM 340 C ASP A1116 -3.313 -6.222 4.274 1.00 20.10 C ATOM 341 O ASP A1116 -2.200 -5.824 4.652 1.00 21.01 O ATOM 342 CB ASP A1116 -2.295 -6.893 2.081 1.00 24.94 C ATOM 343 CG ASP A1116 -1.879 -8.311 2.421 1.00 27.19 C ATOM 344 OD1 ASP A1116 -2.229 -8.803 3.515 1.00 28.21 O ATOM 345 OD2 ASP A1116 -1.196 -8.936 1.585 1.00 29.29 O ATOM 346 H ASP A1116 -3.386 -4.416 2.159 1.00 0.00 H ATOM 347 N PRO A1117 -4.292 -6.469 5.151 1.00 21.07 N ATOM 348 CA PRO A1117 -4.123 -6.084 6.562 1.00 20.98 C ATOM 349 C PRO A1117 -2.960 -6.763 7.254 1.00 23.67 C ATOM 350 O PRO A1117 -2.243 -6.109 8.021 1.00 25.38 O ATOM 351 CB PRO A1117 -5.474 -6.460 7.189 1.00 22.70 C ATOM 352 CG PRO A1117 -6.436 -6.414 6.056 1.00 22.47 C ATOM 353 CD PRO A1117 -5.648 -6.987 4.895 1.00 21.05 C ATOM 354 N GLN A1118 -2.746 -8.058 7.014 1.00 25.34 N ATOM 355 CA GLN A1118 -1.639 -8.743 7.674 1.00 27.44 C ATOM 356 C GLN A1118 -0.293 -8.193 7.216 1.00 25.48 C ATOM 357 O GLN A1118 0.597 -7.944 8.039 1.00 28.08 O ATOM 358 CB GLN A1118 -1.724 -10.253 7.436 1.00 32.43 C ATOM 359 CG GLN A1118 -0.514 -11.027 7.927 1.00 39.28 C ATOM 360 CD GLN A1118 -0.694 -12.528 7.823 1.00 45.27 C ATOM 361 OE1 GLN A1118 -0.640 -13.238 8.827 1.00 48.49 O ATOM 362 NE2 GLN A1118 -0.903 -13.023 6.603 1.00 46.45 N ATOM 363 HE22 GLN A1118 -0.941 -12.385 5.782 1.00 0.00 H ATOM 364 HE21 GLN A1118 -1.028 -14.047 6.472 1.00 0.00 H ATOM 365 H GLN A1118 -3.365 -8.577 6.359 1.00 0.00 H ATOM 366 N LEU A1119 -0.122 -8.012 5.906 1.00 24.80 N ATOM 367 CA LEU A1119 1.135 -7.483 5.382 1.00 27.46 C ATOM 368 C LEU A1119 1.401 -6.069 5.891 1.00 25.08 C ATOM 369 O LEU A1119 2.546 -5.719 6.203 1.00 25.21 O ATOM 370 CB LEU A1119 1.109 -7.519 3.851 1.00 32.29 C ATOM 371 CG LEU A1119 2.260 -6.906 3.045 1.00 35.57 C ATOM 372 CD1 LEU A1119 3.586 -7.551 3.398 1.00 37.81 C ATOM 373 CD2 LEU A1119 1.983 -7.041 1.549 1.00 36.63 C ATOM 374 H LEU A1119 -0.893 -8.250 5.249 1.00 0.00 H ATOM 375 N LEU A1120 0.355 -5.250 5.996 1.00 23.50 N ATOM 376 CA LEU A1120 0.514 -3.866 6.410 1.00 24.07 C ATOM 377 C LEU A1120 0.604 -3.699 7.918 1.00 25.03 C ATOM 378 O LEU A1120 0.947 -2.607 8.388 1.00 26.58 O ATOM 379 CB LEU A1120 -0.661 -3.055 5.880 1.00 21.57 C ATOM 380 CG LEU A1120 -0.784 -2.936 4.360 1.00 22.16 C ATOM 381 CD1 LEU A1120 -2.083 -2.253 3.996 1.00 21.65 C ATOM 382 CD2 LEU A1120 0.395 -2.147 3.803 1.00 23.43 C ATOM 383 H LEU A1120 -0.596 -5.609 5.777 1.00 0.00 H ATOM 384 N GLY A1121 0.319 -4.745 8.687 1.00 22.87 N ATOM 385 CA GLY A1121 0.276 -4.586 10.125 1.00 24.14 C ATOM 386 C GLY A1121 -0.924 -3.821 10.641 1.00 21.49 C ATOM 387 O GLY A1121 -0.848 -3.221 11.719 1.00 23.78 O ATOM 388 H GLY A1121 0.128 -5.673 8.258 1.00 0.00 H ATOM 389 N ILE A1122 -2.042 -3.855 9.923 1.00 20.86 N ATOM 390 CA ILE A1122 -3.297 -3.264 10.393 1.00 20.39 C ATOM 391 C ILE A1122 -4.372 -4.343 10.491 1.00 19.32 C ATOM 392 O ILE A1122 -5.360 -4.313 9.746 1.00 21.57 O ATOM 393 CB ILE A1122 -3.735 -2.064 9.536 1.00 19.34 C ATOM 394 CG1 ILE A1122 -3.733 -2.405 8.040 1.00 19.23 C ATOM 395 CG2 ILE A1122 -2.836 -0.878 9.834 1.00 18.24 C ATOM 396 CD1 ILE A1122 -4.512 -1.385 7.196 1.00 17.71 C ATOM 397 H ILE A1122 -2.025 -4.319 8.992 1.00 0.00 H ATOM 398 N PRO A1123 -4.229 -5.308 11.402 1.00 21.35 N ATOM 399 CA PRO A1123 -5.188 -6.423 11.434 1.00 23.02 C ATOM 400 C PRO A1123 -6.621 -6.033 11.782 1.00 24.97 C ATOM 401 O PRO A1123 -7.521 -6.869 11.606 1.00 26.22 O ATOM 402 CB PRO A1123 -4.586 -7.379 12.466 1.00 23.07 C ATOM 403 CG PRO A1123 -3.694 -6.524 13.301 1.00 23.90 C ATOM 404 CD PRO A1123 -3.155 -5.473 12.392 1.00 22.57 C ATOM 405 N ASP A1124 -6.871 -4.806 12.254 1.00 25.39 N ATOM 406 CA ASP A1124 -8.241 -4.375 12.518 1.00 23.85 C ATOM 407 C ASP A1124 -9.014 -4.009 11.251 1.00 22.71 C ATOM 408 O ASP A1124 -10.213 -3.725 11.339 1.00 23.03 O ATOM 409 CB ASP A1124 -8.271 -3.221 13.528 1.00 24.36 C ATOM 410 CG ASP A1124 -7.629 -1.949 13.000 1.00 22.90 C ATOM 411 OD1 ASP A1124 -7.061 -1.961 11.889 1.00 20.75 O ATOM 412 OD2 ASP A1124 -7.706 -0.923 13.716 1.00 24.50 O ATOM 413 H ASP A1124 -6.082 -4.153 12.435 1.00 0.00 H ATOM 414 N TYR A1125 -8.370 -4.040 10.083 1.00 19.51 N ATOM 415 CA TYR A1125 -8.963 -3.445 8.886 1.00 18.55 C ATOM 416 C TYR A1125 -10.294 -4.099 8.524 1.00 20.73 C ATOM 417 O TYR A1125 -11.302 -3.412 8.320 1.00 21.02 O ATOM 418 CB TYR A1125 -7.971 -3.506 7.719 1.00 18.64 C ATOM 419 CG TYR A1125 -8.500 -2.821 6.480 1.00 16.38 C ATOM 420 CD1 TYR A1125 -8.429 -1.437 6.334 1.00 16.75 C ATOM 421 CD2 TYR A1125 -9.104 -3.556 5.473 1.00 17.41 C ATOM 422 CE1 TYR A1125 -8.937 -0.811 5.193 1.00 16.03 C ATOM 423 CE2 TYR A1125 -9.610 -2.946 4.352 1.00 16.60 C ATOM 424 CZ TYR A1125 -9.522 -1.581 4.211 1.00 14.93 C ATOM 425 OH TYR A1125 -10.055 -1.005 3.079 1.00 15.26 O ATOM 426 HH TYR A1125 -9.920 -0.025 3.114 1.00 0.00 H ATOM 427 H TYR A1125 -7.436 -4.493 10.023 1.00 0.00 H ATOM 428 N PHE A1126 -10.319 -5.432 8.442 1.00 22.97 N ATOM 429 CA PHE A1126 -11.536 -6.133 8.045 1.00 24.86 C ATOM 430 C PHE A1126 -12.617 -6.108 9.118 1.00 24.86 C ATOM 431 O PHE A1126 -13.771 -6.436 8.813 1.00 27.80 O ATOM 432 CB PHE A1126 -11.234 -7.576 7.621 1.00 25.80 C ATOM 433 CG PHE A1126 -10.463 -7.692 6.325 1.00 26.07 C ATOM 434 CD1 PHE A1126 -10.652 -6.779 5.298 1.00 25.86 C ATOM 435 CD2 PHE A1126 -9.551 -8.726 6.140 1.00 27.86 C ATOM 436 CE1 PHE A1126 -9.936 -6.887 4.111 1.00 25.70 C ATOM 437 CE2 PHE A1126 -8.840 -8.849 4.954 1.00 27.06 C ATOM 438 CZ PHE A1126 -9.029 -7.933 3.939 1.00 26.78 C ATOM 439 H PHE A1126 -9.461 -5.977 8.664 1.00 0.00 H ATOM 440 N ASP A1127 -12.281 -5.728 10.354 1.00 22.90 N ATOM 441 CA ASP A1127 -13.298 -5.495 11.372 1.00 25.97 C ATOM 442 C ASP A1127 -14.068 -4.209 11.123 1.00 25.52 C ATOM 443 O ASP A1127 -15.203 -4.076 11.595 1.00 30.46 O ATOM 444 CB ASP A1127 -12.648 -5.422 12.749 1.00 31.39 C ATOM 445 CG ASP A1127 -11.931 -6.705 13.121 1.00 37.62 C ATOM 446 OD1 ASP A1127 -12.413 -7.793 12.741 1.00 40.27 O ATOM 447 OD2 ASP A1127 -10.883 -6.624 13.795 1.00 40.71 O ATOM 448 H ASP A1127 -11.278 -5.596 10.594 1.00 0.00 H ATOM 449 N ILE A1128 -13.476 -3.270 10.394 1.00 19.84 N ATOM 450 CA ILE A1128 -14.087 -1.973 10.138 1.00 20.06 C ATOM 451 C ILE A1128 -14.637 -1.881 8.721 1.00 19.93 C ATOM 452 O ILE A1128 -15.712 -1.321 8.507 1.00 21.57 O ATOM 453 CB ILE A1128 -13.061 -0.851 10.416 1.00 21.01 C ATOM 454 CG1 ILE A1128 -12.720 -0.785 11.907 1.00 25.10 C ATOM 455 CG2 ILE A1128 -13.577 0.488 9.906 1.00 22.35 C ATOM 456 CD1 ILE A1128 -11.432 -0.037 12.198 1.00 26.90 C ATOM 457 H ILE A1128 -12.539 -3.469 9.990 1.00 0.00 H ATOM 458 N VAL A1129 -13.908 -2.432 7.755 1.00 18.69 N ATOM 459 CA VAL A1129 -14.260 -2.387 6.341 1.00 17.42 C ATOM 460 C VAL A1129 -14.844 -3.746 5.983 1.00 20.73 C ATOM 461 O VAL A1129 -14.117 -4.741 5.884 1.00 24.21 O ATOM 462 CB VAL A1129 -13.031 -2.078 5.480 1.00 18.64 C ATOM 463 CG1 VAL A1129 -13.369 -2.224 3.985 1.00 17.40 C ATOM 464 CG2 VAL A1129 -12.506 -0.683 5.803 1.00 19.42 C ATOM 465 H VAL A1129 -13.033 -2.925 8.025 1.00 0.00 H ATOM 466 N LYS A1130 -16.158 -3.784 5.779 1.00 20.38 N ATOM 467 CA LYS A1130 -16.857 -5.031 5.516 1.00 21.83 C ATOM 468 C LYS A1130 -16.834 -5.431 4.052 1.00 19.94 C ATOM 469 O LYS A1130 -16.898 -6.625 3.741 1.00 22.88 O ATOM 470 CB LYS A1130 -18.304 -4.916 5.994 1.00 24.58 C ATOM 471 CG LYS A1130 -18.429 -4.595 7.465 1.00 29.66 C ATOM 472 CD LYS A1130 -17.692 -5.608 8.319 1.00 32.52 C ATOM 473 CE LYS A1130 -17.936 -5.342 9.796 1.00 36.44 C ATOM 474 NZ LYS A1130 -17.245 -6.340 10.649 1.00 39.87 N ATOM 475 HZ1 LYS A1130 -17.598 -7.292 10.422 1.00 0.00 H ATOM 476 HZ2 LYS A1130 -16.221 -6.297 10.471 1.00 0.00 H ATOM 477 HZ3 LYS A1130 -17.433 -6.128 11.650 1.00 0.00 H ATOM 478 H LYS A1130 -16.700 -2.897 5.809 1.00 0.00 H ATOM 479 N ASN A1131 -16.715 -4.468 3.138 1.00 18.43 N ATOM 480 CA ASN A1131 -16.773 -4.745 1.702 1.00 20.68 C ATOM 481 C ASN A1131 -15.615 -4.019 1.044 1.00 16.45 C ATOM 482 O ASN A1131 -15.783 -2.917 0.502 1.00 