Browse entries in the PDBbind-CN Database
HEADER 5TB6_COMPLEX COMPND 5TB6_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 119 SER MET ARG LYS LYS ILE PHE LYS PRO GLU GLU LEU ARG SEQRES 2 A 119 GLN ALA LEU MET PRO THR LEU GLU ALA LEU TYR ARG GLN SEQRES 3 A 119 ASP PRO GLU SER LEU PRO PHE ARG GLN PRO VAL ASP PRO SEQRES 4 A 119 GLN LEU LEU GLY ILE PRO ASP TYR PHE ASP ILE VAL LYS SEQRES 5 A 119 ASN PRO MET ASP LEU SER THR ILE LYS ARG LYS LEU ASP SEQRES 6 A 119 THR GLY GLN TYR GLN GLU PRO TRP GLN TYR VAL ASP ASP SEQRES 7 A 119 VAL TRP LEU MET PHE ASN ASN ALA TRP LEU TYR ASN ARG SEQRES 8 A 119 LYS THR SER ARG VAL TYR LYS PHE CYS SER LYS LEU ALA SEQRES 9 A 119 GLU VAL PHE GLU GLN GLU ILE ASP PRO VAL MET GLN SER SEQRES 10 A 119 LEU GLY HET UNN A 277 36 ATOM 1 N SER A1079 25.359 41.919 12.292 1.00 45.32 N ATOM 2 CA SER A1079 25.970 42.187 10.950 1.00 55.16 C ATOM 3 C SER A1079 25.649 41.129 9.851 1.00 57.34 C ATOM 4 O SER A1079 25.762 41.416 8.648 1.00 55.96 O ATOM 5 CB SER A1079 27.484 42.357 11.101 1.00 56.93 C ATOM 6 HN3 SER A1079 25.701 41.005 12.651 1.00 0.00 H ATOM 7 HN2 SER A1079 24.323 41.891 12.201 1.00 0.00 H ATOM 8 HN1 SER A1079 25.630 42.676 12.952 1.00 0.00 H ATOM 9 N MET A1080 25.265 39.916 10.268 1.00 54.95 N ATOM 10 CA MET A1080 24.856 38.825 9.346 1.00 50.17 C ATOM 11 C MET A1080 23.525 39.160 8.633 1.00 45.81 C ATOM 12 O MET A1080 22.773 40.027 9.104 1.00 46.58 O ATOM 13 CB MET A1080 24.713 37.486 10.117 1.00 46.51 C ATOM 14 CG MET A1080 23.689 37.492 11.305 1.00 47.61 C ATOM 15 SD MET A1080 23.204 35.832 11.928 1.00 47.34 S ATOM 16 CE MET A1080 22.230 36.216 13.385 1.00 58.10 C ATOM 17 H MET A1080 25.252 39.728 11.291 1.00 0.00 H ATOM 18 N ARG A1081 23.228 38.482 7.519 1.00 39.70 N ATOM 19 CA ARG A1081 21.950 38.668 6.808 1.00 40.50 C ATOM 20 C ARG A1081 20.807 37.936 7.525 1.00 37.11 C ATOM 21 O ARG A1081 20.983 36.833 8.043 1.00 31.75 O ATOM 22 CB ARG A1081 22.050 38.212 5.338 1.00 41.15 C ATOM 23 CG ARG A1081 22.751 39.237 4.448 1.00 48.21 C ATOM 24 CD ARG A1081 22.753 38.910 2.942 1.00 41.58 C ATOM 25 NE ARG A1081 23.451 39.977 2.232 1.00 37.86 N ATOM 26 CZ ARG A1081 24.746 39.975 1.938 1.00 27.33 C ATOM 27 NH1 ARG A1081 25.264 41.022 1.323 1.00 41.42 N ATOM 28 NH2 ARG A1081 25.521 38.937 2.249 1.00 18.95 N ATOM 29 HE ARG A1081 22.892 40.802 1.934 1.00 0.00 H ATOM 30 HH12 ARG A1081 26.276 41.037 1.085 1.00 0.00 H ATOM 31 HH11 ARG A1081 24.660 41.832 1.076 1.00 0.00 H ATOM 32 HH22 ARG A1081 26.533 38.954 2.011 1.00 0.00 H ATOM 33 HH21 ARG A1081 25.114 38.110 2.730 1.00 0.00 H ATOM 34 H ARG A1081 23.920 37.803 7.143 1.00 0.00 H ATOM 35 N LYS A1082 19.634 38.550 7.564 1.00 30.37 N ATOM 36 CA LYS A1082 18.508 37.933 8.266 1.00 32.83 C ATOM 37 C LYS A1082 17.277 38.012 7.395 1.00 23.79 C ATOM 38 O LYS A1082 17.151 38.930 6.580 1.00 30.11 O ATOM 39 CB LYS A1082 18.234 38.658 9.593 1.00 31.22 C ATOM 40 CG LYS A1082 19.119 38.233 10.740 1.00 42.57 C ATOM 41 CD LYS A1082 19.111 39.246 11.881 1.00 55.81 C ATOM 42 CE LYS A1082 19.676 38.645 13.184 1.00 57.46 C ATOM 43 NZ LYS A1082 20.559 39.610 13.902 1.00 26.58 N ATOM 44 HZ1 LYS A1082 21.358 39.870 13.288 1.00 0.00 H ATOM 45 HZ2 LYS A1082 20.014 40.462 14.144 1.00 0.00 H ATOM 46 HZ3 LYS A1082 20.918 39.168 14.772 1.00 0.00 H ATOM 47 H LYS A1082 19.513 39.471 7.096 1.00 0.00 H ATOM 48 N LYS A1083 16.365 37.065 7.609 1.00 16.05 N ATOM 49 CA LYS A1083 15.058 37.085 6.959 1.00 19.09 C ATOM 50 C LYS A1083 15.186 37.237 5.445 1.00 20.01 C ATOM 51 O LYS A1083 14.602 38.144 4.826 1.00 16.73 O ATOM 52 CB LYS A1083 14.215 38.224 7.547 1.00 22.86 C ATOM 53 CG LYS A1083 13.993 38.116 9.060 1.00 25.33 C ATOM 54 CD LYS A1083 13.199 39.325 9.550 1.00 38.68 C ATOM 55 CE LYS A1083 13.135 39.365 11.067 1.00 49.28 C ATOM 56 NZ LYS A1083 12.184 40.407 11.536 1.00 49.98 N ATOM 57 HZ1 LYS A1083 12.494 41.338 11.191 1.00 0.00 H ATOM 58 HZ2 LYS A1083 11.234 40.198 11.168 1.00 0.00 H ATOM 59 HZ3 LYS A1083 12.161 40.411 12.576 1.00 0.00 H ATOM 60 H LYS A1083 16.591 36.286 8.260 1.00 0.00 H ATOM 61 N ILE A1084 15.960 36.342 4.846 1.00 14.82 N ATOM 62 CA ILE A1084 16.162 36.419 3.395 1.00 9.96 C ATOM 63 C ILE A1084 14.987 35.851 2.615 1.00 12.41 C ATOM 64 O ILE A1084 14.766 36.226 1.472 1.00 12.18 O ATOM 65 CB ILE A1084 17.482 35.783 2.935 1.00 12.20 C ATOM 66 CG1 ILE A1084 17.412 34.250 3.069 1.00 13.03 C ATOM 67 CG2 ILE A1084 18.683 36.465 3.648 1.00 18.58 C ATOM 68 CD1 ILE A1084 18.566 33.449 2.374 1.00 15.46 C ATOM 69 H ILE A1084 16.420 35.592 5.400 1.00 0.00 H ATOM 70 N PHE A1085 14.277 34.910 3.235 1.00 11.64 N ATOM 71 CA PHE A1085 13.078 34.312 2.673 1.00 9.43 C ATOM 72 C PHE A1085 11.804 35.061 3.065 1.00 12.61 C ATOM 73 O PHE A1085 11.668 35.551 4.193 1.00 13.22 O ATOM 74 CB PHE A1085 12.976 32.846 3.084 1.00 15.70 C ATOM 75 CG PHE A1085 14.119 32.007 2.591 1.00 15.31 C ATOM 76 CD1 PHE A1085 14.151 31.571 1.264 1.00 14.12 C ATOM 77 CD2 PHE A1085 15.122 31.592 3.452 1.00 15.36 C ATOM 78 CE1 PHE A1085 15.209 30.783 0.794 1.00 20.70 C ATOM 79 CE2 PHE A1085 16.177 30.817 2.988 1.00 17.56 C ATOM 80 CZ PHE A1085 16.221 30.411 1.644 1.00 17.30 C ATOM 81 H PHE A1085 14.597 34.586 4.170 1.00 0.00 H ATOM 82 N LYS A1086 10.882 35.141 2.118 1.00 12.70 N ATOM 83 CA LYS A1086 9.528 35.605 2.412 1.00 14.03 C ATOM 84 C LYS A1086 8.825 34.531 3.224 1.00 13.25 C ATOM 85 O LYS A1086 9.033 33.316 2.987 1.00 13.24 O ATOM 86 CB LYS A1086 8.746 35.867 1.134 1.00 16.39 C ATOM 87 CG LYS A1086 9.314 37.040 0.319 1.00 11.27 C ATOM 88 CD LYS A1086 8.569 37.215 -1.010 1.00 19.02 C ATOM 89 CE LYS A1086 9.369 38.069 -1.975 1.00 20.09 C ATOM 90 NZ LYS A1086 8.546 38.527 -3.107 1.00 22.44 N ATOM 91 HZ1 LYS A1086 8.180 37.702 -3.624 1.00 0.00 H ATOM 92 HZ2 LYS A1086 7.751 39.094 -2.749 1.00 0.00 H ATOM 93 HZ3 LYS A1086 9.128 39.108 -3.744 1.00 0.00 H ATOM 94 H LYS A1086 11.127 34.868 1.145 1.00 0.00 H ATOM 95 N PRO A1087 7.961 34.957 4.158 1.00 10.66 N ATOM 96 CA PRO A1087 7.177 33.945 4.873 1.00 11.38 C ATOM 97 C PRO A1087 6.398 33.005 3.982 1.00 13.24 C ATOM 98 O PRO A1087 6.287 31.813 4.284 1.00 10.18 O ATOM 99 CB PRO A1087 6.240 34.789 5.722 1.00 15.10 C ATOM 100 CG PRO A1087 7.039 36.010 6.019 1.00 16.87 C ATOM 101 CD PRO A1087 7.782 36.291 4.761 1.00 12.86 C ATOM 102 N GLU A1088 5.895 33.516 2.865 1.00 10.70 N ATOM 103 CA GLU A1088 5.166 32.680 1.923 1.00 12.98 C ATOM 104 C GLU A1088 6.080 31.666 1.182 1.00 14.94 C ATOM 105 O GLU A1088 5.609 30.621 0.757 1.00 9.76 O ATOM 106 CB GLU A1088 4.365 33.563 0.966 1.00 12.78 C ATOM 107 CG GLU A1088 3.366 34.472 1.677 1.00 17.08 C ATOM 108 CD GLU A1088 3.949 35.761 2.223 1.00 17.95 C ATOM 109 OE1 GLU A1088 5.164 35.975 2.015 1.00 13.41 O ATOM 110 OE2 GLU A1088 3.182 36.572 2.848 1.00 19.46 O ATOM 111 H GLU A1088 6.024 34.528 2.660 1.00 0.00 H ATOM 112 N GLU A1089 7.373 31.967 1.021 1.00 13.14 N ATOM 113 CA GLU A1089 8.318 30.999 0.432 1.00 15.68 C ATOM 114 C GLU A1089 8.587 29.887 1.427 1.00 13.48 C ATOM 115 O GLU A1089 8.654 28.712 1.053 1.00 12.03 O ATOM 116 CB GLU A1089 9.641 31.657 0.018 1.00 15.22 C ATOM 117 CG GLU A1089 9.513 32.573 -1.218 1.00 12.42 C ATOM 118 CD GLU A1089 10.759 33.402 -1.490 1.00 21.58 C ATOM 119 OE1 GLU A1089 11.425 33.864 -0.547 1.00 14.85 O ATOM 120 OE2 GLU A1089 11.106 33.594 -2.673 1.00 18.59 O ATOM 121 H GLU A1089 7.719 32.902 1.317 1.00 0.00 H ATOM 122 N LEU A1090 8.686 30.254 2.704 1.00 12.65 N ATOM 123 CA LEU A1090 8.844 29.246 3.746 1.00 9.02 C ATOM 124 C LEU A1090 7.606 28.355 3.877 1.00 11.49 C ATOM 125 O LEU A1090 7.731 27.118 4.031 1.00 11.80 O ATOM 126 CB LEU A1090 9.141 29.921 5.087 1.00 13.87 C ATOM 127 CG LEU A1090 10.482 30.686 5.166 1.00 7.93 C ATOM 128 CD1 LEU A1090 10.670 31.300 6.564 1.00 10.17 C ATOM 129 CD2 LEU A1090 11.705 29.841 4.714 1.00 13.38 C ATOM 130 H LEU A1090 8.651 31.262 2.958 1.00 0.00 H ATOM 131 N ARG A1091 6.424 28.967 3.815 1.00 11.49 N ATOM 132 CA ARG A1091 5.187 28.201 3.839 1.00 11.84 C ATOM 133 C ARG A1091 5.220 27.153 2.736 1.00 10.04 C ATOM 134 O ARG A1091 4.947 25.970 2.986 1.00 11.01 O ATOM 135 CB ARG A1091 3.958 29.119 3.673 1.00 9.39 C ATOM 136 CG ARG A1091 2.618 28.428 3.624 1.00 13.99 C ATOM 137 CD ARG A1091 1.527 29.476 3.586 1.00 13.58 C ATOM 138 NE ARG A1091 1.499 30.212 2.317 1.00 11.85 N ATOM 139 CZ ARG A1091 0.843 31.354 2.141 1.00 15.04 C ATOM 140 NH1 ARG A1091 0.863 31.979 0.963 1.00 10.22 N ATOM 141 NH2 ARG A1091 0.160 31.890 3.143 1.00 11.10 N ATOM 142 HE ARG A1091 2.022 29.817 1.509 1.00 0.00 H ATOM 143 HH12 ARG A1091 0.345 32.872 0.839 1.00 0.00 H ATOM 144 HH11 ARG A1091 1.397 31.573 0.168 1.00 0.00 H ATOM 145 HH22 ARG A1091 -0.353 32.784 3.003 1.00 0.00 H ATOM 146 HH21 ARG A1091 0.137 31.417 4.069 1.00 0.00 H ATOM 147 H ARG A1091 6.385 30.004 3.749 1.00 0.00 H ATOM 148 N GLN A1092 5.537 27.574 1.509 1.00 10.70 N ATOM 149 CA GLN A1092 5.564 26.636 0.388 1.00 11.63 C ATOM 150 C GLN A1092 6.629 25.524 0.554 1.00 13.15 C ATOM 151 O GLN A1092 6.383 24.339 0.232 1.00 11.94 O ATOM 152 CB GLN A1092 5.823 27.389 -0.924 1.00 16.11 C ATOM 153 CG GLN A1092 5.847 26.524 -2.162 1.00 23.81 C ATOM 154 CD GLN A1092 6.064 27.350 -3.408 1.00 21.99 C ATOM 155 OE1 GLN A1092 7.187 27.787 -3.692 1.00 22.19 O ATOM 156 NE2 GLN A1092 4.981 27.616 -4.135 1.00 18.01 N ATOM 157 HE22 GLN A1092 4.058 27.225 -3.856 1.00 0.00 H ATOM 158 HE21 GLN A1092 5.057 28.214 -4.982 1.00 0.00 H ATOM 159 H GLN A1092 5.766 28.576 1.350 1.00 0.00 H ATOM 160 N ALA A1093 7.817 25.906 1.009 1.00 12.64 N ATOM 161 CA ALA A1093 8.932 24.962 1.118 1.00 12.98 C ATOM 162 C ALA A1093 8.696 23.946 2.211 1.00 13.67 C ATOM 163 O ALA A1093 9.023 22.787 2.028 1.00 10.26 O ATOM 164 CB ALA A1093 10.258 25.688 1.334 1.00 8.89 C ATOM 165 H ALA A1093 7.959 26.896 1.294 1.00 0.00 H ATOM 166 N LEU A1094 8.126 24.386 3.332 1.00 10.90 N ATOM 167 CA LEU A1094 8.031 23.551 4.529 1.00 11.50 C ATOM 168 C LEU A1094 6.756 22.758 4.683 1.00 8.92 C ATOM 169 O LEU A1094 6.737 21.775 5.412 1.00 9.00 O ATOM 170 CB LEU A1094 8.231 24.421 5.763 1.00 12.27 C ATOM 171 CG LEU A1094 9.574 25.123 5.802 1.00 9.97 C ATOM 172 CD1 LEU A1094 9.591 26.197 6.852 1.00 7.65 C ATOM 173 CD2 LEU A1094 10.712 24.097 5.987 1.00 11.68 C ATOM 174 H LEU A1094 7.738 25.350 3.357 1.00 0.00 H ATOM 175 N MET A1095 5.683 23.187 4.023 1.00 14.54 N ATOM 176 CA MET A1095 4.382 22.548 4.161 1.00 16.70 C ATOM 177 C MET