16.87 O ATOM 483 CB ASN A1131 -18.112 -4.318 1.100 1.00 23.64 C ATOM 484 CG ASN A1131 -19.281 -5.083 1.693 1.00 27.39 C ATOM 485 OD1 ASN A1131 -20.120 -4.507 2.381 1.00 29.81 O ATOM 486 ND2 ASN A1131 -19.346 -6.380 1.420 1.00 29.37 N ATOM 487 HD22 ASN A1131 -18.612 -6.825 0.833 1.00 0.00 H ATOM 488 HD21 ASN A1131 -20.131 -6.951 1.793 1.00 0.00 H ATOM 489 H ASN A1131 -16.576 -3.487 3.456 1.00 0.00 H ATOM 490 N PRO A1132 -14.425 -4.622 1.055 1.00 17.68 N ATOM 491 CA PRO A1132 -13.258 -3.956 0.473 1.00 16.07 C ATOM 492 C PRO A1132 -13.440 -3.739 -1.017 1.00 17.45 C ATOM 493 O PRO A1132 -14.129 -4.494 -1.705 1.00 19.18 O ATOM 494 CB PRO A1132 -12.106 -4.932 0.735 1.00 18.40 C ATOM 495 CG PRO A1132 -12.619 -5.934 1.720 1.00 22.29 C ATOM 496 CD PRO A1132 -14.109 -5.965 1.570 1.00 20.57 C ATOM 497 N MET A1133 -12.807 -2.687 -1.511 1.00 17.77 N ATOM 498 CA MET A1133 -12.777 -2.412 -2.935 1.00 17.30 C ATOM 499 C MET A1133 -11.522 -1.606 -3.214 1.00 16.37 C ATOM 500 O MET A1133 -11.062 -0.847 -2.354 1.00 16.11 O ATOM 501 CB MET A1133 -14.041 -1.659 -3.366 1.00 17.55 C ATOM 502 CG MET A1133 -14.167 -1.418 -4.869 1.00 14.97 C ATOM 503 SD MET A1133 -14.101 -2.907 -5.879 1.00 16.69 S ATOM 504 CE MET A1133 -15.446 -3.888 -5.216 1.00 18.06 C ATOM 505 H MET A1133 -12.318 -2.040 -0.860 1.00 0.00 H ATOM 506 N ASP A1134 -10.958 -1.787 -4.406 1.00 14.42 N ATOM 507 CA ASP A1134 -9.755 -1.067 -4.799 1.00 15.04 C ATOM 508 C ASP A1134 -9.707 -0.949 -6.318 1.00 15.03 C ATOM 509 O ASP A1134 -10.523 -1.526 -7.046 1.00 14.55 O ATOM 510 CB ASP A1134 -8.502 -1.772 -4.297 1.00 16.35 C ATOM 511 CG ASP A1134 -8.206 -3.016 -5.082 1.00 18.00 C ATOM 512 OD1 ASP A1134 -8.966 -4.012 -4.968 1.00 20.72 O ATOM 513 OD2 ASP A1134 -7.223 -2.984 -5.838 1.00 19.31 O ATOM 514 H ASP A1134 -11.387 -2.459 -5.073 1.00 0.00 H ATOM 515 N LEU A1135 -8.695 -0.225 -6.794 1.00 14.46 N ATOM 516 CA LEU A1135 -8.572 0.053 -8.220 1.00 15.02 C ATOM 517 C LEU A1135 -8.408 -1.218 -9.049 1.00 16.29 C ATOM 518 O LEU A1135 -9.030 -1.357 -10.106 1.00 16.10 O ATOM 519 CB LEU A1135 -7.399 1.001 -8.469 1.00 14.58 C ATOM 520 CG LEU A1135 -7.601 2.436 -7.977 1.00 12.19 C ATOM 521 CD1 LEU A1135 -6.330 3.172 -8.259 1.00 14.45 C ATOM 522 CD2 LEU A1135 -8.755 3.105 -8.695 1.00 12.92 C ATOM 523 H LEU A1135 -7.980 0.148 -6.137 1.00 0.00 H ATOM 524 N SER A1136 -7.559 -2.150 -8.607 1.00 15.67 N ATOM 525 CA SER A1136 -7.335 -3.353 -9.404 1.00 16.42 C ATOM 526 C SER A1136 -8.618 -4.160 -9.544 1.00 15.09 C ATOM 527 O SER A1136 -8.886 -4.752 -10.603 1.00 17.48 O ATOM 528 CB SER A1136 -6.221 -4.195 -8.782 1.00 18.89 C ATOM 529 OG SER A1136 -6.627 -4.811 -7.575 1.00 20.85 O ATOM 530 HG SER A1136 -6.888 -4.114 -6.922 1.00 0.00 H ATOM 531 H SER A1136 -7.062 -2.020 -7.703 1.00 0.00 H ATOM 532 N THR A1137 -9.432 -4.183 -8.493 1.00 15.85 N ATOM 533 CA THR A1137 -10.668 -4.953 -8.554 1.00 16.72 C ATOM 534 C THR A1137 -11.668 -4.309 -9.505 1.00 14.12 C ATOM 535 O THR A1137 -12.303 -5.000 -10.310 1.00 16.76 O ATOM 536 CB THR A1137 -11.243 -5.115 -7.149 1.00 18.13 C ATOM 537 OG1 THR A1137 -10.321 -5.876 -6.353 1.00 18.40 O ATOM 538 CG2 THR A1137 -12.590 -5.835 -7.202 1.00 19.01 C ATOM 539 HG1 THR A1137 -9.455 -5.399 -6.307 1.00 0.00 H ATOM 540 H THR A1137 -9.188 -3.654 -7.631 1.00 0.00 H ATOM 541 N ILE A1138 -11.801 -2.985 -9.442 1.00 14.62 N ATOM 542 CA ILE A1138 -12.682 -2.278 -10.357 1.00 15.71 C ATOM 543 C ILE A1138 -12.216 -2.468 -11.796 1.00 15.78 C ATOM 544 O ILE A1138 -13.026 -2.709 -12.698 1.00 15.74 O ATOM 545 CB ILE A1138 -12.746 -0.795 -9.962 1.00 14.41 C ATOM 546 CG1 ILE A1138 -13.279 -0.655 -8.536 1.00 15.25 C ATOM 547 CG2 ILE A1138 -13.654 -0.058 -10.923 1.00 14.59 C ATOM 548 CD1 ILE A1138 -13.158 0.731 -7.960 1.00 15.37 C ATOM 549 H ILE A1138 -11.267 -2.450 -8.728 1.00 0.00 H ATOM 550 N LYS A1139 -10.903 -2.369 -12.028 1.00 16.94 N ATOM 551 CA LYS A1139 -10.357 -2.591 -13.363 1.00 15.12 C ATOM 552 C LYS A1139 -10.724 -3.977 -13.872 1.00 16.03 C ATOM 553 O LYS A1139 -11.192 -4.134 -15.005 1.00 16.28 O ATOM 554 CB LYS A1139 -8.833 -2.423 -13.343 1.00 18.50 C ATOM 555 CG LYS A1139 -8.191 -2.664 -14.707 1.00 22.37 C ATOM 556 CD LYS A1139 -6.733 -2.250 -14.717 1.00 25.22 C ATOM 557 CE LYS A1139 -6.167 -2.399 -16.112 1.00 29.03 C ATOM 558 NZ LYS A1139 -6.582 -3.700 -16.703 1.00 32.40 N ATOM 559 HZ1 LYS A1139 -6.230 -4.477 -16.109 1.00 0.00 H ATOM 560 HZ2 LYS A1139 -7.620 -3.742 -16.751 1.00 0.00 H ATOM 561 HZ3 LYS A1139 -6.185 -3.787 -17.660 1.00 0.00 H ATOM 562 H LYS A1139 -10.261 -2.130 -11.245 1.00 0.00 H ATOM 563 N ARG A1140 -10.533 -4.996 -13.030 1.00 15.49 N ATOM 564 CA ARG A1140 -10.893 -6.355 -13.418 1.00 18.00 C ATOM 565 C ARG A1140 -12.380 -6.467 -13.742 1.00 18.56 C ATOM 566 O ARG A1140 -12.761 -7.106 -14.730 1.00 18.64 O ATOM 567 CB ARG A1140 -10.502 -7.327 -12.304 1.00 19.56 C ATOM 568 CG ARG A1140 -10.854 -8.770 -12.575 1.00 25.54 C ATOM 569 CD ARG A1140 -9.704 -9.493 -13.241 1.00 30.74 C ATOM 570 NE ARG A1140 -9.991 -10.917 -13.399 1.00 34.90 N ATOM 571 CZ ARG A1140 -9.310 -11.737 -14.192 1.00 39.33 C ATOM 572 NH1 ARG A1140 -8.297 -11.277 -14.914 1.00 40.71 N ATOM 573 NH2 ARG A1140 -9.648 -13.018 -14.267 1.00 41.42 N ATOM 574 HE ARG A1140 -10.782 -11.316 -12.854 1.00 0.00 H ATOM 575 HH12 ARG A1140 -7.766 -11.921 -15.534 1.00 0.00 H ATOM 576 HH11 ARG A1140 -8.034 -10.272 -14.860 1.00 0.00 H ATOM 577 HH22 ARG A1140 -9.116 -13.661 -14.887 1.00 0.00 H ATOM 578 HH21 ARG A1140 -10.445 -13.379 -13.705 1.00 0.00 H ATOM 579 H ARG A1140 -10.124 -4.819 -12.090 1.00 0.00 H ATOM 580 N LYS A1141 -13.236 -5.834 -12.933 1.00 18.33 N ATOM 581 CA LYS A1141 -14.671 -5.906 -13.194 1.00 17.02 C ATOM 582 C LYS A1141 -15.025 -5.231 -14.514 1.00 17.84 C ATOM 583 O LYS A1141 -15.871 -5.721 -15.268 1.00 18.64 O ATOM 584 CB LYS A1141 -15.450 -5.327 -12.019 1.00 17.00 C ATOM 585 CG LYS A1141 -15.263 -6.162 -10.743 1.00 18.38 C ATOM 586 CD LYS A1141 -16.000 -5.553 -9.552 1.00 18.99 C ATOM 587 CE LYS A1141 -17.505 -5.701 -9.690 1.00 18.29 C ATOM 588 NZ LYS A1141 -18.197 -5.336 -8.408 1.00 20.20 N ATOM 589 HZ1 LYS A1141 -17.867 -5.963 -7.647 1.00 0.00 H ATOM 590 HZ2 LYS A1141 -17.978 -4.349 -8.166 1.00 0.00 H ATOM 591 HZ3 LYS A1141 -19.224 -5.445 -8.527 1.00 0.00 H ATOM 592 H LYS A1141 -12.881 -5.292 -12.120 1.00 0.00 H ATOM 593 N LEU A1142 -14.349 -4.130 -14.834 1.00 17.48 N ATOM 594 CA LEU A1142 -14.554 -3.485 -16.125 1.00 20.71 C ATOM 595 C LEU A1142 -14.101 -4.388 -17.268 1.00 19.43 C ATOM 596 O LEU A1142 -14.803 -4.525 -18.278 1.00 21.69 O ATOM 597 CB LEU A1142 -13.788 -2.158 -16.134 1.00 24.94 C ATOM 598 CG LEU A1142 -14.402 -0.889 -16.722 1.00 29.20 C ATOM 599 CD1 LEU A1142 -15.898 -0.834 -16.495 1.00 27.45 C ATOM 600 CD2 LEU A1142 -13.728 0.312 -16.090 1.00 28.92 C ATOM 601 H LEU A1142 -13.669 -3.727 -14.158 1.00 0.00 H ATOM 602 N ASP A1143 -12.941 -5.038 -17.116 1.00 18.37 N ATOM 603 CA ASP A1143 -12.390 -5.866 -18.183 1.00 20.90 C ATOM 604 C ASP A1143 -13.179 -7.153 -18.388 1.00 19.26 C ATOM 605 O ASP A1143 -13.177 -7.716 -19.493 1.00 21.70 O ATOM 606 CB ASP A1143 -10.934 -6.210 -17.867 1.00 22.63 C ATOM 607 CG ASP A1143 -9.989 -5.053 -18.126 1.00 27.12 C ATOM 608 OD1 ASP A1143 -10.287 -4.229 -19.018 1.00 29.81 O ATOM 609 OD2 ASP A1143 -8.943 -4.981 -17.447 1.00 28.25 O ATOM 610 H ASP A1143 -12.422 -4.951 -16.219 1.00 0.00 H ATOM 611 N THR A1144 -13.824 -7.655 -17.337 1.00 18.78 N ATOM 612 CA THR A1144 -14.541 -8.918 -17.413 1.00 19.21 C ATOM 613 C THR A1144 -16.050 -8.740 -17.500 1.00 19.30 C ATOM 614 O THR A1144 -16.792 -9.714 -17.314 1.00 22.96 O ATOM 615 CB THR A1144 -14.146 -9.829 -16.248 1.00 20.93 C ATOM 616 OG1 THR A1144 -14.466 -9.210 -15.002 1.00 19.18 O ATOM 617 CG2 THR A1144 -12.645 -10.143 -16.292 1.00 22.41 C ATOM 618 HG1 THR A1144 -13.974 -8.354 -14.924 1.00 0.00 H ATOM 619 H THR A1144 -13.815 -7.131 -16.439 1.00 0.00 H ATOM 620 N GLY A1145 -16.512 -7.527 -17.796 1.00 18.62 N ATOM 621 CA GLY A1145 -17.920 -7.290 -18.062 1.00 