A1095 4.422 21.033 3.946 1.00 8.05 C ATOM 178 O MET A1095 3.833 20.268 4.736 1.00 10.21 O ATOM 179 CB MET A1095 3.330 23.204 3.234 1.00 16.38 C ATOM 180 CG MET A1095 1.891 22.874 3.625 1.00 14.73 C ATOM 181 SD MET A1095 1.379 23.264 5.288 1.00 22.32 S ATOM 182 CE MET A1095 1.091 25.029 5.146 1.00 23.92 C ATOM 183 H MET A1095 5.777 24.005 3.388 1.00 0.00 H ATOM 184 N PRO A1096 5.146 20.573 2.906 1.00 10.43 N ATOM 185 CA PRO A1096 5.223 19.127 2.718 1.00 17.30 C ATOM 186 C PRO A1096 5.722 18.347 3.950 1.00 12.59 C ATOM 187 O PRO A1096 5.279 17.229 4.178 1.00 12.70 O ATOM 188 CB PRO A1096 6.193 18.969 1.521 1.00 23.89 C ATOM 189 CG PRO A1096 6.135 20.329 0.786 1.00 18.89 C ATOM 190 CD PRO A1096 5.915 21.331 1.885 1.00 10.46 C ATOM 191 N THR A1097 6.601 18.941 4.748 1.00 14.99 N ATOM 192 CA THR A1097 7.156 18.279 5.928 1.00 15.48 C ATOM 193 C THR A1097 6.083 18.182 7.034 1.00 11.77 C ATOM 194 O THR A1097 5.989 17.187 7.732 1.00 12.62 O ATOM 195 CB THR A1097 8.474 18.987 6.427 1.00 18.68 C ATOM 196 OG1 THR A1097 8.175 20.233 7.046 1.00 13.57 O ATOM 197 CG2 THR A1097 9.473 19.213 5.269 1.00 14.50 C ATOM 198 HG1 THR A1097 7.722 20.824 6.394 1.00 0.00 H ATOM 199 H THR A1097 6.905 19.910 4.526 1.00 0.00 H ATOM 200 N LEU A1098 5.284 19.232 7.176 1.00 11.48 N ATOM 201 CA LEU A1098 4.122 19.207 8.069 1.00 15.17 C ATOM 202 C LEU A1098 3.073 18.144 7.621 1.00 14.07 C ATOM 203 O LEU A1098 2.494 17.400 8.418 1.00 14.02 O ATOM 204 CB LEU A1098 3.481 20.601 8.098 1.00 13.20 C ATOM 205 CG LEU A1098 2.442 20.810 9.195 1.00 14.45 C ATOM 206 CD1 LEU A1098 3.075 20.476 10.513 1.00 17.08 C ATOM 207 CD2 LEU A1098 1.896 22.227 9.159 1.00 15.33 C ATOM 208 H LEU A1098 5.488 20.098 6.638 1.00 0.00 H ATOM 209 N GLU A1099 2.807 18.145 6.332 1.00 13.29 N ATOM 210 CA GLU A1099 1.871 17.237 5.716 1.00 17.18 C ATOM 211 C GLU A1099 2.272 15.766 5.993 1.00 14.96 C ATOM 212 O GLU A1099 1.399 14.933 6.288 1.00 13.15 O ATOM 213 CB GLU A1099 1.761 17.543 4.205 1.00 14.18 C ATOM 214 CG GLU A1099 0.924 18.812 3.843 1.00 36.17 C ATOM 215 CD GLU A1099 0.950 19.256 2.325 1.00 41.98 C ATOM 216 OE1 GLU A1099 1.914 18.939 1.568 1.00 33.91 O ATOM 217 OE2 GLU A1099 -0.004 19.974 1.912 1.00 33.64 O ATOM 218 H GLU A1099 3.296 18.835 5.727 1.00 0.00 H ATOM 219 N ALA A1100 3.576 15.469 5.965 1.00 13.74 N ATOM 220 CA ALA A1100 4.053 14.099 6.205 1.00 15.34 C ATOM 221 C ALA A1100 3.740 13.677 7.633 1.00 15.16 C ATOM 222 O ALA A1100 3.431 12.535 7.855 1.00 14.60 O ATOM 223 CB ALA A1100 5.546 13.971 5.954 1.00 9.24 C ATOM 224 H ALA A1100 4.266 16.222 5.770 1.00 0.00 H ATOM 225 N LEU A1101 3.791 14.604 8.592 1.00 13.46 N ATOM 226 CA LEU A1101 3.440 14.246 9.984 1.00 10.17 C ATOM 227 C LEU A1101 1.923 13.966 10.071 1.00 16.60 C ATOM 228 O LEU A1101 1.491 12.973 10.670 1.00 13.79 O ATOM 229 CB LEU A1101 3.837 15.368 10.932 1.00 11.30 C ATOM 230 CG LEU A1101 5.341 15.694 10.905 1.00 9.96 C ATOM 231 CD1 LEU A1101 5.677 16.781 11.911 1.00 13.08 C ATOM 232 CD2 LEU A1101 6.238 14.433 11.141 1.00 14.31 C ATOM 233 H LEU A1101 4.077 15.577 8.361 1.00 0.00 H ATOM 234 N TYR A1102 1.126 14.816 9.429 1.00 12.08 N ATOM 235 CA TYR A1102 -0.329 14.633 9.425 1.00 9.01 C ATOM 236 C TYR A1102 -0.750 13.274 8.854 1.00 11.15 C ATOM 237 O TYR A1102 -1.751 12.719 9.284 1.00 12.56 O ATOM 238 CB TYR A1102 -1.046 15.744 8.663 1.00 11.87 C ATOM 239 CG TYR A1102 -1.434 16.966 9.502 1.00 12.99 C ATOM 240 CD1 TYR A1102 -2.717 17.077 10.073 1.00 9.98 C ATOM 241 CD2 TYR A1102 -0.521 17.973 9.763 1.00 13.40 C ATOM 242 CE1 TYR A1102 -3.071 18.207 10.846 1.00 11.72 C ATOM 243 CE2 TYR A1102 -0.865 19.092 10.515 1.00 12.88 C ATOM 244 CZ TYR A1102 -2.156 19.209 11.038 1.00 13.61 C ATOM 245 OH TYR A1102 -2.495 20.301 11.815 1.00 17.74 O ATOM 246 HH TYR A1102 -3.440 20.222 12.099 1.00 0.00 H ATOM 247 H TYR A1102 1.542 15.623 8.922 1.00 0.00 H ATOM 248 N ARG A1103 0.000 12.812 7.856 1.00 13.33 N ATOM 249 CA ARG A1103 -0.257 11.578 7.137 1.00 16.17 C ATOM 250 C ARG A1103 0.053 10.350 7.980 1.00 15.83 C ATOM 251 O ARG A1103 -0.310 9.258 7.593 1.00 16.83 O ATOM 252 CB ARG A1103 0.578 11.597 5.836 1.00 13.90 C ATOM 253 CG ARG A1103 0.652 10.339 5.021 1.00 46.54 C ATOM 254 CD ARG A1103 1.113 10.649 3.568 1.00 53.63 C ATOM 255 NE ARG A1103 2.442 11.277 3.462 1.00 41.85 N ATOM 256 CZ ARG A1103 2.695 12.537 3.077 1.00 42.06 C ATOM 257 NH1 ARG A1103 3.954 12.960 3.016 1.00 31.23 N ATOM 258 NH2 ARG A1103 1.725 13.392 2.752 1.00 45.43 N ATOM 259 HE ARG A1103 3.262 10.687 3.709 1.00 0.00 H ATOM 260 HH12 ARG A1103 4.161 13.935 2.719 1.00 0.00 H ATOM 261 HH11 ARG A1103 4.732 12.316 3.265 1.00 0.00 H ATOM 262 HH22 ARG A1103 1.963 14.361 2.458 1.00 0.00 H ATOM 263 HH21 ARG A1103 0.731 13.090 2.792 1.00 0.00 H ATOM 264 H ARG A1103 0.827 13.374 7.572 1.00 0.00 H ATOM 265 N GLN A1104 0.691 10.523 9.147 1.00 13.09 N ATOM 266 CA GLN A1104 1.024 9.381 10.018 1.00 14.09 C ATOM 267 C GLN A1104 -0.169 9.009 10.868 1.00 18.96 C ATOM 268 O GLN A1104 -0.554 9.755 11.752 1.00 15.14 O ATOM 269 CB GLN A1104 2.189 9.698 10.961 1.00 16.10 C ATOM 270 CG GLN A1104 3.464 10.104 10.258 1.00 15.38 C ATOM 271 CD GLN A1104 3.861 9.135 9.121 1.00 20.54 C ATOM 272 OE1 GLN A1104 3.925 7.934 9.326 1.00 14.58 O ATOM 273 NE2 GLN A1104 4.084 9.674 7.911 1.00 20.51 N ATOM 274 HE22 GLN A1104 4.019 10.704 7.780 1.00 0.00 H ATOM 275 HE21 GLN A1104 4.322 9.062 7.105 1.00 0.00 H ATOM 276 H GLN A1104 0.957 11.484 9.444 1.00 0.00 H ATOM 277 N ASP A1105 -0.707 7.827 10.620 1.00 18.27 N ATOM 278 CA ASP A1105 -1.896 7.360 11.280 1.00 19.56 C ATOM 279 C ASP A1105 -1.584 6.000 11.878 1.00 19.91 C ATOM 280 O ASP A1105 -1.153 5.108 11.158 1.00 17.42 O ATOM 281 CB ASP A1105 -3.027 7.289 10.253 1.00 18.06 C ATOM 282 CG ASP A1105 -4.290 6.632 10.788 1.00 31.03 C ATOM 283 OD1 ASP A1105 -4.688 6.874 11.938 1.00 20.47 O ATOM 284 OD2 ASP A1105 -4.894 5.851 10.039 1.00 51.62 O ATOM 285 H ASP A1105 -0.251 7.209 9.918 1.00 0.00 H ATOM 286 N PRO A1106 -1.812 5.817 13.195 1.00 19.34 N ATOM 287 CA PRO A1106 -2.443 6.682 14.199 1.00 13.31 C ATOM 288 C PRO A1106 -1.502 7.692 14.875 1.00 12.23 C ATOM 289 O PRO A1106 -1.934 8.428 15.771 1.00 13.63 O ATOM 290 CB PRO A1106 -2.916 5.659 15.244 1.00 22.84 C ATOM 291 CG PRO A1106 -1.839 4.603 15.224 1.00 20.46 C ATOM 292 CD PRO A1106 -1.326 4.561 13.808 1.00 17.60 C ATOM 293 N GLU A1107 -0.229 7.730 14.489 1.00 12.55 N ATOM 294 CA GLU A1107 0.765 8.376 15.354 1.00 11.95 C ATOM 295 C GLU A1107 0.594 9.876 15.509 1.00 8.43 C ATOM 296 O GLU A1107 0.927 10.414 16.563 1.00 14.97 O ATOM 297 CB GLU A1107 2.210 8.025 14.956 1.00 15.60 C ATOM 298 CG GLU A1107 2.555 6.525 15.128 1.00 17.41 C ATOM 299 CD GLU A1107 2.355 5.682 13.884 1.00 20.31 C ATOM 300 OE1 GLU A1107 1.685 6.134 12.933 1.00 16.67 O ATOM 301 OE2 GLU A1107 2.853 4.537 13.874 1.00 22.61 O ATOM 302 H GLU A1107 0.058 7.306 13.584 1.00 0.00 H ATOM 303 N SER A1108 0.034 10.542 14.499 1.00 10.58 N ATOM 304 CA SER A1108 -0.235 11.976 14.569 1.00 12.86 C ATOM 305 C SER A1108 -1.447 12.326 15.466 1.00 11.49 C ATOM 306 O SER A1108 -1.587 13.480 15.871 1.00 13.58 O ATOM 307 CB SER A1108 -0.472 12.526 13.157 1.00 11.18 C ATOM 308 OG SER A1108 -1.742 12.153 12.676 1.00 13.85 O ATOM 309 HG SER A1108 -1.806 11.165 12.647 1.00 0.00 H ATOM 310 H SER A1108 -0.219 10.024 13.634 1.00 0.00 H ATOM 311 N LEU A1109 -2.316 11.349 15.776 1.00 14.96 N ATOM 312 CA LEU A1109 -3.608 11.664 16.410 1.00 10.31 C ATOM 313 C LEU A1109 -3.472 12.394 17.769 1.00 9.03 C ATOM 314 O LEU A1109 -4.219 13.347 18.013 1.00 14.57 O ATOM 315 CB LEU A1109 -4.512 10.444 16.550 1.00 16.75 C ATOM 316 CG LEU A1109 -4.915 9.810 15.197 1.00 26.66 C ATOM 317 CD1 LEU A1109 -5.639 8.455 15.403 1.00 19.06 C ATOM 318 CD2 LEU A1109 -5.762 10.744 14.390 1.00 20.15 C ATOM 319 H LEU A1109 -2.074 10.360 15.566 1.00 0.00 H ATOM 320 N PRO A1110 -2.533 11.960 18.644 1.00 11.80 N ATOM 321 CA PRO A1110 -2.334 12.691 19.918 1.00 9.32 C ATOM 322 C PRO A1110 -1.737 14.085 19.788 1.00 7.56 C ATOM 323 O PRO A1110 -1.707 14.807 20.784 1.00 10.06 O ATOM 324 CB PRO A1110 -1.381 11.797 20.713 1.00 11.36 C ATOM 325 CG PRO A1110 -1.588 10.458 20.180 1.00 11.15 C ATOM 326 CD PRO A1110 -1.819 10.676 18.685 1.00 14.73 C ATOM 327 N PHE A1111 -1.267 14.451 18.592 1.00 7.56 N ATOM 328 CA PHE A1111 -0.588 15.723 18.310 1.00 9.72 C ATOM 329 C PHE A1111 -1.407 16.720 17.465 1.00 9.91 C ATOM 330 O PHE A1111 -0.973 17.878 17.231 1.00 10.49 O ATOM 331 CB PHE A1111 0.722 15.425 17.596 1.00 12.00 C ATOM 332 CG PHE A1111 1.683 14.626 18.414 1.00 9.13 C ATOM 333 CD1 PHE A1111 2.683 15.260 19.168 1.00 13.49 C ATOM 334 CD2 PHE A1111 1.618 13.221 18.436 1.00 8.36 C ATOM 335 CE1 PHE A1111 3.579 14.501 19.929 1.00 15.91 C ATOM 336 CE2 PHE A1111 2.490 12.469 19.233 1.00 11.84 C ATOM 337 CZ PHE A1111 3.475 13.122 19.980 1.00 8.87 C ATOM 338 H PHE A1111 -1.391 13.786 17.802 1.00 0.00 H ATOM 339 N ARG A1112 -2.597 16.297 17.023 1.00 9.10 N ATOM 340 CA ARG A1112 -3.429 17.095 16.084 1.00 7.79 C ATOM 341 C ARG A1112 -3.960 18.381 16.704 1.00 10.17 C ATOM 342 O ARG A1112 -4.125 19.386 16.015 1.00 12.26 O ATOM 343 CB ARG A1112 -4.625 16.285 15.557 1.00 15.83 C ATOM 344 CG ARG A1112 -4.304 15.074 14.732 1.00 22.70 C ATOM 345 CD ARG A1112 -3.672 15.437 13.458 1.00 30.88 C ATOM 346 NE ARG A1112 -3.728 14.390 12.421 1.00 33.20 N ATOM 347 CZ ARG A1112 -4.584 14.351 11.394 1.00 37.12 C ATOM 348 NH1 ARG A1112 -4.467 13.372 10.510 1.00 40.74 N ATOM 349 NH2 ARG A1112 -5.560 15.262 11.230 1.00 17.58 N ATOM 350 HE ARG A1112 -3.041 13.613 12.495 1.00 0.00 H ATOM 351 HH12 ARG A1112 -5.120 13.320 9.703 1.00 0.00 H ATOM 352 HH11 ARG A1112 -3.722 12.656 10.623 1.00 0.00 H ATOM 353 HH22 ARG A1112 -6.204 15.193 10.416 1.00 0.00 H ATOM 354 HH21 ARG A1112 -5.671 16.035 11.917 1.00 0.00 H ATOM 355 H ARG A1112 -2.953 15.376 17.348 1.00 0.00 H ATOM 356 N GLN A1113 -4.269 18.301 17.993 1.00 10.17 N ATOM 357 CA GLN A1113 -4.932 19.351 18.764 1.00 9.95 C ATOM 358 C GLN A1113 -4.114 19.620 20.040 1.00 8.34 C ATOM 359 O GLN A1113 -3.421 18.720 20.554 1.00 9.30 O ATOM 360 CB GLN A1113 -6.366 18.944 19.180 1.00 11.74 C ATOM 361 CG GLN A1113 -7.323 18.725 18.006 1.00 10.48 C ATOM 362 CD GLN A1113 -8.714 18.249 18.431 1.00 23.24 C ATOM 363 OE1 GLN A1113 -9.294 18.762 19.390 1.00 32.24 O ATOM 364 NE2 GLN A1113 -9.253 17.269 17.705 1.00 41.72 N ATOM 365 HE22 GLN