20.85 C ATOM 622 C GLY A1145 -18.838 -7.459 -16.873 1.00 21.46 C ATOM 623 O GLY A1145 -19.995 -7.846 -17.049 1.00 23.15 O ATOM 624 H GLY A1145 -15.847 -6.728 -17.838 1.00 0.00 H ATOM 625 N GLN A1146 -18.362 -7.171 -15.664 1.00 20.27 N ATOM 626 CA GLN A1146 -19.161 -7.391 -14.465 1.00 21.13 C ATOM 627 C GLN A1146 -20.079 -6.223 -14.123 1.00 21.58 C ATOM 628 O GLN A1146 -20.861 -6.329 -13.172 1.00 22.54 O ATOM 629 CB GLN A1146 -18.262 -7.721 -13.269 1.00 20.94 C ATOM 630 CG GLN A1146 -17.562 -9.071 -13.376 1.00 22.75 C ATOM 631 CD GLN A1146 -16.789 -9.425 -12.121 1.00 23.28 C ATOM 632 OE1 GLN A1146 -17.293 -9.281 -11.005 1.00 23.65 O ATOM 633 NE2 GLN A1146 -15.552 -9.879 -12.295 1.00 23.65 N ATOM 634 HE22 GLN A1146 -15.167 -9.985 -13.255 1.00 0.00 H ATOM 635 HE21 GLN A1146 -14.969 -10.129 -11.471 1.00 0.00 H ATOM 636 H GLN A1146 -17.402 -6.782 -15.573 1.00 0.00 H ATOM 637 N TYR A1147 -20.003 -5.118 -14.856 1.00 21.49 N ATOM 638 CA TYR A1147 -20.934 -4.014 -14.682 1.00 22.80 C ATOM 639 C TYR A1147 -21.945 -4.035 -15.820 1.00 22.76 C ATOM 640 O TYR A1147 -21.572 -4.114 -16.994 1.00 24.53 O ATOM 641 CB TYR A1147 -20.192 -2.682 -14.651 1.00 21.00 C ATOM 642 CG TYR A1147 -19.179 -2.565 -13.531 1.00 20.41 C ATOM 643 CD1 TYR A1147 -19.563 -2.681 -12.199 1.00 19.46 C ATOM 644 CD2 TYR A1147 -17.843 -2.314 -13.808 1.00 17.50 C ATOM 645 CE1 TYR A1147 -18.634 -2.554 -11.174 1.00 18.06 C ATOM 646 CE2 TYR A1147 -16.912 -2.193 -12.797 1.00 17.28 C ATOM 647 CZ TYR A1147 -17.312 -2.314 -11.485 1.00 17.28 C ATOM 648 OH TYR A1147 -16.370 -2.194 -10.498 1.00 18.49 O ATOM 649 HH TYR A1147 -16.803 -2.303 -9.615 1.00 0.00 H ATOM 650 H TYR A1147 -19.256 -5.040 -15.575 1.00 0.00 H ATOM 651 N GLN A1148 -23.221 -3.988 -15.474 1.00 21.87 N ATOM 652 CA GLN A1148 -24.258 -3.889 -16.489 1.00 24.95 C ATOM 653 C GLN A1148 -24.666 -2.449 -16.753 1.00 24.21 C ATOM 654 O GLN A1148 -25.162 -2.143 -17.844 1.00 24.96 O ATOM 655 CB GLN A1148 -25.478 -4.728 -16.086 1.00 30.19 C ATOM 656 CG GLN A1148 -25.289 -6.240 -16.268 1.00 34.83 C ATOM 657 CD GLN A1148 -24.182 -6.821 -15.400 1.00 38.03 C ATOM 658 OE1 GLN A1148 -24.170 -6.633 -14.182 1.00 38.29 O ATOM 659 NE2 GLN A1148 -23.240 -7.525 -16.027 1.00 38.33 N ATOM 660 HE22 GLN A1148 -23.290 -7.659 -17.057 1.00 0.00 H ATOM 661 HE21 GLN A1148 -22.455 -7.941 -15.486 1.00 0.00 H ATOM 662 H GLN A1148 -23.485 -4.022 -14.469 1.00 0.00 H ATOM 663 N GLU A1149 -24.434 -1.564 -15.789 1.00 21.81 N ATOM 664 CA GLU A1149 -24.892 -0.187 -15.818 1.00 24.23 C ATOM 665 C GLU A1149 -23.774 0.702 -15.302 1.00 20.64 C ATOM 666 O GLU A1149 -23.017 0.295 -14.412 1.00 19.77 O ATOM 667 CB GLU A1149 -26.104 -0.014 -14.888 1.00 27.55 C ATOM 668 CG GLU A1149 -27.324 -0.809 -15.295 1.00 32.79 C ATOM 669 CD GLU A1149 -28.262 -0.007 -16.168 1.00 37.96 C ATOM 670 OE1 GLU A1149 -29.478 0.016 -15.881 1.00 41.24 O ATOM 671 OE2 GLU A1149 -27.785 0.612 -17.140 1.00 38.97 O ATOM 672 H GLU A1149 -23.889 -1.878 -14.961 1.00 0.00 H ATOM 673 N PRO A1150 -23.645 1.922 -15.830 1.00 20.22 N ATOM 674 CA PRO A1150 -22.595 2.818 -15.324 1.00 16.90 C ATOM 675 C PRO A1150 -22.641 3.038 -13.822 1.00 16.86 C ATOM 676 O PRO A1150 -21.581 3.102 -13.183 1.00 16.29 O ATOM 677 CB PRO A1150 -22.836 4.120 -16.109 1.00 18.91 C ATOM 678 CG PRO A1150 -23.484 3.686 -17.367 1.00 20.11 C ATOM 679 CD PRO A1150 -24.349 2.497 -16.993 1.00 19.77 C ATOM 680 N TRP A1151 -23.836 3.145 -13.231 1.00 16.53 N ATOM 681 CA TRP A1151 -23.922 3.434 -11.802 1.00 15.54 C ATOM 682 C TRP A1151 -23.309 2.339 -10.942 1.00 14.96 C ATOM 683 O TRP A1151 -22.872 2.629 -9.816 1.00 16.22 O ATOM 684 CB TRP A1151 -25.364 3.713 -11.369 1.00 17.68 C ATOM 685 CG TRP A1151 -26.327 2.581 -11.592 1.00 21.27 C ATOM 686 CD1 TRP A1151 -27.158 2.425 -12.662 1.00 23.08 C ATOM 687 CD2 TRP A1151 -26.584 1.470 -10.718 1.00 23.37 C ATOM 688 NE1 TRP A1151 -27.913 1.282 -12.519 1.00 27.37 N ATOM 689 CE2 TRP A1151 -27.581 0.678 -11.337 1.00 25.29 C ATOM 690 CE3 TRP A1151 -26.069 1.061 -9.482 1.00 24.00 C ATOM 691 CZ2 TRP A1151 -28.067 -0.496 -10.764 1.00 26.15 C ATOM 692 CZ3 TRP A1151 -26.568 -0.119 -8.911 1.00 25.07 C ATOM 693 CH2 TRP A1151 -27.548 -0.874 -9.554 1.00 25.28 C ATOM 694 HE1 TRP A1151 -28.620 0.935 -13.198 1.00 0.00 H ATOM 695 H TRP A1151 -24.705 3.022 -13.789 1.00 0.00 H ATOM 696 N GLN A1152 -23.243 1.100 -11.444 1.00 16.83 N ATOM 697 CA GLN A1152 -22.611 0.026 -10.680 1.00 15.83 C ATOM 698 C GLN A1152 -21.105 0.232 -10.583 1.00 15.26 C ATOM 699 O GLN A1152 -20.500 -0.040 -9.534 1.00 14.76 O ATOM 700 CB GLN A1152 -22.937 -1.333 -11.301 1.00 16.54 C ATOM 701 CG GLN A1152 -24.423 -1.694 -11.260 1.00 19.22 C ATOM 702 CD GLN A1152 -24.719 -2.910 -12.091 1.00 23.47 C ATOM 703 OE1 GLN A1152 -24.166 -3.076 -13.176 1.00 23.85 O ATOM 704 NE2 GLN A1152 -25.578 -3.788 -11.582 1.00 26.90 N ATOM 705 HE22 GLN A1152 -26.022 -3.606 -10.660 1.00 0.00 H ATOM 706 HE21 GLN A1152 -25.805 -4.657 -12.106 1.00 0.00 H ATOM 707 H GLN A1152 -23.644 0.900 -12.383 1.00 0.00 H ATOM 708 N TYR A1153 -20.486 0.711 -11.661 1.00 16.98 N ATOM 709 CA TYR A1153 -19.087 1.109 -11.597 1.00 15.41 C ATOM 710 C TYR A1153 -18.903 2.294 -10.664 1.00 14.97 C ATOM 711 O TYR A1153 -18.025 2.274 -9.795 1.00 14.30 O ATOM 712 CB TYR A1153 -18.590 1.448 -12.998 1.00 15.79 C ATOM 713 CG TYR A1153 -17.312 2.248 -13.057 1.00 13.00 C ATOM 714 CD1 TYR A1153 -16.081 1.606 -12.977 1.00 13.03 C ATOM 715 CD2 TYR A1153 -17.330 3.629 -13.243 1.00 15.14 C ATOM 716 CE1 TYR A1153 -14.891 2.338 -13.057 1.00 13.24 C ATOM 717 CE2 TYR A1153 -16.144 4.358 -13.326 1.00 14.27 C ATOM 718 CZ TYR A1153 -14.934 3.703 -13.228 1.00 15.04 C ATOM 719 OH TYR A1153 -13.742 4.408 -13.310 1.00 15.69 O ATOM 720 HH TYR A1153 -13.691 4.867 -14.186 1.00 0.00 H ATOM 721 H TYR A1153 -21.007 0.801 -12.557 1.00 0.00 H ATOM 722 N VAL A1154 -19.734 3.330 -10.823 1.00 15.07 N ATOM 723 CA VAL A1154 -19.641 4.482 -9.926 1.00 15.30 C ATOM 724 C VAL A1154 -19.802 4.062 -8.469 1.00 14.64 C ATOM 725 O VAL A1154 -19.061 4.529 -7.597 1.00 14.38 O ATOM 726 CB VAL A1154 -20.637 5.578 -10.336 1.00 15.55 C ATOM 727 CG1 VAL A1154 -20.534 6.742 -9.354 1.00 17.21 C ATOM 728 CG2 VAL A1154 -20.348 6.049 -11.740 1.00 16.85 C ATOM 729 H VAL A1154 -20.444 3.317 -11.582 1.00 0.00 H ATOM 730 N ASP A1155 -20.734 3.143 -8.192 1.00 16.38 N ATOM 731 CA ASP A1155 -20.918 2.625 -6.836 1.00 17.05 C ATOM 732 C ASP A1155 -19.631 2.005 -6.295 1.00 14.74 C ATOM 733 O ASP A1155 -19.310 2.162 -5.112 1.00 14.51 O ATOM 734 CB ASP A1155 -22.018 1.565 -6.837 1.00 16.86 C ATOM 735 CG ASP A1155 -23.401 2.139 -6.680 1.00 21.62 C ATOM 736 OD1 ASP A1155 -23.545 3.371 -6.533 1.00 23.75 O ATOM 737 OD2 ASP A1155 -24.351 1.333 -6.706 1.00 23.50 O ATOM 738 H ASP A1155 -21.342 2.789 -8.958 1.00 0.00 H ATOM 739 N ASP A1156 -18.904 1.253 -7.131 1.00 15.65 N ATOM 740 CA ASP A1156 -17.678 0.604 -6.666 1.00 14.05 C ATOM 741 C ASP A1156 -16.579 1.616 -6.403 1.00 13.60 C ATOM 742 O ASP A1156 -15.829 1.483 -5.427 1.00 13.81 O ATOM 743 CB ASP A1156 -17.189 -0.425 -7.680 1.00 14.34 C ATOM 744 CG ASP A1156 -17.701 -1.825 -7.391 1.00 18.10 C ATOM 745 OD1 ASP A1156 -18.299 -2.043 -6.319 1.00 19.65 O ATOM 746 OD2 ASP A1156 -17.491 -2.721 -8.241 1.00 19.64 O ATOM 747 H ASP A1156 -19.213 1.130 -8.116 1.00 0.00 H ATOM 748 N VAL A1157 -16.456 2.637 -7.263 1.00 12.00 N ATOM 749 CA VAL A1157 -15.456 3.662 -7.000 1.00 12.89 C ATOM 750 C VAL A1157 -15.759 4.356 -5.687 1.00 12.68 C ATOM 751 O VAL A1157 -14.857 4.607 -4.870 1.00 13.10 O ATOM 752 CB VAL A1157 -15.375 4.662 -8.162 1.00 12.72 C ATOM 753 CG1 VAL A1157 -14.447 5.822 -7.767 1.00 13.64 C ATOM 754 CG2 VAL A1157 -14.884 3.946 -9.401 1.00 15.44 C ATOM 755 H VAL A1157 -17.065 2.696 -8.104 1.00 0.00 H ATOM 756 N TRP A1158 -17.026 4.687 -5.461 1.00 12.68 N ATOM 757 CA TRP A1158 -17.392 5.364 -4.218 1.00 13.59 C ATOM 758 C TRP A1158 -17.276 4.449 -2.999 1.00 15.45 C ATOM 759 O TRP A1158 -17.014 4.935 -1.891 1.00 14.96 O ATOM 760 CB TRP A1158 -18.783 