A1113 -8.727 16.866 16.904 1.00 0.00 H ATOM 366 HE21 GLN A1113 -10.200 16.908 17.940 1.00 0.00 H ATOM 367 H GLN A1113 -4.020 17.423 18.493 1.00 0.00 H ATOM 368 N PRO A1114 -4.248 20.829 20.593 1.00 9.09 N ATOM 369 CA PRO A1114 -3.555 21.101 21.846 1.00 11.88 C ATOM 370 C PRO A1114 -3.990 20.126 22.928 1.00 9.43 C ATOM 371 O PRO A1114 -5.193 19.779 23.040 1.00 8.62 O ATOM 372 CB PRO A1114 -3.966 22.518 22.192 1.00 10.58 C ATOM 373 CG PRO A1114 -4.374 23.120 20.895 1.00 12.34 C ATOM 374 CD PRO A1114 -4.966 22.010 20.086 1.00 10.98 C ATOM 375 N VAL A1115 -3.011 19.683 23.703 1.00 9.29 N ATOM 376 CA VAL A1115 -3.264 18.875 24.890 1.00 15.28 C ATOM 377 C VAL A1115 -4.272 19.588 25.792 1.00 11.38 C ATOM 378 O VAL A1115 -4.110 20.765 26.136 1.00 12.00 O ATOM 379 CB VAL A1115 -1.962 18.539 25.648 1.00 16.16 C ATOM 380 CG1 VAL A1115 -2.259 17.874 27.014 1.00 8.93 C ATOM 381 CG2 VAL A1115 -1.097 17.606 24.776 1.00 9.12 C ATOM 382 H VAL A1115 -2.029 19.920 23.456 1.00 0.00 H ATOM 383 N ASP A1116 -5.345 18.877 26.123 1.00 10.75 N ATOM 384 CA ASP A1116 -6.364 19.414 27.002 1.00 12.20 C ATOM 385 C ASP A1116 -6.229 18.666 28.332 1.00 9.50 C ATOM 386 O ASP A1116 -6.726 17.525 28.448 1.00 11.52 O ATOM 387 CB ASP A1116 -7.731 19.190 26.360 1.00 14.87 C ATOM 388 CG ASP A1116 -8.875 19.755 27.167 1.00 19.44 C ATOM 389 OD1 ASP A1116 -8.707 19.952 28.393 1.00 11.43 O ATOM 390 OD2 ASP A1116 -9.953 20.004 26.580 1.00 23.57 O ATOM 391 H ASP A1116 -5.456 17.915 25.743 1.00 0.00 H ATOM 392 N PRO A1117 -5.586 19.299 29.336 1.00 13.50 N ATOM 393 CA PRO A1117 -5.337 18.616 30.630 1.00 12.66 C ATOM 394 C PRO A1117 -6.612 18.212 31.360 1.00 16.56 C ATOM 395 O PRO A1117 -6.644 17.160 32.001 1.00 14.60 O ATOM 396 CB PRO A1117 -4.494 19.651 31.423 1.00 8.75 C ATOM 397 CG PRO A1117 -3.840 20.452 30.322 1.00 11.39 C ATOM 398 CD PRO A1117 -4.925 20.620 29.302 1.00 15.89 C ATOM 399 N GLN A1118 -7.660 19.035 31.263 1.00 12.19 N ATOM 400 CA GLN A1118 -8.905 18.721 31.936 1.00 19.87 C ATOM 401 C GLN A1118 -9.554 17.451 31.345 1.00 14.86 C ATOM 402 O GLN A1118 -9.889 16.525 32.067 1.00 13.50 O ATOM 403 CB GLN A1118 -9.885 19.889 31.882 1.00 20.12 C ATOM 404 CG GLN A1118 -11.125 19.581 32.717 1.00 16.30 C ATOM 405 CD GLN A1118 -12.182 20.638 32.554 1.00 28.16 C ATOM 406 OE1 GLN A1118 -12.024 21.555 31.750 1.00 29.78 O ATOM 407 NE2 GLN A1118 -13.267 20.516 33.304 1.00 32.50 N ATOM 408 HE22 GLN A1118 -13.352 19.721 33.970 1.00 0.00 H ATOM 409 HE21 GLN A1118 -14.033 21.215 33.227 1.00 0.00 H ATOM 410 H GLN A1118 -7.582 19.907 30.701 1.00 0.00 H ATOM 411 N LEU A1119 -9.689 17.413 30.034 1.00 13.63 N ATOM 412 CA LEU A1119 -10.208 16.215 29.344 1.00 12.25 C ATOM 413 C LEU A1119 -9.376 14.949 29.636 1.00 14.20 C ATOM 414 O LEU A1119 -9.948 13.843 29.906 1.00 14.17 O ATOM 415 CB LEU A1119 -10.223 16.508 27.852 1.00 12.49 C ATOM 416 CG LEU A1119 -10.624 15.391 26.878 1.00 12.45 C ATOM 417 CD1 LEU A1119 -11.938 14.752 27.326 1.00 24.51 C ATOM 418 CD2 LEU A1119 -10.738 15.982 25.488 1.00 21.67 C ATOM 419 H LEU A1119 -9.424 18.247 29.472 1.00 0.00 H ATOM 420 N LEU A1120 -8.048 15.097 29.651 1.00 14.41 N ATOM 421 CA LEU A1120 -7.154 13.949 29.852 1.00 15.12 C ATOM 422 C LEU A1120 -6.928 13.625 31.348 1.00 19.75 C ATOM 423 O LEU A1120 -6.278 12.633 31.697 1.00 20.39 O ATOM 424 CB LEU A1120 -5.823 14.180 29.113 1.00 15.15 C ATOM 425 CG LEU A1120 -5.930 14.253 27.566 1.00 21.74 C ATOM 426 CD1 LEU A1120 -4.601 14.746 26.974 1.00 14.10 C ATOM 427 CD2 LEU A1120 -6.372 12.912 26.889 1.00 24.90 C ATOM 428 H LEU A1120 -7.639 16.044 29.518 1.00 0.00 H ATOM 429 N GLY A1121 -7.455 14.477 32.219 1.00 17.87 N ATOM 430 CA GLY A1121 -7.309 14.329 33.666 1.00 16.57 C ATOM 431 C GLY A1121 -5.873 14.349 34.169 1.00 17.67 C ATOM 432 O GLY A1121 -5.495 13.554 35.042 1.00 19.87 O ATOM 433 H GLY A1121 -7.997 15.287 31.855 1.00 0.00 H ATOM 434 N ILE A1122 -5.075 15.251 33.595 1.00 13.48 N ATOM 435 CA ILE A1122 -3.680 15.427 33.951 1.00 14.79 C ATOM 436 C ILE A1122 -3.413 16.899 34.343 1.00 17.18 C ATOM 437 O ILE A1122 -2.800 17.683 33.559 1.00 9.58 O ATOM 438 CB ILE A1122 -2.802 14.954 32.800 1.00 16.73 C ATOM 439 CG1 ILE A1122 -3.216 15.599 31.452 1.00 8.86 C ATOM 440 CG2 ILE A1122 -2.895 13.418 32.685 1.00 11.26 C ATOM 441 CD1 ILE A1122 -2.275 15.359 30.239 1.00 10.56 C ATOM 442 H ILE A1122 -5.474 15.860 32.853 1.00 0.00 H ATOM 443 N PRO A1123 -3.868 17.300 35.558 1.00 13.03 N ATOM 444 CA PRO A1123 -3.761 18.699 36.014 1.00 15.54 C ATOM 445 C PRO A1123 -2.349 19.266 36.135 1.00 16.32 C ATOM 446 O PRO A1123 -2.195 20.465 36.181 1.00 16.11 O ATOM 447 CB PRO A1123 -4.421 18.695 37.403 1.00 21.08 C ATOM 448 CG PRO A1123 -4.872 17.344 37.668 1.00 18.29 C ATOM 449 CD PRO A1123 -4.507 16.436 36.568 1.00 17.22 C ATOM 450 N ASP A1124 -1.333 18.403 36.173 1.00 10.34 N ATOM 451 CA ASP A1124 0.045 18.849 36.223 1.00 9.41 C ATOM 452 C ASP A1124 0.627 19.210 34.876 1.00 12.25 C ATOM 453 O ASP A1124 1.749 19.709 34.820 1.00 13.24 O ATOM 454 CB ASP A1124 0.909 17.829 36.957 1.00 13.10 C ATOM 455 CG ASP A1124 1.191 16.588 36.164 1.00 17.99 C ATOM 456 OD1 ASP A1124 0.407 16.218 35.266 1.00 13.77 O ATOM 457 OD2 ASP A1124 2.203 15.947 36.501 1.00 15.87 O ATOM 458 H ASP A1124 -1.535 17.383 36.167 1.00 0.00 H ATOM 459 N TYR A1125 -0.145 19.027 33.798 1.00 10.57 N ATOM 460 CA TYR A1125 0.416 19.149 32.461 1.00 8.28 C ATOM 461 C TYR A1125 1.067 20.508 32.217 1.00 9.13 C ATOM 462 O TYR A1125 2.243 20.576 31.804 1.00 8.56 O ATOM 463 CB TYR A1125 -0.589 18.827 31.357 1.00 10.36 C ATOM 464 CG TYR A1125 0.067 18.872 29.973 1.00 7.59 C ATOM 465 CD1 TYR A1125 0.044 20.047 29.211 1.00 8.08 C ATOM 466 CD2 TYR A1125 0.781 17.792 29.475 1.00 10.19 C ATOM 467 CE1 TYR A1125 0.659 20.115 27.927 1.00 7.50 C ATOM 468 CE2 TYR A1125 1.401 17.839 28.206 1.00 12.37 C ATOM 469 CZ TYR A1125 1.371 19.037 27.459 1.00 7.84 C ATOM 470 OH TYR A1125 1.963 19.038 26.212 1.00 13.31 O ATOM 471 HH TYR A1125 1.869 19.935 25.804 1.00 0.00 H ATOM 472 H TYR A1125 -1.152 18.796 33.917 1.00 0.00 H ATOM 473 N PHE A1126 0.331 21.573 32.507 1.00 9.69 N ATOM 474 CA PHE A1126 0.809 22.934 32.270 1.00 11.23 C ATOM 475 C PHE A1126 1.835 23.406 33.311 1.00 15.57 C ATOM 476 O PHE A1126 2.436 24.461 33.147 1.00 10.73 O ATOM 477 CB PHE A1126 -0.360 23.923 32.273 1.00 15.71 C ATOM 478 CG PHE A1126 -1.268 23.851 31.063 1.00 11.57 C ATOM 479 CD1 PHE A1126 -0.782 23.587 29.799 1.00 12.77 C ATOM 480 CD2 PHE A1126 -2.622 24.118 31.218 1.00 10.21 C ATOM 481 CE1 PHE A1126 -1.651 23.550 28.703 1.00 17.47 C ATOM 482 CE2 PHE A1126 -3.478 24.126 30.126 1.00 14.05 C ATOM 483 CZ PHE A1126 -3.002 23.834 28.881 1.00 8.61 C ATOM 484 H PHE A1126 -0.615 21.435 32.916 1.00 0.00 H ATOM 485 N ASP A1127 1.999 22.668 34.402 1.00 9.63 N ATOM 486 CA ASP A1127 3.110 22.936 35.322 1.00 13.51 C ATOM 487 C ASP A1127 4.442 22.487 34.716 1.00 14.37 C ATOM 488 O ASP A1127 5.450 23.204 34.818 1.00 14.46 O ATOM 489 CB ASP A1127 2.918 22.239 36.678 1.00 12.46 C ATOM 490 CG ASP A1127 1.670 22.702 37.420 1.00 28.43 C ATOM 491 OD1 ASP A1127 1.328 23.913 37.362 1.00 25.80 O ATOM 492 OD2 ASP A1127 1.040 21.848 38.075 1.00 30.85 O ATOM 493 H ASP A1127 1.335 21.894 34.606 1.00 0.00 H ATOM 494 N ILE A1128 4.412 21.300 34.099 1.00 14.92 N ATOM 495 CA ILE A1128 5.586 20.638 33.534 1.00 13.14 C ATOM 496 C ILE A1128 5.914 21.163 32.134 1.00 10.02 C ATOM 497 O ILE A1128 7.091 21.357 31.810 1.00 9.48 O ATOM 498 CB ILE A1128 5.388 19.097 33.481 1.00 11.18 C ATOM 499 CG1 ILE A1128 5.414 18.524 34.903 1.00 15.54 C ATOM 500 CG2 ILE A1128 6.493 18.399 32.628 1.00 16.26 C ATOM 501 CD1 ILE A1128 4.855 17.167 34.994 1.00 22.63 C ATOM 502 H ILE A1128 3.494 20.818 34.016 1.00 0.00 H ATOM 503 N VAL A1129 4.878 21.331 31.311 1.00 11.07 N ATOM 504 CA VAL A1129 5.016 21.819 29.944 1.00 11.60 C ATOM 505 C VAL A1129 4.665 23.310 29.949 1.00 13.94 C ATOM 506 O VAL A1129 3.476 23.727 29.937 1.00 13.57 O ATOM 507 CB VAL A1129 4.155 21.009 28.956 1.00 9.70 C ATOM 508 CG1 VAL A1129 4.420 21.480 27.529 1.00 8.33 C ATOM 509 CG2 VAL A1129 4.486 19.492 29.115 1.00 10.89 C ATOM 510 H VAL A1129 3.926 21.103 31.661 1.00 0.00 H ATOM 511 N LYS A1130 5.722 24.107 29.972 1.00 9.37 N ATOM 512 CA LYS A1130 5.595 25.579 30.115 1.00 12.84 C ATOM 513 C LYS A1130 5.255 26.275 28.791 1.00 13.06 C ATOM 514 O LYS A1130 4.696 27.356 28.790 1.00 13.49 O ATOM 515 CB LYS A1130 6.846 26.137 30.748 1.00 18.43 C ATOM 516 CG LYS A1130 7.087 25.608 32.186 1.00 15.31 C ATOM 517 CD LYS A1130 8.313 26.292 32.766 1.00 35.47 C ATOM 518 CE LYS A1130 8.522 25.982 34.252 1.00 42.83 C ATOM 519 NZ LYS A1130 7.920 27.045 35.120 1.00 66.90 N ATOM 520 HZ1 LYS A1130 8.367 27.960 34.906 1.00 0.00 H ATOM 521 HZ2 LYS A1130 6.898 27.105 34.934 1.00 0.00 H ATOM 522 HZ3 LYS A1130 8.079 26.806 36.120 1.00 0.00 H ATOM 523 H LYS A1130 6.670 23.689 29.887 1.00 0.00 H ATOM 524 N ASN A1131 5.568 25.622 27.668 1.00 11.15 N ATOM 525 CA ASN A1131 5.310 26.164 26.320 1.00 11.02 C ATOM 526 C ASN A1131 4.702 25.104 25.397 1.00 7.63 C ATOM 527 O ASN A1131 5.409 24.516 24.574 1.00 12.90 O ATOM 528 CB ASN A1131 6.606 26.719 25.727 1.00 18.26 C ATOM 529 CG ASN A1131 7.059 27.968 26.442 1.00 12.85 C ATOM 530 OD1 ASN A1131 6.380 29.010 26.388 1.00 16.74 O ATOM 531 ND2 ASN A1131 8.173 27.871 27.142 1.00 19.26 N ATOM 532 HD22 ASN A1131 8.704 26.977 27.154 1.00 0.00 H ATOM 533 HD21 ASN A1131 8.521 28.689 27.682 1.00 0.00 H ATOM 534 H ASN A1131 6.015 24.686 27.748 1.00 0.00 H ATOM 535 N PRO A1132 3.375 24.864 25.532 1.00 11.55 N ATOM 536 CA PRO A1132 2.717 23.821 24.738 1.00 9.71 C ATOM 537 C PRO A1132 2.798 24.108 23.249 1.00 7.56 C ATOM 538 O PRO A1132 2.825 25.298 22.831 1.00 11.38 O ATOM 539 CB PRO A1132 1.255 23.874 25.224 1.00 7.62 C ATOM 540 CG PRO A1132 1.367 24.329 26.634 1.00 8.73 C ATOM 541 CD PRO A1132 2.458 25.408 26.554 1.00 8.08 C ATOM 542 N MET A1133 2.845 23.037 22.465 1.00 13.73 N ATOM 543 CA MET A1133 2.837 23.145 21.019 1.00 12.00 C ATOM 544 C MET A1133 2.227 21.873 20.425 1.00 10.45 C ATOM 545 O MET A1133 2.418 20.773 20.949 1.00 9.60 O ATOM 546 CB MET A1133 4.258 23.335 20.509 1.00 8.69 C ATOM 547 CG MET A1133 4.329 23.613 18.973 1.00 8.47 C ATOM 548 SD MET A1133 3.429 25.094 18.410 1.00 10.47 S ATOM 549 CE MET A1133 4.086 26.312 19.577 1.00 9.39 C ATOM 550 H MET A1133 2.889 22.094 22.901 1.00 0.00 H ATOM 551 N ASP