5.988 -4.339 1.00 12.03 C ATOM 761 CG TRP A1158 -18.656 7.367 -4.866 1.00 14.63 C ATOM 762 CD1 TRP A1158 -18.665 7.747 -6.169 1.00 18.65 C ATOM 763 CD2 TRP A1158 -18.387 8.536 -4.100 1.00 16.55 C ATOM 764 NE1 TRP A1158 -18.449 9.104 -6.264 1.00 20.34 N ATOM 765 CE2 TRP A1158 -18.266 9.607 -5.005 1.00 18.77 C ATOM 766 CE3 TRP A1158 -18.242 8.781 -2.732 1.00 17.90 C ATOM 767 CZ2 TRP A1158 -18.025 10.918 -4.587 1.00 18.79 C ATOM 768 CZ3 TRP A1158 -18.005 10.082 -2.314 1.00 19.43 C ATOM 769 CH2 TRP A1158 -17.894 11.133 -3.244 1.00 21.00 C ATOM 770 HE1 TRP A1158 -18.428 9.655 -7.146 1.00 0.00 H ATOM 771 H TRP A1158 -17.756 4.465 -6.167 1.00 0.00 H ATOM 772 N LEU A1159 -17.513 3.144 -3.158 1.00 13.14 N ATOM 773 CA LEU A1159 -17.274 2.202 -2.061 1.00 13.34 C ATOM 774 C LEU A1159 -15.812 2.220 -1.648 1.00 13.89 C ATOM 775 O LEU A1159 -15.489 2.242 -0.446 1.00 12.92 O ATOM 776 CB LEU A1159 -17.674 0.797 -2.518 1.00 14.33 C ATOM 777 CG LEU A1159 -17.418 -0.328 -1.531 1.00 14.76 C ATOM 778 CD1 LEU A1159 -18.198 -0.072 -0.238 1.00 16.87 C ATOM 779 CD2 LEU A1159 -17.754 -1.686 -2.169 1.00 16.11 C ATOM 780 H LEU A1159 -17.871 2.793 -4.069 1.00 0.00 H ATOM 781 N MET A1160 -14.914 2.210 -2.646 1.00 13.21 N ATOM 782 CA MET A1160 -13.485 2.368 -2.396 1.00 12.09 C ATOM 783 C MET A1160 -13.191 3.643 -1.612 1.00 12.98 C ATOM 784 O MET A1160 -12.447 3.616 -0.625 1.00 13.93 O ATOM 785 CB MET A1160 -12.745 2.371 -3.727 1.00 13.27 C ATOM 786 CG MET A1160 -11.272 2.684 -3.619 1.00 14.97 C ATOM 787 SD MET A1160 -10.474 2.543 -5.228 1.00 14.66 S ATOM 788 CE MET A1160 -11.093 4.030 -6.028 1.00 16.60 C ATOM 789 H MET A1160 -15.246 2.086 -3.624 1.00 0.00 H ATOM 790 N PHE A1161 -13.767 4.773 -2.033 1.00 14.08 N ATOM 791 CA PHE A1161 -13.522 6.029 -1.327 1.00 13.09 C ATOM 792 C PHE A1161 -14.081 5.978 0.088 1.00 12.75 C ATOM 793 O PHE A1161 -13.402 6.350 1.056 1.00 13.27 O ATOM 794 CB PHE A1161 -14.197 7.175 -2.069 1.00 13.73 C ATOM 795 CG PHE A1161 -13.610 7.496 -3.414 1.00 12.49 C ATOM 796 CD1 PHE A1161 -12.315 7.163 -3.737 1.00 11.86 C ATOM 797 CD2 PHE A1161 -14.384 8.180 -4.345 1.00 14.47 C ATOM 798 CE1 PHE A1161 -11.797 7.489 -4.983 1.00 14.32 C ATOM 799 CE2 PHE A1161 -13.878 8.508 -5.581 1.00 12.82 C ATOM 800 CZ PHE A1161 -12.588 8.157 -5.907 1.00 14.10 C ATOM 801 H PHE A1161 -14.391 4.759 -2.865 1.00 0.00 H ATOM 802 N ASN A1162 -15.314 5.497 0.236 1.00 12.06 N ATOM 803 CA ASN A1162 -15.947 5.511 1.544 1.00 12.47 C ATOM 804 C ASN A1162 -15.216 4.606 2.519 1.00 14.25 C ATOM 805 O ASN A1162 -15.088 4.943 3.699 1.00 16.11 O ATOM 806 CB ASN A1162 -17.425 5.138 1.428 1.00 15.77 C ATOM 807 CG ASN A1162 -18.259 6.300 0.950 1.00 18.96 C ATOM 808 OD1 ASN A1162 -18.011 7.444 1.335 1.00 22.88 O ATOM 809 ND2 ASN A1162 -19.260 6.022 0.113 1.00 20.67 N ATOM 810 HD22 ASN A1162 -19.431 5.040 -0.185 1.00 0.00 H ATOM 811 HD21 ASN A1162 -19.869 6.787 -0.242 1.00 0.00 H ATOM 812 H ASN A1162 -15.824 5.111 -0.584 1.00 0.00 H ATOM 813 N ASN A1163 -14.723 3.455 2.044 1.00 14.61 N ATOM 814 CA ASN A1163 -13.921 2.588 2.898 1.00 14.23 C ATOM 815 C ASN A1163 -12.690 3.321 3.415 1.00 13.74 C ATOM 816 O ASN A1163 -12.337 3.198 4.590 1.00 13.93 O ATOM 817 CB ASN A1163 -13.467 1.352 2.112 1.00 12.21 C ATOM 818 CG ASN A1163 -14.588 0.360 1.823 1.00 12.81 C ATOM 819 OD1 ASN A1163 -15.630 0.349 2.463 1.00 16.75 O ATOM 820 ND2 ASN A1163 -14.332 -0.508 0.856 1.00 14.84 N ATOM 821 HD22 ASN A1163 -13.431 -0.460 0.339 1.00 0.00 H ATOM 822 HD21 ASN A1163 -15.032 -1.238 0.614 1.00 0.00 H ATOM 823 H ASN A1163 -14.914 3.178 1.060 1.00 0.00 H ATOM 824 N ALA A1164 -12.022 4.074 2.542 1.00 14.94 N ATOM 825 CA ALA A1164 -10.802 4.769 2.931 1.00 13.26 C ATOM 826 C ALA A1164 -11.092 5.886 3.918 1.00 12.91 C ATOM 827 O ALA A1164 -10.333 6.084 4.871 1.00 14.44 O ATOM 828 CB ALA A1164 -10.095 5.312 1.694 1.00 12.39 C ATOM 829 H ALA A1164 -12.377 4.167 1.569 1.00 0.00 H ATOM 830 N TRP A1165 -12.173 6.644 3.711 1.00 13.00 N ATOM 831 CA TRP A1165 -12.508 7.674 4.697 1.00 11.56 C ATOM 832 C TRP A1165 -12.987 7.082 6.018 1.00 14.90 C ATOM 833 O TRP A1165 -12.859 7.723 7.065 1.00 16.31 O ATOM 834 CB TRP A1165 -13.593 8.602 4.164 1.00 14.21 C ATOM 835 CG TRP A1165 -13.163 9.517 3.080 1.00 12.79 C ATOM 836 CD1 TRP A1165 -12.045 10.319 3.052 1.00 13.31 C ATOM 837 CD2 TRP A1165 -13.896 9.813 1.896 1.00 13.20 C ATOM 838 NE1 TRP A1165 -12.034 11.069 1.900 1.00 13.74 N ATOM 839 CE2 TRP A1165 -13.159 10.774 1.172 1.00 12.55 C ATOM 840 CE3 TRP A1165 -15.101 9.347 1.366 1.00 14.70 C ATOM 841 CZ2 TRP A1165 -13.591 11.278 -0.052 1.00 14.52 C ATOM 842 CZ3 TRP A1165 -15.527 9.852 0.146 1.00 13.56 C ATOM 843 CH2 TRP A1165 -14.775 10.796 -0.550 1.00 13.31 C ATOM 844 HE1 TRP A1165 -11.295 11.748 1.626 1.00 0.00 H ATOM 845 H TRP A1165 -12.764 6.505 2.867 1.00 0.00 H ATOM 846 N LEU A1166 -13.588 5.895 5.975 1.00 16.17 N ATOM 847 CA LEU A1166 -14.073 5.227 7.176 1.00 17.00 C ATOM 848 C LEU A1166 -12.915 4.719 8.023 1.00 17.47 C ATOM 849 O LEU A1166 -12.855 4.973 9.237 1.00 20.88 O ATOM 850 CB LEU A1166 -14.989 4.073 6.777 1.00 18.05 C ATOM 851 CG LEU A1166 -15.471 3.188 7.919 1.00 19.57 C ATOM 852 CD1 LEU A1166 -16.371 3.992 8.828 1.00 22.52 C ATOM 853 CD2 LEU A1166 -16.200 1.994 7.348 1.00 20.62 C ATOM 854 H LEU A1166 -13.716 5.429 5.054 1.00 0.00 H ATOM 855 N TYR A1167 -11.981 4.005 7.395 1.00 15.32 N ATOM 856 CA TYR A1167 -10.920 3.347 8.143 1.00 14.81 C ATOM 857 C TYR A1167 -9.827 4.312 8.575 1.00 15.12 C ATOM 858 O TYR A1167 -9.359 4.267 9.720 1.00 17.12 O ATOM 859 CB TYR A1167 -10.311 2.213 7.315 1.00 15.37 C ATOM 860 CG TYR A1167 -9.210 1.575 8.106 1.00 14.90 C ATOM 861 CD1 TYR A1167 -9.514 0.706 9.151 1.00 15.63 C ATOM 862 CD2 TYR A1167 -7.871 1.910 7.882 1.00 16.03 C ATOM 863 CE1 TYR A1167 -8.516 0.159 9.922 1.00 18.57 C ATOM 864 CE2 TYR A1167 -6.873 1.371 8.644 1.00 16.37 C ATOM 865 CZ TYR A1167 -7.202 0.492 9.659 1.00 17.96 C ATOM 866 OH TYR A1167 -6.214 -0.051 10.445 1.00 19.86 O ATOM 867 HH TYR A1167 -6.622 -0.654 11.116 1.00 0.00 H ATOM 868 H TYR A1167 -12.011 3.917 6.359 1.00 0.00 H ATOM 869 N ASN A1168 -9.363 5.154 7.661 1.00 14.78 N ATOM 870 CA ASN A1168 -8.187 5.962 7.933 1.00 15.31 C ATOM 871 C ASN A1168 -8.554 7.252 8.649 1.00 15.50 C ATOM 872 O ASN A1168 -9.665 7.775 8.511 1.00 16.89 O ATOM 873 CB ASN A1168 -7.440 6.249 6.636 1.00 14.14 C ATOM 874 CG ASN A1168 -7.015 4.975 5.930 1.00 14.42 C ATOM 875 OD1 ASN A1168 -5.995 4.383 6.270 1.00 14.75 O ATOM 876 ND2 ASN A1168 -7.821 4.529 4.964 1.00 14.97 N ATOM 877 HD22 ASN A1168 -8.675 5.065 4.710 1.00 0.00 H ATOM 878 HD21 ASN A1168 -7.595 3.645 4.465 1.00 0.00 H ATOM 879 H ASN A1168 -9.845 5.236 6.743 1.00 0.00 H ATOM 880 N ARG A1169 -7.605 7.754 9.434 1.00 13.84 N ATOM 881 CA ARG A1169 -7.835 8.969 10.197 1.00 15.10 C ATOM 882 C ARG A1169 -7.771 10.180 9.280 1.00 15.05 C ATOM 883 O ARG A1169 -7.098 10.171 8.249 1.00 15.30 O ATOM 884 CB ARG A1169 -6.791 9.110 11.307 1.00 17.18 C ATOM 885 CG ARG A1169 -6.798 7.985 12.346 1.00 19.92 C ATOM 886 CD ARG A1169 -7.979 8.089 13.317 1.00 22.45 C ATOM 887 NE ARG A1169 -9.248 7.750 12.672 1.00 23.60 N ATOM 888 CZ ARG A1169 -9.705 6.511 12.525 1.00 25.34 C ATOM 889 NH1 ARG A1169 -9.003 5.487 12.986 1.00 24.95 N ATOM 890 NH2 ARG A1169 -10.866 6.295 11.921 1.00 27.06 N ATOM 891 HE ARG A1169 -9.830 8.530 12.305 1.00 0.00 H ATOM 892 HH12 ARG A1169 -9.361 4.517 12.871 1.00 0.00 H ATOM 893 HH11 ARG A1169 -8.094 5.653 13.463 1.00 0.00 H ATOM 894 HH22 ARG A1169 -11.221 5.324 11.808 1.00 0.00 H ATOM 895 HH21 ARG A1169 -11.422 7.097 11.561 1.00 0.00 H ATOM 896 H ARG A1169 -6.687 7.271 9.503 1.00 0.00 H ATOM 897 N LYS A1170 -8.481 11.240 9.674 1.00 16.45 N ATOM 898 CA LYS A1170 -8.622 12.400 8.801 1.00 17.81 C ATOM 899 C LYS A1170 -7.302 13.115 8.545 1.00 16.33 C ATOM 900 O LYS A1170 -7.190 13.838 7.552 1.00 18.70 O ATOM 901 CB LYS A1170 -9.709 13.354 9.316 1.00 22.97 C ATOM 902 CG LYS A1170 -9.219 14.532 10.119 1.00 23.88 C ATOM 903 CD LYS A1170 -10.396 15.349 