A1134 1.525 22.029 19.312 1.00 9.11 N ATOM 552 CA ASP A1134 0.861 20.916 18.630 1.00 11.28 C ATOM 553 C ASP A1134 0.741 21.236 17.130 1.00 13.03 C ATOM 554 O ASP A1134 1.032 22.350 16.693 1.00 8.54 O ATOM 555 CB ASP A1134 -0.529 20.694 19.252 1.00 9.73 C ATOM 556 CG ASP A1134 -1.500 21.778 18.840 1.00 12.81 C ATOM 557 OD1 ASP A1134 -1.273 22.942 19.281 1.00 13.67 O ATOM 558 OD2 ASP A1134 -2.435 21.484 18.054 1.00 11.83 O ATOM 559 H ASP A1134 1.442 22.983 18.905 1.00 0.00 H ATOM 560 N LEU A1135 0.349 20.228 16.360 1.00 9.60 N ATOM 561 CA LEU A1135 0.218 20.319 14.911 1.00 9.37 C ATOM 562 C LEU A1135 -0.701 21.440 14.471 1.00 9.60 C ATOM 563 O LEU A1135 -0.352 22.169 13.554 1.00 8.82 O ATOM 564 CB LEU A1135 -0.255 18.983 14.334 1.00 14.10 C ATOM 565 CG LEU A1135 0.804 17.875 14.293 1.00 7.46 C ATOM 566 CD1 LEU A1135 0.178 16.503 13.842 1.00 10.22 C ATOM 567 CD2 LEU A1135 2.070 18.300 13.393 1.00 7.43 C ATOM 568 H LEU A1135 0.122 19.322 16.817 1.00 0.00 H ATOM 569 N SER A1136 -1.845 21.616 15.131 1.00 9.92 N ATOM 570 CA SER A1136 -2.769 22.666 14.691 1.00 11.92 C ATOM 571 C SER A1136 -2.157 24.051 14.828 1.00 7.80 C ATOM 572 O SER A1136 -2.429 24.949 14.013 1.00 8.48 O ATOM 573 CB SER A1136 -4.117 22.600 15.427 1.00 11.35 C ATOM 574 OG SER A1136 -4.099 23.079 16.787 1.00 9.98 O ATOM 575 HG SER A1136 -3.461 22.539 17.317 1.00 0.00 H ATOM 576 H SER A1136 -2.080 21.016 15.948 1.00 0.00 H ATOM 577 N THR A1137 -1.365 24.249 15.858 1.00 11.21 N ATOM 578 CA THR A1137 -0.787 25.568 16.117 1.00 7.68 C ATOM 579 C THR A1137 0.299 25.874 15.076 1.00 13.98 C ATOM 580 O THR A1137 0.379 26.975 14.520 1.00 8.97 O ATOM 581 CB THR A1137 -0.206 25.638 17.589 1.00 9.33 C ATOM 582 OG1 THR A1137 -1.253 25.399 18.512 1.00 8.55 O ATOM 583 CG2 THR A1137 0.464 26.971 17.849 1.00 14.58 C ATOM 584 HG1 THR A1137 -1.638 24.502 18.348 1.00 0.00 H ATOM 585 H THR A1137 -1.146 23.458 16.497 1.00 0.00 H ATOM 586 N ILE A1138 1.100 24.861 14.780 1.00 10.91 N ATOM 587 CA ILE A1138 2.178 24.958 13.796 1.00 12.70 C ATOM 588 C ILE A1138 1.584 25.208 12.401 1.00 13.60 C ATOM 589 O ILE A1138 2.070 26.058 11.645 1.00 11.76 O ATOM 590 CB ILE A1138 3.014 23.627 13.776 1.00 11.96 C ATOM 591 CG1 ILE A1138 3.805 23.441 15.083 1.00 7.79 C ATOM 592 CG2 ILE A1138 3.999 23.601 12.572 1.00 13.54 C ATOM 593 CD1 ILE A1138 4.448 22.027 15.276 1.00 12.64 C ATOM 594 H ILE A1138 0.956 23.955 15.270 1.00 0.00 H ATOM 595 N LYS A1139 0.569 24.411 12.049 1.00 10.25 N ATOM 596 CA LYS A1139 -0.179 24.558 10.784 1.00 13.30 C ATOM 597 C LYS A1139 -0.642 25.981 10.612 1.00 10.66 C ATOM 598 O LYS A1139 -0.401 26.571 9.554 1.00 11.10 O ATOM 599 CB LYS A1139 -1.403 23.664 10.749 1.00 15.66 C ATOM 600 CG LYS A1139 -2.239 23.834 9.450 1.00 13.68 C ATOM 601 CD LYS A1139 -3.317 22.778 9.265 1.00 33.33 C ATOM 602 CE LYS A1139 -4.169 23.080 8.015 1.00 32.55 C ATOM 603 NZ LYS A1139 -3.332 23.303 6.755 1.00 28.88 N ATOM 604 HZ1 LYS A1139 -2.693 24.110 6.903 1.00 0.00 H ATOM 605 HZ2 LYS A1139 -2.773 22.449 6.556 1.00 0.00 H ATOM 606 HZ3 LYS A1139 -3.963 23.501 5.952 1.00 0.00 H ATOM 607 H LYS A1139 0.292 23.648 12.700 1.00 0.00 H ATOM 608 N ARG A1140 -1.314 26.524 11.633 1.00 12.23 N ATOM 609 CA ARG A1140 -1.880 27.882 11.531 1.00 12.98 C ATOM 610 C ARG A1140 -0.818 28.961 11.393 1.00 13.19 C ATOM 611 O ARG A1140 -1.043 29.941 10.693 1.00 12.89 O ATOM 612 CB ARG A1140 -2.814 28.215 12.700 1.00 9.43 C ATOM 613 CG ARG A1140 -4.102 27.327 12.725 1.00 13.43 C ATOM 614 CD ARG A1140 -4.852 27.344 14.096 1.00 13.84 C ATOM 615 NE ARG A1140 -5.851 26.260 14.132 1.00 18.21 N ATOM 616 CZ ARG A1140 -6.900 26.192 14.958 1.00 15.04 C ATOM 617 NH1 ARG A1140 -7.166 27.174 15.823 1.00 17.20 N ATOM 618 NH2 ARG A1140 -7.731 25.151 14.860 1.00 22.24 N ATOM 619 HE ARG A1140 -5.729 25.480 13.455 1.00 0.00 H ATOM 620 HH12 ARG A1140 -7.987 27.101 16.457 1.00 0.00 H ATOM 621 HH11 ARG A1140 -6.552 28.012 15.863 1.00 0.00 H ATOM 622 HH22 ARG A1140 -8.553 25.080 15.494 1.00 0.00 H ATOM 623 HH21 ARG A1140 -7.556 24.411 14.150 1.00 0.00 H ATOM 624 H ARG A1140 -1.439 25.981 12.511 1.00 0.00 H ATOM 625 N LYS A1141 0.318 28.793 12.075 1.00 10.50 N ATOM 626 CA LYS A1141 1.449 29.758 11.983 1.00 10.05 C ATOM 627 C LYS A1141 2.086 29.670 10.610 1.00 11.58 C ATOM 628 O LYS A1141 2.300 30.679 9.979 1.00 13.29 O ATOM 629 CB LYS A1141 2.495 29.493 13.075 1.00 14.18 C ATOM 630 CG LYS A1141 2.037 29.939 14.467 1.00 9.53 C ATOM 631 CD LYS A1141 3.029 29.523 15.566 1.00 13.48 C ATOM 632 CE LYS A1141 4.279 30.391 15.521 1.00 10.54 C ATOM 633 NZ LYS A1141 5.159 30.198 16.747 1.00 12.47 N ATOM 634 HZ1 LYS A1141 4.622 30.450 17.601 1.00 0.00 H ATOM 635 HZ2 LYS A1141 5.458 29.204 16.804 1.00 0.00 H ATOM 636 HZ3 LYS A1141 5.997 30.809 16.671 1.00 0.00 H ATOM 637 H LYS A1141 0.416 27.961 12.691 1.00 0.00 H ATOM 638 N LEU A1142 2.303 28.449 10.120 1.00 12.48 N ATOM 639 CA LEU A1142 2.869 28.259 8.777 1.00 12.62 C ATOM 640 C LEU A1142 1.937 28.810 7.695 1.00 16.47 C ATOM 641 O LEU A1142 2.374 29.622 6.840 1.00 12.01 O ATOM 642 CB LEU A1142 3.259 26.780 8.526 1.00 12.11 C ATOM 643 CG LEU A1142 4.156 26.498 7.290 1.00 10.14 C ATOM 644 CD1 LEU A1142 5.465 27.206 