10.675 1.00 27.54 C ATOM 904 CE LYS A1170 -11.391 14.459 11.409 1.00 31.39 C ATOM 905 NZ LYS A1170 -12.659 15.157 11.770 1.00 34.76 N ATOM 906 HZ1 LYS A1170 -12.445 15.964 12.390 1.00 0.00 H ATOM 907 HZ2 LYS A1170 -13.124 15.498 10.905 1.00 0.00 H ATOM 908 HZ3 LYS A1170 -13.289 14.494 12.266 1.00 0.00 H ATOM 909 H LYS A1170 -8.936 11.239 10.609 1.00 0.00 H ATOM 910 N THR A1171 -6.300 12.908 9.391 1.00 15.75 N ATOM 911 CA THR A1171 -4.990 13.515 9.222 1.00 16.47 C ATOM 912 C THR A1171 -4.032 12.653 8.415 1.00 14.88 C ATOM 913 O THR A1171 -2.898 13.074 8.167 1.00 17.10 O ATOM 914 CB THR A1171 -4.375 13.733 10.596 1.00 16.26 C ATOM 915 OG1 THR A1171 -4.393 12.491 11.308 1.00 17.15 O ATOM 916 CG2 THR A1171 -5.145 14.790 11.393 1.00 16.76 C ATOM 917 HG1 THR A1171 -3.995 12.620 12.205 1.00 0.00 H ATOM 918 H THR A1171 -6.459 12.286 10.209 1.00 0.00 H ATOM 919 N SER A1172 -4.442 11.450 8.023 1.00 15.21 N ATOM 920 CA SER A1172 -3.536 10.487 7.413 1.00 14.78 C ATOM 921 C SER A1172 -3.397 10.687 5.901 1.00 15.48 C ATOM 922 O SER A1172 -4.245 11.287 5.232 1.00 14.51 O ATOM 923 CB SER A1172 -4.039 9.076 7.673 1.00 14.47 C ATOM 924 OG SER A1172 -5.217 8.836 6.910 1.00 14.59 O ATOM 925 HG SER A1172 -5.916 9.487 7.171 1.00 0.00 H ATOM 926 H SER A1172 -5.440 11.189 8.156 1.00 0.00 H ATOM 927 N ARG A1173 -2.304 10.139 5.366 1.00 13.29 N ATOM 928 CA ARG A1173 -2.055 10.192 3.928 1.00 13.49 C ATOM 929 C ARG A1173 -3.182 9.540 3.151 1.00 14.26 C ATOM 930 O ARG A1173 -3.664 10.102 2.165 1.00 14.54 O ATOM 931 CB ARG A1173 -0.739 9.494 3.591 1.00 13.32 C ATOM 932 CG ARG A1173 0.496 10.204 4.086 1.00 16.04 C ATOM 933 CD ARG A1173 1.723 9.302 4.019 1.00 17.54 C ATOM 934 NE ARG A1173 1.569 8.179 4.938 1.00 14.99 N ATOM 935 CZ ARG A1173 2.336 7.094 4.962 1.00 17.13 C ATOM 936 NH1 ARG A1173 3.350 6.954 4.115 1.00 16.45 N ATOM 937 NH2 ARG A1173 2.079 6.132 5.846 1.00 17.92 N ATOM 938 HE ARG A1173 0.795 8.232 5.631 1.00 0.00 H ATOM 939 HH12 ARG A1173 3.940 6.098 4.147 1.00 0.00 H ATOM 940 HH11 ARG A1173 3.553 7.700 3.420 1.00 0.00 H ATOM 941 HH22 ARG A1173 2.673 5.279 5.873 1.00 0.00 H ATOM 942 HH21 ARG A1173 1.284 6.234 6.509 1.00 0.00 H ATOM 943 H ARG A1173 -1.616 9.665 5.985 1.00 0.00 H ATOM 944 N VAL A1174 -3.595 8.333 3.544 1.00 13.63 N ATOM 945 CA VAL A1174 -4.603 7.633 2.747 1.00 12.74 C ATOM 946 C VAL A1174 -5.897 8.436 2.697 1.00 12.62 C ATOM 947 O VAL A1174 -6.541 8.542 1.645 1.00 12.97 O ATOM 948 CB VAL A1174 -4.839 6.189 3.236 1.00 13.62 C ATOM 949 CG1 VAL A1174 -6.016 5.580 2.474 1.00 13.99 C ATOM 950 CG2 VAL A1174 -3.601 5.336 3.052 1.00 15.06 C ATOM 951 H VAL A1174 -3.206 7.896 4.404 1.00 0.00 H ATOM 952 N TYR A1175 -6.276 9.049 3.823 1.00 12.18 N ATOM 953 CA TYR A1175 -7.502 9.849 3.862 1.00 14.76 C ATOM 954 C TYR A1175 -7.389 11.084 2.965 1.00 13.41 C ATOM 955 O TYR A1175 -8.294 11.372 2.177 1.00 14.33 O ATOM 956 CB TYR A1175 -7.796 10.230 5.310 1.00 14.36 C ATOM 957 CG TYR A1175 -9.145 10.845 5.656 1.00 16.03 C ATOM 958 CD1 TYR A1175 -9.424 12.177 5.375 1.00 16.60 C ATOM 959 CD2 TYR A1175 -10.103 10.109 6.343 1.00 14.32 C ATOM 960 CE1 TYR A1175 -10.645 12.758 5.732 1.00 16.08 C ATOM 961 CE2 TYR A1175 -11.309 10.667 6.686 1.00 17.69 C ATOM 962 CZ TYR A1175 -11.575 11.997 6.394 1.00 17.23 C ATOM 963 OH TYR A1175 -12.786 12.532 6.771 1.00 20.15 O ATOM 964 HH TYR A1175 -12.882 12.468 7.754 1.00 0.00 H ATOM 965 H TYR A1175 -5.694 8.957 4.680 1.00 0.00 H ATOM 966 N LYS A1176 -6.286 11.825 3.064 1.00 12.89 N ATOM 967 CA LYS A1176 -6.120 13.014 2.235 1.00 13.13 C ATOM 968 C LYS A1176 -6.013 12.624 0.770 1.00 14.21 C ATOM 969 O LYS A1176 -6.565 13.303 -0.116 1.00 14.30 O ATOM 970 CB LYS A1176 -4.842 13.739 2.651 1.00 16.36 C ATOM 971 CG LYS A1176 -4.836 14.251 4.069 1.00 19.83 C ATOM 972 CD LYS A1176 -5.165 15.728 4.125 1.00 26.09 C ATOM 973 CE LYS A1176 -5.354 16.216 5.553 1.00 29.46 C ATOM 974 NZ LYS A1176 -6.382 17.294 5.589 1.00 31.64 N ATOM 975 HZ1 LYS A1176 -6.071 18.088 4.993 1.00 0.00 H ATOM 976 HZ2 LYS A1176 -7.285 16.922 5.231 1.00 0.00 H ATOM 977 HZ3 LYS A1176 -6.505 17.622 6.568 1.00 0.00 H ATOM 978 H LYS A1176 -5.540 11.554 3.736 1.00 0.00 H ATOM 979 N PHE A1177 -5.327 11.513 0.504 1.00 13.65 N ATOM 980 CA PHE A1177 -5.189 11.032 -0.862 1.00 12.08 C ATOM 981 C PHE A1177 -6.537 10.612 -1.420 1.00 15.11 C ATOM 982 O PHE A1177 -6.829 10.847 -2.600 1.00 14.87 O ATOM 983 CB PHE A1177 -4.194 9.877 -0.915 1.00 13.18 C ATOM 984 CG PHE A1177 -2.771 10.290 -0.653 1.00 13.22 C ATOM 985 CD1 PHE A1177 -2.412 11.631 -0.541 1.00 13.23 C ATOM 986 CD2 PHE A1177 -1.778 9.345 -0.529 1.00 15.15 C ATOM 987 CE1 PHE A1177 -1.081 12.018 -0.302 1.00 16.01 C ATOM 988 CE2 PHE A1177 -0.467 9.726 -0.301 1.00 15.15 C ATOM 989 CZ PHE A1177 -0.120 11.087 -0.181 1.00 15.38 C ATOM 990 H PHE A1177 -4.885 10.983 1.282 1.00 0.00 H ATOM 991 N CYS A1178 -7.371 9.999 -0.579 1.00 13.71 N ATOM 992 CA CYS A1178 -8.711 9.638 -1.018 1.00 14.28 C ATOM 993 C CYS A1178 -9.491 10.875 -1.447 1.00 15.11 C ATOM 994 O CYS A1178 -10.190 10.861 -2.471 1.00 14.80 O ATOM 995 CB CYS A1178 -9.435 8.961 0.129 1.00 11.54 C ATOM 996 SG CYS A1178 -11.077 8.412 -0.345 1.00 13.26 S ATOM 997 H CYS A1178 -7.064 9.779 0.390 1.00 0.00 H ATOM 998 N SER A1179 -9.407 11.953 -0.671 1.00 14.31 N ATOM 999 CA SER A1179 -10.139 13.151 -1.063 1.00 15.24 C ATOM 1000 C SER A1179 -9.654 13.688 -2.403 1.00 15.94 C ATOM 1001 O SER A1179 -10.459 14.187 -3.199 1.00 15.44 O ATOM 1002 CB SER A1179 -10.049 14.210 0.046 1.00 14.99 C ATOM 1003 OG SER A1179 -10.786 13.777 1.182 1.00 14.90 O ATOM 1004 HG SER A1179 -10.725 14.462 1.894 1.00 0.00 H ATOM 1005 H SER A1179 -8.832 11.941 0.196 1.00 0.00 H ATOM 1006 N LYS A1180 -8.356 13.570 -2.688 1.00 13.55 N ATOM 1007 CA LYS A1180 -7.874 13.997 -3.997 1.00 13.64 C ATOM 1008 C LYS A1180 -8.446 13.132 -5.114 1.00 14.35 C ATOM 1009 O LYS A1180 -8.899 13.652 -6.135 1.00 15.00 O ATOM 1010 CB LYS A1180 -6.342 14.035 -4.038 1.00 17.63 C ATOM 1011 CG LYS A1180 -5.747 14.446 -5.403 1.00 22.85 C ATOM 1012 CD LYS A1180 -6.177 15.850 -5.848 1.00 27.72 C ATOM 1013 CE LYS A1180 -5.551 16.239 -7.191 1.00 31.98 C ATOM 1014 NZ LYS A1180 -4.073 16.314 -7.107 1.00 34.67 N ATOM 1015 HZ1 LYS A1180 -3.803 17.028 -6.401 1.00 0.00 H ATOM 1016 HZ2 LYS A1180 -3.695 15.387 -6.826 1.00 0.00 H ATOM 1017 HZ3 LYS A1180 -3.687 16.580 -8.036 1.00 0.00 H ATOM 1018 H LYS A1180 -7.696 13.179 -1.986 1.00 0.00 H ATOM 1019 N LEU A1181 -8.444 11.812 -4.938 1.00 13.63 N ATOM 1020 CA LEU A1181 -9.000 10.941 -5.965 1.00 12.06 C ATOM 1021 C LEU A1181 -10.492 11.202 -6.170 1.00 14.08 C ATOM 1022 O LEU A1181 -10.984 11.159 -7.304 1.00 14.26 O ATOM 1023 CB LEU A1181 -8.774 9.485 -5.567 1.00 13.10 C ATOM 1024 CG LEU A1181 -7.338 8.962 -5.478 1.00 15.25 C ATOM 1025 CD1 LEU A1181 -7.372 7.469 -5.217 1.00 16.96 C ATOM 1026 CD2 LEU A1181 -6.562 9.247 -6.742 1.00 15.76 C ATOM 1027 H LEU A1181 -8.046 11.403 -4.068 1.00 0.00 H ATOM 1028 N ALA A1182 -11.228 11.499 -5.089 1.00 12.40 N ATOM 1029 CA ALA A1182 -12.658 11.778 -5.233 1.00 12.15 C ATOM 1030 C ALA A1182 -12.894 13.046 -6.058 1.00 13.48 C ATOM 1031 O ALA A1182 -13.819 13.110 -6.879 1.00 12.56 O ATOM 1032 CB ALA A1182 -13.319 11.869 -3.855 1.00 13.09 C ATOM 1033 H ALA A1182 -10.783 11.531 -4.149 1.00 0.00 H ATOM 1034 N GLU A1183 -12.039 14.052 -5.884 1.00 14.73 N ATOM 1035 CA GLU A1183 -12.139 15.259 -6.688 1.00 15.21 C ATOM 1036 C GLU A1183 -11.865 14.946 -8.153 1.00 14.79 C ATOM 1037 O GLU A1183 -12.603 15.379 -9.044 1.00 14.59 O ATOM 1038 CB GLU A1183 -11.124 16.271 -6.166 1.00 15.68 C ATOM 1039 CG GLU A1183 -11.152 17.565 -6.958 1.00 18.23 C ATOM 1040 CD GLU A1183 -10.097 18.582 -6.554 1.00 25.24 C ATOM 1041 OE1 GLU A1183 -8.940 18.199 -6.309 1.00 26.06 O ATOM 1042 OE2 GLU A1183 -10.430 19.787 -6.505 1.00 28.94 O ATOM 1043 H GLU A1183 -11.292 13.973 -5.165 1.00 0.00 H ATOM 1044 N VAL A1184 -10.794 14.199 -8.418 1.00 14.81 N ATOM 1045 CA VAL A1184 -10.452 13.830 -9.789 1.00 15.33 C ATOM 1046 C VAL A1184 -11.558 12.988 -10.412 1.00 13.10 C ATOM 1047 O VAL A1184 -11.972 13.220 -11.555 1.00 14.64 O ATOM 1048 CB VAL A1184 -9.096 13.102 -9.822 1.00 16.22 C ATOM 1049 CG1 VAL A1184 -8.869 12.457 -11.193 1.00 18.03 C ATOM 1050 CG2 VAL A1184 -7.957 14.033 -9.464 1.00 16.99 C ATOM 1051 H VAL A1184 -10.191 13.873 -7.635 1.00 0.00 H ATOM 1052 N PHE A1185 -12.064 12.005 -9.669 1.00 13.49 N ATOM 1053 CA PHE A1185 -13.116 11.164 -10.224 1.00 13.96 C ATOM 1054 C PHE A1185 -14.368 11.975 -10.552 1.00 13.27 C ATOM 1055 O PHE A1185 -14.951 11.831 -11.632 1.00 14.12 O ATOM 1056 CB PHE A1185 -13.440 10.014 -9.278 1.00 13.03 C ATOM 1057 CG PHE A1185 -14.420 9.050 -9.838 1.00 13.46 C ATOM 1058 CD1 PHE A1185 -14.055 8.211 -10.876 1.00 15.32 C ATOM 1059 CD2 PHE A1185 -15.706 8.972 -9.330 1.00 13.93 C ATOM 1060 CE1 PHE A1185 -14.959 7.302 -11.402 1.00 15.24 C ATOM 1061 CE2 PHE A1185 -16.637 8.068 -9.851 1.00 15.08 C ATOM 1062 CZ PHE A1185 -16.256 7.227 -10.890 1.00 15.63 C ATOM 1063 H PHE A1185 -11.712 11.840 -8.704 1.00 0.00 H ATOM 1064 N GLU A1186 -14.798 12.840 -9.628 1.00 13.24 N ATOM 1065 CA GLU A1186 -15.961 13.676 -9.896 1.00 13.93 C ATOM 1066 C GLU A1186 -15.804 14.457 -11.194 1.00 15.12 C ATOM 1067 O GLU A1186 -16.732 14.515 -12.008 1.00 15.71 O ATOM 1068 CB GLU A1186 -16.136 14.644 -8.735 1.00 13.42 C ATOM 1069 CG GLU A1186 -17.034 15.819 -9.037 1.00 15.35 C ATOM 1070 CD GLU A1186 -17.065 16.786 -7.879 1.00 17.71 C ATOM 1071 OE1 GLU A1186 -17.363 16.349 -6.740 1.00 15.67 O ATOM 1072 OE2 GLU A1186 -16.755 17.974 -8.109 1.00 20.86 O ATOM 1073 H GLU A1186 -14.302 12.916 -8.717 1.00 0.00 H ATOM 1074 N GLN A1187 -14.623 15.050 -11.408 1.00 15.01 N ATOM 1075 CA GLN A1187 -14.367 15.834 -12.610 1.00 16.58 C ATOM 1076 C GLN A1187 -14.479 14.986 -13.862 1.00 16.60 C ATOM 1077 O GLN A1187 -15.046 15.425 -14.868 1.00 17.81 O ATOM 1078 CB GLN A1187 -12.955 16.409 -12.533 1.00 18.64 C ATOM 1079 CG GLN A1187 -12.773 17.474 -11.478 1.00 22.43 C ATOM 1080 CD GLN A1187 -11.313 17.756 -11.203 1.00 27.09 C ATOM 1081 OE1 GLN A1187 -10.430 17.313 -11.940 1.00 30.53 O ATOM 1082 NE2 GLN A1187 -11.048 18.498 -10.137 1.00 28.28 N ATOM 1083 HE22 GLN A1187 -11.825 18.851 -9.543 1.00 0.00 H ATOM 1084 HE21 GLN A1187 -10.063 18.727 -9.895 1.00 0.00 H ATOM 1085 H GLN A1187 -13.869 14.949 -10.699 1.00 0.00 H ATOM 1086 N GLU A1188 -13.921 13.777 -13.820 1.00 15.43 N ATOM 1087 CA GLU A1188 -13.849 12.930 -15.003 1.00 16.71 C ATOM 1088 C GLU A1188 -15.156 12.203 -15.292 1.00 14.99 C ATOM 1089 O GLU A1188 -15.509 12.000 -16.461 1.00 14.79 O ATOM 1090 CB GLU A1188 -12.703 11.934 -14.847 1.00 18.80 C ATOM 1091 CG GLU A1188 -11.321 12.601 -14.828 1.00 21.75 C ATOM 1092 CD GLU A1188 -11.044 13.450 -16.077 1.00 27.10 C ATOM 1093 OE1 GLU A1188 -11.444 13.042 -17.187 1.00 28.63 O ATOM 1094 OE2 GLU A1188 -10.428 14.531 -15.953 1.00 30.28 O ATOM 1095 H GLU A1188 -13.528 13.430 -12.922 1.00 0.00 H ATOM 1096 N ILE A1189 -15.896 11.831 -14.250 1.00 13.41 N ATOM 1097 CA ILE A1189 -17.051 10.968 -14.463 1.00 14.51 C ATOM 1098 C ILE A1189 -18.251 11.737 -15.011 1.00 14.84 C ATOM 1099 O ILE A1189 -19.048 11.178 -15.774 1.00 16.78 O ATOM 1100 CB ILE A1189 -17.364 10.188 -13.174 1.00 14.09 C ATOM 1101 CG1 ILE A1189 -18.299 9.007 -13.444 1.00 14.68 C ATOM 1102 CG2 ILE A1189 -17.973 11.122 -12.169 1.00 14.15 C ATOM 1103 CD1 ILE A1189 -17.708 7.996 -14.440 1.00 15.56 C ATOM 1104 H ILE A1189 -15.652 12.153 -13.292 1.00 0.00 H ATOM 1105 N ASP A1190 -18.421 13.015 -14.652 1.00 15.80 N ATOM 1106 CA ASP A1190 -19.648 13.680 -15.085 1.00 17.66 C ATOM 1107 C ASP A1190 -19.732 13.837 -16.594 1.00 18.40 C ATOM 1108 O ASP A1190 -20.790 13.526 -17.164 1.00 16.74 O ATOM 1109 CB ASP A1190 -19.898 14.993 -14.339 1.00 21.28 C ATOM 1110 CG ASP A1190 -21.167 15.676 -14.826 1.00 26.20 C ATOM 1111 OD1 ASP A1190 -22.263 15.100 -14.646 1.00 27.51 O ATOM 1112 OD2 ASP A1190 -21.072 16.759 -15.442 1.00 29.03 O ATOM 1113 H ASP A1190 -17.707 13.516 -14.086 1.00 0.00 H ATOM 1114 N PRO A1191 -18.702 14.314 -17.300 1.00 18.08 N ATOM 1115 CA PRO A1191 -18.826 14.374 -18.761 1.00 19.19 C ATOM 1116 C PRO A1191 -19.035 13.010 -19.390 1.00 17.24 C ATOM 1117 O PRO A1191 -19.750 12.906 -20.392 1.00 18.17 O ATOM 1118 CB PRO A1191 -17.522 15.049 -19.218 1.00 20.05 C ATOM 1119 CG PRO A1191 -16.628 15.041 -18.046 1.00 22.53 C ATOM 1120 CD PRO A1191 -17.482 14.992 -16.827 1.00 20.14 C ATOM 1121 N VAL A1192 -18.462 11.956 -18.801 1.00 16.23 N ATOM 1122 CA VAL A1192 -18.688 10.607 -19.301 1.00 19.07 C ATOM 1123 C VAL A1192 -20.141 10.191 -19.094 1.00 17.75 C ATOM 1124 O VAL A1192 -20.748 9.560 -19.966 1.00 19.98 O ATOM 1125 CB VAL A1192 -17.697 9.628 -18.645 1.00 19.00 C ATOM 1126 CG1 VAL A1192 -18.080 8.195 -18.970 1.00 21.90 C ATOM 1127 CG2 VAL A1192 -16.272 9.929 -19.109 1.00 19.97 C ATOM 1128 H VAL A1192 -17.847 12.101 -17.975 1.00 0.00 H ATOM 1129 N MET A1193 -20.721 10.519 -17.933 1.00 16.50 N ATOM 1130 CA MET A1193 -22.126 10.188 -17.706 1.00 19.38 C ATOM 1131 C MET A1193 -23.027 10.924 -18.689 1.00 20.07 C ATOM 1132 O MET A1193 -23.999 10.355 -19.209 1.00 23.96 O ATOM 1133 CB MET A1193 -22.525 10.504 -16.264 1.00 20.84 C ATOM 1134 CG MET A1193 -21.915 9.589 -15.230 1.00 22.77 C ATOM 1135 SD MET A1193 -22.221 7.829 -15.532 1.00 26.12 S ATOM 1136 CE MET A1193 -23.991 7.750 -15.312 1.00 30.77 C ATOM 1137 H MET A1193 -20.174 11.007 -17.196 1.00 0.00 H ATOM 1138 N GLN A1194 -22.714 12.192 -18.974 1.00 20.89 N ATOM 1139 CA GLN A1194 -23.490 12.939 -19.957 1.00 21.85 C ATOM 1140 C GLN A1194 -23.389 12.310 -21.339 1.00 23.29 C ATOM 1141 O GLN A1194 -24.331 12.406 -22.135 1.00 25.98 O ATOM 1142 CB GLN A1194 -23.012 14.393 -20.027 1.00 24.96 C ATOM 1143 CG GLN A1194 -23.073 15.146 -18.703 1.00 27.56 C ATOM 1144 CD GLN A1194 -24.404 14.983 -17.985 1.00 33.46 C ATOM 1145 OE1 GLN A1194 -25.469 15.130 -18.585 1.00 36.71 O ATOM 1146 NE2 GLN A1194 -24.346 14.673 -16.692 1.00 34.61 N ATOM 1147 HE22 GLN A1194 -23.424 14.558 -16.226 1.00 0.00 H ATOM 1148 HE21 GLN A1194 -25.223 14.545 -16.148 1.00 0.00 H ATOM 1149 H GLN A1194 -21.913 12.648 -18.492 1.00 0.00 H ATOM 1150 N SER A1195 -22.260 11.669 -21.643 1.00 22.73 N ATOM 1151 CA SER A1195 -22.085 11.039 -22.945 1.00 25.19 C ATOM 1152 C SER A1195 -22.783 9.690 -23.012 1.00 26.68 C ATOM 1153 O SER A1195 -23.200 9.272 -24.094 1.00 29.28 O ATOM 1154 CB SER A1195 -20.600 10.849 -23.248 1.00 25.78 C ATOM 1155 OG SER A1195 -20.073 9.761 -22.508 1.00 25.67 O ATOM 1156 HG SER A1195 -20.183 9.938 -21.540 1.00 0.00 H ATOM 1157 H SER A1195 -21.494 11.618 -20.941 1.00 0.00 H ATOM 1158 N LEU A1196 -22.905 8.996 -21.885 1.00 29.38 N ATOM 1159 CA LEU A1196 -23.563 7.693 -21.863 1.00 31.77 C ATOM 1160 C LEU A1196 -25.076 7.851 -21.844 1.00 35.09 C ATOM 1161 O LEU A1196 -25.803 6.969 -22.295 1.00 37.81 O ATOM 1162 CB LEU A1196 -23.102 6.870 -20.662 1.00 31.07 C ATOM 1163 CG LEU A1196 -21.670 6.332 -20.707 1.00 30.26 C ATOM 1164 CD1 LEU A1196 -21.220 5.877 -19.338 1.00 30.02 C ATOM 1165 CD2 LEU A1196 -21.558 5.184 -21.706 1.00 31.59 C ATOM 1166 H LEU A1196 -22.524 9.389 -21.001 1.00 0.00 H TER 1167 LEU A1196 HETATM 1168 O HOH 1 -2.054 -7.107 -4.306 1.00 41.00 O HETATM 1169 O HOH 2 5.109 6.257 -8.725 1.00 32.96 O HETATM 1170 O HOH 3 -21.046 7.473 -0.826 1.00 41.07 O HETATM 1171 O HOH 4 -9.783 1.494 2.670 1.00 13.65 O HETATM 1172 O HOH 5 -0.360 13.000 7.917 1.00 29.73 O HETATM 1173 O HOH 6 -27.078 -2.788 -19.475 1.00 34.93 O HETATM 1174 O HOH 7 -8.285 -8.968 -16.160 1.00 49.10 O HETATM 1175 O HOH 8 -23.159 5.699 -7.690 1.00 30.80 O HETATM 1176 O HOH 9 -21.033 2.891 -3.265 1.00 23.91 O HETATM 1177 O HOH 10 -2.940 -6.689 -1.997 1.00 28.57 O HETATM 1178 O HOH 11 -22.156 -5.027 -19.412 1.00 33.47 O HETATM 1179 O HOH 12 -10.575 13.825 -19.575 1.00 31.69 O HETATM 1180 O HOH 13 -3.855 5.254 7.595 1.00 16.75 O HETATM 1181 O HOH 14 -8.119 1.711 13.654 1.00 26.37 O HETATM 1182 O HOH 15 -26.512 -6.128 -13.002 1.00 41.29 O HETATM 1183 O HOH 16 -20.587 -1.394 -5.074 1.00 29.69 O HETATM 1184 O HOH 17 -8.148 -7.432 9.057 1.00 34.33 O HETATM 1185 O HOH 18 -11.877 8.571 9.823 1.00 37.67 O HETATM 1186 O HOH 19 -3.798 -1.989 -9.950 1.00 27.18 O HETATM 1187 O HOH 20 -10.247 -4.506 -2.637 1.00 20.30 O HETATM 1188 O HOH 21 -9.432 15.113 3.107 1.00 22.51 O HETATM 1189 O HOH 22 -8.945 0.758 -1.830 1.00 15.75 O HETATM 1190 O HOH 23 -0.355 15.885 -6.113 1.00 31.99 O HETATM 1191 O HOH 24 -16.540 17.676 -14.599 1.00 20.28 O HETATM 1192 O HOH 25 -17.232 -3.337 -19.168 1.00 29.80 O HETATM 1193 O HOH 26 3.686 9.926 -0.295 1.00 19.64 O HETATM 1194 O HOH 27 -1.246 13.732 -8.408 1.00 28.13 O HETATM 1195 O HOH 28 -16.616 -5.595 -1.578 1.00 27.46 O HETATM 1196 O HOH 29 -13.040 20.100 -9.195 1.00 31.14 O HETATM 1197 O HOH 30 -19.209 -4.531 -5.683 1.00 25.53 O HETATM 1198 O HOH 31 -11.338 -4.557 15.514 1.00 50.39 O HETATM 1199 O HOH 32 -11.184 -1.186 0.590 1.00 15.81 O HETATM 1200 O HOH 33 -21.570 -8.443 -19.213 1.00 41.96 O HETATM 1201 O HOH 34 -19.244 18.045 -5.678 1.00 18.31 O HETATM 1202 O HOH 35 -17.561 -1.392 6.477 1.00 27.65 O HETATM 1203 O HOH 36 -21.041 19.056 -13.932 1.00 29.97 O HETATM 1204 O HOH 37 -12.366 15.897 -2.180 1.00 21.77 O HETATM 1205 O HOH 38 -17.225 -0.149 10.492 1.00 30.66 O HETATM 1206 O HOH 39 -13.629 -10.578 -10.443 1.00 44.74 O HETATM 1207 O HOH 40 -6.437 -0.251 -1.598 1.00 15.73 O HETATM 1208 O HOH 41 -18.937 3.960 -24.852 1.00 35.89 O HETATM 1209 O HOH 42 -11.498 4.308 -24.005 1.00 23.59 O HETATM 1210 O HOH 43 -7.703 8.650 -18.842 1.00 33.13 O HETATM 1211 O HOH 44 -5.955 -8.493 0.899 1.00 32.18 O HETATM 1212 O HOH 45 -13.868 12.419 -18.659 1.00 28.17 O HETATM 1213 O HOH 46 -12.429 -2.017 -28.776 1.00 27.56 O HETATM 1214 O HOH 47 -6.739 -5.651 -12.126 1.00 28.77 O HETATM 1215 O HOH 48 -7.115 -7.523 -7.190 1.00 27.70 O HETATM 1216 O HOH 49 -18.802 -4.232 -17.262 1.00 31.00 O HETATM 1217 O HOH 50 1.844 15.112 -7.651 1.00 35.35 O HETATM 1218 O HOH 51 -11.149 10.297 -17.605 1.00 35.01 O HETATM 1219 O HOH 52 -11.320 19.616 -3.863 1.00 48.98 O HETATM 1220 O HOH 53 -26.429 1.603 -25.207 1.00 47.99 O HETATM 1221 O HOH 54 -21.341 -2.073 -7.807 1.00 21.24 O HETATM 1222 O HOH 55 -22.831 12.568 -13.592 1.00 22.69 O HETATM 1223 O HOH 56 -13.274 -6.910 -22.174 1.00 34.92 O HETATM 1224 O HOH 57 -9.182 -6.244 15.990 1.00 51.94 O HETATM 1225 O HOH 58 -23.875 -1.394 -7.173 1.00 29.84 O HETATM 1226 O HOH 59 -17.249 6.409 4.730 1.00 28.27 O HETATM 1227 O HOH 60 -8.881 -5.586 1.177 1.00 21.78 O HETATM 1228 O HOH 61 5.788 8.350 -5.406 1.00 33.09 O HETATM 1229 O HOH 62 -17.258 -1.658 3.581 1.00 18.82 O HETATM 1230 O HOH 63 3.678 3.917 6.581 1.00 27.93 O HETATM 1231 O HOH 64 -10.640 1.552 0.086 1.00 13.89 O HETATM 1232 O HOH 65 -3.046 6.879 -18.289 1.00 41.26 O HETATM 1233 O HOH 66 1.023 1.091 -4.892 1.00 20.75 O HETATM 1234 O HOH 67 0.921 12.548 -10.220 1.00 46.90 O HETATM 1235 O HOH 68 -27.853 3.413 -16.550 1.00 36.22 O HETATM 1236 O HOH 69 -2.138 -0.353 -2.957 1.00 18.66 O HETATM 1237 O HOH 70 -12.213 3.678 11.724 1.00 31.89 O HETATM 1238 O HOH 71 -5.085 6.424 9.831 1.00 17.03 O HETATM 1239 O HOH 72 -3.321 -1.691 -0.801 1.00 23.62 O HETATM 1240 O HOH 73 -6.655 16.175 -0.302 1.00 30.45 O HETATM 1241 O HOH 74 2.838 -0.798 7.149 1.00 37.19 O HETATM 1242 O HOH 75 -17.423 19.540 -10.454 1.00 24.87 O HETATM 1243 O HOH 76 -14.358 8.497 -21.478 1.00 25.98 O HETATM 1244 O HOH 77 -14.305 -7.642 5.695 1.00 29.93 O HETATM 1245 O HOH 78 -13.364 -7.057 -2.885 1.00 35.05 O HETATM 1246 O HOH 79 -13.426 11.491 9.431 1.00 31.89 O HETATM 1247 O HOH 80 -19.946 9.166 2.718 1.00 33.16 O HETATM 1248 O HOH 81 2.344 1.184 3.855 1.00 24.13 O HETATM 1249 O HOH 82 -19.407 14.083 -10.859 1.00 14.91 O HETATM 1250 O HOH 83 -19.426 -5.287 -25.959 1.00 27.22 O HETATM 1251 O HOH 84 -17.856 2.127 3.309 1.00 21.61 O HETATM 1252 O HOH 85 3.915 3.522 -10.698 1.00 37.02 O HETATM 1253 O HOH 86 -9.152 -3.205 -0.509 1.00 16.53 O HETATM 1254 O HOH 87 -15.747 -5.616 -23.299 1.00 27.63 O HETATM 1255 O HOH 88 -17.284 -7.486 -6.525 1.00 33.18 O HETATM 1256 O HOH 89 -1.997 -3.530 0.827 1.00 25.21 O HETATM 1257 O HOH 90 -10.730 -5.812 -21.541 1.00 35.70 O HETATM 1258 O HOH 91 -7.928 -6.341 -14.950 1.00 32.38 O HETATM 1259 O HOH 92 -21.089 -4.555 -8.842 1.00 30.74 O HETATM 1260 O HOH 93 -20.266 3.170 -0.462 1.00 29.56 O HETATM 1261 O HOH 94 -20.039 -1.488 3.027 1.00 30.73 O HETATM 1262 O HOH 95 -10.264 10.794 12.196 1.00 20.34 O HETATM 1263 O HOH 96 -4.431 -10.265 5.388 1.00 34.19 O HETATM 1264 O HOH 97 -3.839 5.500 -20.438 1.00 44.64 O HETATM 1265 O HOH 98 -26.041 4.775 -15.019 1.00 30.09 O HETATM 1266 O HOH 99 -8.692 -4.941 -21.926 1.00 44.07 O HETATM 1267 O HOH 100 -3.346 18.165 -4.175 1.00 42.22 O HETATM 1268 O HOH 101 -26.296 -1.066 -4.916 1.00 29.66 O HETATM 1269 O HOH 102 6.990 4.917 -0.215 1.00 25.54 O HETATM 1270 O HOH 103 3.696 1.403 6.043 1.00 38.55 O HETATM 1271 O HOH 104 6.010 6.746 1.650 1.00 28.37 O HETATM 1272 O HOH 105 -6.841 -6.604 15.503 1.00 34.69 O HETATM 1273 O HOH 106 -5.590 4.532 11.697 1.00 25.14 O HETATM 1274 O HOH 107 -2.725 3.380 9.227 1.00 21.00 O HETATM 1275 O HOH 108 -18.530 18.176 -12.555 1.00 27.46 O HETATM 1276 O HOH 109 -10.777 -7.085 -2.449 1.00 24.45 O HETATM 1277 O HOH 110 -20.143 16.644 -11.129 1.00 17.30 O HETATM 1278 O HOH 111 -12.876 10.322 -20.017 1.00 28.90 O HETATM 1279 O HOH 112 -6.459 -9.664 8.114 1.00 32.98 O HETATM 1280 O HOH 113 -9.945 2.704 -22.339 1.00 30.80 O HETATM 1281 O HOH 114 -15.968 8.194 -23.712 1.00 40.65 O HETATM 1282 O HOH 115 3.301 -0.625 1.968 1.00 29.69 O HETATM 1283 O HOH 116 -8.285 17.346 1.616 1.00 26.71 O HETATM 1284 O HOH 117 -21.686 -0.785 -2.846 1.00 31.24 O HETATM 1285 O HOH 118 -26.659 6.517 -13.629 1.00 32.98 O HETATM 1286 O HOH 119 8.186 8.824 -6.645 1.00 32.40 O HETATM 1287 O HOH 120 0.181 -2.139 -3.061 1.00 41.13 O HETATM 1288 O HOH 121 -9.920 -7.865 0.023 1.00 25.35 O HETATM 1289 O HOH 122 -21.741 -5.340 -5.442 1.00 33.07 O HETATM 1290 O HOH 123 6.922 5.871 -5.139 1.00 34.89 O HETATM 1291 O HOH 124 3.498 1.975 -3.440 1.00 27.95 O HETATM 1292 O HOH 125 -8.052 -9.712 -0.315 1.00 41.44 O HETATM 1293 O HOH 126 -18.761 -4.186 -28.606 1.00 32.02 O HETATM 1294 O HOH 127 -8.967 -4.344 17.565 1.00 43.95 O HETATM 1295 O HOH 128 -19.336 1.716 9.885 1.00 37.49 O HETATM 1296 O HOH 129 -4.944 18.058 -2.265 1.00 33.39 O HETATM 1297 O HOH 130 -28.709 -1.339 -4.379 1.00 47.85 O HETATM 1298 O HOH 131 2.743 -1.884 -2.429 1.00 41.20 O HETATM 1299 O HOH 132 -22.305 -9.273 11.563 1.00 54.10 O HETATM 1300 O HOH 133 5.653 -0.301 4.038 1.00 34.16 O HETATM 1301 C14 UNN A 134 0.049 3.115 6.467 1.00 0.00 C HETATM 1302 C13 UNN A 134 -1.075 2.091 6.475 1.00 0.08 C HETATM 1303 C18 UNN A 134 -0.617 0.817 7.160 1.00 0.00 C HETATM 1304 C17 UNN A 134 -0.045 1.154 8.515 1.00 0.05 C HETATM 1305 O16 UNN A 134 1.052 2.061 8.407 1.00 -0.38 O HETATM 1306 C15 UNN A 134 0.616 3.298 7.856 1.00 0.05 C HETATM 1307 H12 UNN A 134 -0.162 3.725 8.506 1.00 0.06 H HETATM 1308 H13 UNN A 134 1.471 3.988 7.805 1.00 0.06 H HETATM 1309 H14 UNN A 134 0.302 0.228 8.997 1.00 0.06 H HETATM 1310 H15 UNN A 134 -0.831 1.615 9.131 1.00 0.06 H HETATM 1311 H16 UNN A 134 0.155 0.328 6.547 1.00 0.03 H HETATM 1312 H17 UNN A 134 -1.474 0.138 7.282 1.00 0.03 H HETATM 1313 N12 UNN A 134 -1.513 1.800 5.097 1.00 -0.22 N HETATM 1314 C8 UNN A 134 -2.767 1.709 4.608 1.00 0.06 C HETATM 1315 C7 UNN A 134 -4.059 1.871 5.341 1.00 0.02 C HETATM 1316 C6 UNN A 134 -5.151 1.170 4.550 1.00 0.05 C HETATM 1317 N5 UNN A 134 -5.089 1.535 3.132 1.00 -0.25 N HETATM 1318 C3 UNN A 134 -6.175 2.050 2.496 1.00 0.26 C HETATM 1319 N2 UNN A 134 -6.091 2.179 1.169 1.00 -0.28 N HETATM 1320 C1 UNN A 134 -7.227 2.649 0.398 1.00 0.02 C HETATM 1321 H9 UNN A 134 -6.957 2.685 -0.668 1.00 0.05 H HETATM 1322 H10 UNN A 134 -7.510 3.656 0.739 1.00 0.05 H HETATM 1323 H11 UNN A 134 -8.075 1.962 0.538 1.00 0.05 H HETATM 1324 H8 UNN A 134 -5.237 1.949 0.702 1.00 0.18 H HETATM 1325 O4 UNN A 134 -7.185 2.348 3.114 1.00 -0.40 O HETATM 1326 C38 UNN A 134 -3.859 1.252 2.395 1.00 0.05 C HETATM 1327 C9 UNN A 134 -2.657 1.428 3.279 1.00 0.01 C HETATM 1328 C10 UNN A 134 -1.225 1.368 3.027 1.00 0.10 C HETATM 1329 N11 UNN A 134 -0.559 1.576 4.128 1.00 -0.23 N HETATM 1330 N19 UNN A 134 -0.615 1.204 1.791 1.00 -0.27 N HETATM 1331 C20 UNN A 134 -0.925 0.035 0.950 1.00 0.04 C HETATM 1332 C21 UNN A 134 0.274 -0.340 0.123 1.00 -0.02 C HETATM 1333 C22 UNN A 134 0.666 0.808 -0.767 1.00 -0.02 C HETATM 1334 C23 UNN A 134 0.732 2.107 -0.004 1.00 -0.03 C HETATM 1335 C24 UNN A 134 0.028 2.308 1.190 1.00 0.05 C HETATM 1336 C25 UNN A 134 0.040 3.561 1.798 1.00 -0.04 C HETATM 1337 C26 UNN A 134 0.770 4.620 1.264 1.00 0.01 C HETATM 1338 C27 UNN A 134 1.502 4.411 0.088 1.00 -0.04 C HETATM 1339 C28 UNN A 134 1.471 3.163 -0.535 1.00 -0.08 C HETATM 1340 H25 UNN A 134 2.033 3.012 -1.450 1.00 0.05 H HETATM 1341 C29 UNN A 134 2.340 5.475 -0.516 1.00 -0.01 C HETATM 1342 C30 UNN A 134 2.044 6.832 -0.741 1.00 0.00 C HETATM 1343 N31 UNN A 134 3.055 7.478 -1.294 1.00 -0.22 N HETATM 1344 N32 UNN A 134 4.009 6.532 -1.441 1.00 -0.21 N HETATM 1345 C33 UNN A 134 3.623 5.333 -0.991 1.00 0.06 C HETATM 1346 H27 UNN A 134 4.213 4.418 -0.999 1.00 0.10 H HETATM 1347 C34 UNN A 134 5.291 6.894 -2.032 1.00 0.06 C HETATM 1348 H28 UNN A 134 5.285 7.962 -2.296 1.00 0.06 H HETATM 1349 H29 UNN A 134 5.460 6.293 -2.938 1.00 0.06 H HETATM 1350 H30 UNN A 134 6.096 6.700 -1.308 1.00 0.06 H HETATM 1351 H26 UNN A 134 1.092 7.296 -0.488 1.00 0.07 H HETATM 1352 C35 UNN A 134 0.734 5.943 2.021 1.00 0.27 C HETATM 1353 F36 UNN A 134 0.276 5.729 3.284 1.00 -0.20 F HETATM 1354 F37 UNN A 134 -0.167 6.785 1.452 1.00 -0.20 F HETATM 1355 H31 UNN A 134 1.737 6.395 2.037 1.00 0.12 H HETATM 1356 H24 UNN A 134 -0.531 3.715 2.706 1.00 0.04 H HETATM 1357 H22 UNN A 134 -0.077 0.905 -1.572 1.00 0.04 H HETATM 1358 H23 UNN A 134 1.654 0.600 -1.203 1.00 0.04 H HETATM 1359 H20 UNN A 134 0.029 -1.215 -0.498 1.00 0.03 H HETATM 1360 H21 UNN A 134 1.113 -0.587 0.790 1.00 0.03 H HETATM 1361 H18 UNN A 134 -1.202 -0.813 1.594 1.00 0.06 H HETATM 1362 H19 UNN A 134 -1.765 0.279 0.283 1.00 0.06 H HETATM 1363 H32 UNN A 134 -3.889 0.215 2.028 1.00 0.06 H HETATM 1364 H33 UNN A 134 -3.783 1.941 1.541 1.00 0.06 H HETATM 1365 H3 UNN A 134 -6.132 1.462 4.954 1.00 0.05 H HETATM 1366 H4 UNN A 134 -5.024 0.082 4.647 1.00 0.05 H HETATM 1367 H5 UNN A 134 -3.978 1.421 6.341 1.00 0.05 H HETATM 1368 H6 UNN A 134 -4.299 2.940 5.439 1.00 0.05 H HETATM 1369 H7 UNN A 134 -1.926 2.506 7.035 1.00 0.07 H HETATM 1370 H1 UNN A 134 -0.343 4.078 6.107 1.00 0.03 H HETATM 1371 H2 UNN A 134 0.847 2.769 5.794 1.00 0.03 H CONECT 1 2 13 14 15 CONECT 13 1 CONECT 14 1 CONECT 15 1 CONECT 1301 1302 1306 1370 1371 CONECT 1302 1301 1303 1313 1369 CONECT 1303 1302 1304 1311 1312 CONECT 1304 1303 1305 1309 1310 CONECT 1305 1304 1306 CONECT 1306 1301 1305 1307 1308 CONECT 1307 1306 CONECT 1308 1306 CONECT 1309 1304 CONECT 1310 1304 CONECT 1311 1303 CONECT 1312 1303 CONECT 1313 1302 1314 1329 CONECT 1314 1313 1315 1327 CONECT 1315 1314 1316 1367 1368 CONECT 1316 1315 1317 1365 1366 CONECT 1317 1316 1318 1326 CONECT 1318 1317 1319 1325 CONECT 1319 1318 1320 1324 CONECT 1320 1319 1321 1322 1323 CONECT 1321 1320 CONECT 1322 1320 CONECT 1323 1320 CONECT 1324 1319 CONECT 1325 1318 CONECT 1326 1317 1327 1363 1364 CONECT 1327 1314 1326 1328 CONECT 1328 1327 1329 1330 CONECT 1329 1313 1328 CONECT 1330 1328 1331 1335 CONECT 1331 1330 1332 1361 1362 CONECT 1332 1331 1333 1359 1360 CONECT 1333 1332 1334 1357 1358 CONECT 1334 1333 1335 1339 CONECT 1335 1330 1334 1336 CONECT 1336 1335 1337 1356 CONECT 1337 1336 1338 1352 CONECT 1338 1337 1339 1341 CONECT 1339 1334 1338 1340 CONECT 1340 1339 CONECT 1341 1338 1342 1345 CONECT 1342 1341 1343 1351 CONECT 1343 1342 1344 CONECT 1344 1343 1345 1347 CONECT 1345 1341 1344 1346 CONECT 1346 1345 CONECT 1347 1344 1348 1349 1350 CONECT 1348 1347 CONECT 1349 1347 CONECT 1350 1347 CONECT 1351 1342 CONECT 1352 1337 1353 1354 1355 CONECT 1353 1352 CONECT 1354 1352 CONECT 1355 1352 CONECT 1356 1336 CONECT 1357 1333 CONECT 1358 1333 CONECT 1359 1332 CONECT 1360 1332 CONECT 1361 1331 CONECT 1362 1331 CONECT 1363 1326 CONECT 1364 1326 CONECT 1365 1316 CONECT 1366 1316 CONECT 1367 1315 CONECT 1368 1315 CONECT 1369 1302 CONECT 1370 1301 CONECT 1371 1301 MASTER 0 0 0 0 0 0 0 0 1370 1 75 9 END
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Related entries of code: 5w0e
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
2l84
RCSB PDB
PDBbind
121aa, >2L84_1|Chain... at 96%
3p1d
RCSB PDB
PDBbind
119aa, >3P1D_1|Chains... at 98%
4tqn
RCSB PDB
PDBbind
119aa, >4TQN_1|Chain... at 98%
4yk0
RCSB PDB
PDBbind
114aa, >4YK0_1|Chains... at 100%
5dbm
RCSB PDB
PDBbind
118aa, >5DBM_1|Chains... at 98%
5eng
RCSB PDB
PDBbind
119aa, >5ENG_1|Chain... at 98%
5ep7
RCSB PDB
PDBbind
119aa, >5EP7_1|Chain... at 98%
5h85
RCSB PDB
PDBbind
119aa, >5H85_1|Chain... at 98%
5i83
RCSB PDB
PDBbind
118aa, >5I83_1|Chain... at 98%
5i86
RCSB PDB
PDBbind
118aa, >5I86_1|Chains... at 98%
5i89
RCSB PDB
PDBbind
118aa, >5I89_1|Chain... at 98%
5i8b
RCSB PDB
PDBbind
264aa, >5I8B_1|Chain... *
5i8g
RCSB PDB
PDBbind
264aa, >5I8G_1|Chain... at 100%
5j0d
RCSB PDB
PDBbind
119aa, >5J0D_1|Chain... at 98%
5ktu
RCSB PDB
PDBbind
118aa, >5KTU_1|Chains... at 98%
5ktw
RCSB PDB
PDBbind
114aa, >5KTW_1|Chains... at 97%
5ktx
RCSB PDB
PDBbind
114aa, >5KTX_1|Chain... at 97%
5lpj
RCSB PDB
PDBbind
119aa, >5LPJ_1|Chain... at 98%
5lpk
RCSB PDB
PDBbind
122aa, >5LPK_1|Chains... at 92%
5lpl
RCSB PDB
PDBbind
119aa, >5LPL_1|Chain... at 98%
5lpm
RCSB PDB
PDBbind
116aa, >5LPM_1|Chains... at 94%
5mme
RCSB PDB
PDBbind
119aa, >5MME_1|Chains... at 98%
5mmg
RCSB PDB
PDBbind
119aa, >5MMG_1|Chain... at 98%
5mpk
RCSB PDB
PDBbind
119aa, >5MPK_1|Chains... at 98%
5mpn
RCSB PDB
PDBbind
119aa, >5MPN_1|Chain... at 98%
5mpz
RCSB PDB
PDBbind
119aa, >5MPZ_1|Chain... at 98%
5mqe
RCSB PDB
PDBbind
119aa, >5MQE_1|Chains... at 98%
5nlk
RCSB PDB
PDBbind
119aa, >5NLK_1|Chain... at 98%
5nu3
RCSB PDB
PDBbind
119aa, >5NU3_1|Chain... at 98%
5nu5
RCSB PDB
PDBbind
116aa, >5NU5_1|Chains... at 94%
5tb6
RCSB PDB
PDBbind
119aa, >5TB6_1|Chain... at 98%
5w0f
RCSB PDB
PDBbind
148aa, >5W0F_1|Chain... at 100%
5w0i
RCSB PDB
PDBbind
148aa, >5W0I_1|Chain... at 100%
5w0l
RCSB PDB
PDBbind
148aa, >5W0L_1|Chains... at 100%
5w0q
RCSB PDB
PDBbind
148aa, >5W0Q_1|Chain... at 100%
6axq
RCSB PDB
PDBbind
114aa, >6AXQ_1|Chains... at 98%
6ay3
RCSB PDB
PDBbind
115aa, >6AY3_1|Chains... at 100%
6ay5
RCSB PDB
PDBbind
115aa, >6AY5_1|Chain... at 100%
6fqo
RCSB PDB
PDBbind
119aa, >6FQO_1|Chains... at 98%
6fqu
RCSB PDB
PDBbind
119aa, >6FQU_1|Chain... at 98%
6fr0
RCSB PDB
PDBbind
119aa, >6FR0_1|Chains... at 98%
6frf
RCSB PDB
PDBbind
119aa, >6FRF_1|Chains... at 98%
6alc
RCSB PDB
PDBbind
114aa, >6ALC_1|Chains... at 97%
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
5w0e
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
CBP bromodomain
Ligand Name
9U4
EC.Number
E.C. 2.3.1.48
Resolution
1.41(Å)
Affinity (Kd/Ki/IC50)
IC50=0.94nM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 10151-10171
Ligand Properties
Formula
C
2
7
H
3
3
F
2
N
7
O
2
Molecular Weight
525.593
Exact Mass
525.266
No. of atoms
71
No. of bonds
76
Polar Surface Area
80.45
LOGP Value
2.70 (
Computed with XLOGP3
)
4.75 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 6
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 6
Canonical SMILES
CNC(=O)N1CCc2c(C1)c(nn2C1CCOCC1)N1CCCc2c1cc(C(F)F)c(c2)c1cnn(c1)C
InChI String
InChI=1S/C27H33F2N7O2/c1-30-27(37)34-9-5-23-22(16-34)26(32-36(23)19-6-10-38-11-7-19)35-8-3-4-17-12-20(18-14-31-33(2)15-18)21(25(28)29)13-24(17)35/h12-15,19,25H,3-11,16H2,1-2H3,(H,30,37)
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):
Q92793
Entrez Gene ID
NCBI Entrez Gene ID:
1387
ASD
Information of known allosteric effects of PDB entries
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