7.347 1.00 7.62 C ATOM 645 CD2 LEU A1142 4.398 24.943 7.114 1.00 11.03 C ATOM 646 H LEU A1142 2.068 27.617 10.698 1.00 0.00 H ATOM 647 N ASP A1143 0.656 28.421 7.772 1.00 11.64 N ATOM 648 CA ASP A1143 -0.394 28.919 6.835 1.00 14.06 C ATOM 649 C ASP A1143 -0.527 30.422 6.777 1.00 12.62 C ATOM 650 O ASP A1143 -0.825 30.936 5.715 1.00 18.07 O ATOM 651 CB ASP A1143 -1.797 28.393 7.191 1.00 15.72 C ATOM 652 CG ASP A1143 -1.993 26.928 6.876 1.00 23.49 C ATOM 653 OD1 ASP A1143 -1.150 26.320 6.199 1.00 23.77 O ATOM 654 OD2 ASP A1143 -3.022 26.379 7.326 1.00 27.76 O ATOM 655 H ASP A1143 0.383 27.745 8.514 1.00 0.00 H ATOM 656 N THR A1144 -0.409 31.095 7.923 1.00 13.87 N ATOM 657 CA THR A1144 -0.555 32.566 8.011 1.00 19.80 C ATOM 658 C THR A1144 0.757 33.353 7.884 1.00 19.41 C ATOM 659 O THR A1144 0.791 34.589 8.107 1.00 17.79 O ATOM 660 CB THR A1144 -1.238 32.977 9.324 1.00 16.49 C ATOM 661 OG1 THR A1144 -0.565 32.369 10.442 1.00 14.57 O ATOM 662 CG2 THR A1144 -2.704 32.549 9.280 1.00 14.96 C ATOM 663 HG1 THR A1144 -0.600 31.384 10.351 1.00 0.00 H ATOM 664 H THR A1144 -0.205 30.563 8.793 1.00 0.00 H ATOM 665 N GLY A1145 1.835 32.657 7.542 1.00 14.22 N ATOM 666 CA GLY A1145 3.124 33.319 7.335 1.00 13.56 C ATOM 667 C GLY A1145 3.786 33.858 8.589 1.00 18.94 C ATOM 668 O GLY A1145 4.469 34.888 8.534 1.00 19.15 O ATOM 669 H GLY A1145 1.762 31.627 7.419 1.00 0.00 H ATOM 670 N GLN A1146 3.588 33.178 9.727 1.00 15.66 N ATOM 671 CA GLN A1146 4.128 33.706 10.988 1.00 17.10 C ATOM 672 C GLN A1146 5.587 33.340 11.136 1.00 15.54 C ATOM 673 O GLN A1146 6.302 33.979 11.911 1.00 19.34 O ATOM 674 CB GLN A1146 3.344 33.255 12.235 1.00 17.82 C ATOM 675 CG GLN A1146 1.962 33.931 12.371 1.00 21.42 C ATOM 676 CD GLN A1146 1.181 33.438 13.589 1.00 19.16 C ATOM 677 OE1 GLN A1146 1.661 33.551 14.716 1.00 20.90 O ATOM 678 NE2 GLN A1146 -0.046 32.945 13.363 1.00 19.57 N ATOM 679 HE22 GLN A1146 -0.405 32.870 12.390 1.00 0.00 H ATOM 680 HE21 GLN A1146 -0.638 32.637 14.161 1.00 0.00 H ATOM 681 H GLN A1146 3.057 32.284 9.718 1.00 0.00 H ATOM 682 N TYR A1147 6.050 32.343 10.378 1.00 10.07 N ATOM 683 CA TYR A1147 7.450 31.971 10.463 1.00 10.82 C ATOM 684 C TYR A1147 8.293 32.873 9.571 1.00 14.77 C ATOM 685 O TYR A1147 8.039 32.995 8.361 1.00 14.66 O ATOM 686 CB TYR A1147 7.653 30.516 10.113 1.00 11.47 C ATOM 687 CG TYR A1147 7.025 29.591 11.121 1.00 12.08 C ATOM 688 CD1 TYR A1147 7.453 29.595 12.459 1.00 15.06 C ATOM 689 CD2 TYR A1147 5.994 28.739 10.758 1.00 12.75 C ATOM 690 CE1 TYR A1147 6.880 28.767 13.383 1.00 13.36 C ATOM 691 CE2 TYR A1147 5.443 27.894 11.654 1.00 12.31 C ATOM 692 CZ TYR A1147 5.869 27.898 12.965 1.00 11.66 C ATOM 693 OH TYR A1147 5.253 27.029 13.828 1.00 15.26 O ATOM 694 HH TYR A1147 5.646 27.129 14.731 1.00 0.00 H ATOM 695 H TYR A1147 5.412 31.837 9.731 1.00 0.00 H ATOM 696 N GLN A1148 9.284 33.529 10.160 1.00 12.30 N ATOM 697 CA GLN A1148 10.118 34.479 9.378 1.00 14.09 C ATOM 698 C GLN A1148 11.475 33.913 8.993 1.00 14.75 C ATOM 699 O GLN A1148 12.160 34.463 8.113 1.00 14.00 O ATOM 700 CB GLN A1148 10.287 35.817 10.106 1.00 19.59 C ATOM 701 CG GLN A1148 9.011 36.626 10.200 1.00 26.83 C ATOM 702 CD GLN A1148 9.273 37.972 10.781 1.00 44.32 C ATOM 703 OE1 GLN A1148 9.699 38.081 11.927 1.00 34.36 O ATOM 704 NE2 GLN A1148 9.075 39.015 9.984 1.00 42.26 N ATOM 705 HE22 GLN A1148 8.712 38.871 9.020 1.00 0.00 H ATOM 706 HE21 GLN A1148 9.283 39.976 10.324 1.00 0.00 H ATOM 707 H GLN A1148 9.478 33.378 11.171 1.00 0.00 H ATOM 708 N GLU A1149 11.856 32.819 9.654 1.00 13.96 N ATOM 709 CA GLU A1149 13.081 32.072 9.378 1.00 10.99 C ATOM 710 C GLU A1149 12.750 30.601 9.391 1.00 12.03 C ATOM 711 O GLU A1149 11.903 30.172 10.142 1.00 11.58 O ATOM 712 CB GLU A1149 14.137 32.317 10.440 1.00 17.14 C ATOM 713 CG GLU A1149 14.505 33.754 10.563 1.00 13.96 C ATOM 714 CD GLU A1149 15.487 34.190 9.494 1.00 15.61 C ATOM 715 OE1 GLU A1149 15.631 33.507 8.434 1.00 16.40 O ATOM 716 OE2 GLU A1149 16.119 35.228 9.745 1.00 19.61 O ATOM 717 H GLU A1149 11.240 32.474 10.417 1.00 0.00 H ATOM 718 N PRO A1150 13.405 29.823 8.526 1.00 10.76 N ATOM 719 CA PRO A1150 13.084 28.389 8.488 1.00 13.71 C ATOM 720 C PRO A1150 13.249 27.686 9.818 1.00 11.58 C ATOM 721 O PRO A1150 12.451 26.795 10.134 1.00 9.52 O ATOM 722 CB PRO A1150 14.057 27.827 7.431 1.00 17.11 C ATOM 723 CG PRO A1150 15.091 28.864 7.253 1.00 17.65 C ATOM 724 CD PRO A1150 14.474 30.178 7.574 1.00 15.01 C ATOM 725 N TRP A1151 14.261 28.077 10.576 1.00 11.59 N ATOM 726 CA TRP A1151 14.566 27.449 11.870 1.00 12.42 C ATOM 727 C TRP A1151 13.476 27.683 12.948 1.00 11.77 C ATOM 728 O TRP A1151 13.376 26.915 13.885 1.00 12.23 O ATOM 729 CB TRP A1151 15.943 27.844 12.406 1.00 21.62 C ATOM 730 CG TRP A1151 16.142 29.298 12.618 1.00 13.41 C ATOM 731 CD1 TRP A1151 15.672 30.061 13.664 1.00 17.07 C ATOM 732 CD2 TRP A1151 16.874 30.198 11.759 1.00 20.13 C ATOM 733 NE1 TRP A1151 16.053 31.384 13.494 1.00 26.76 N ATOM 734 CE2 TRP A1151 16.808 31.488 12.351 1.00 25.20 C ATOM 735 CE3 TRP A1151 17.591 30.036 10.565 1.00 36.04 C ATOM 736 CZ2 TRP A1151 17.423 32.625 11.767 1.00 40.15 C ATOM 737 CZ3 TRP A1151 18.209 31.171 9.981 1.00 40.32 C ATOM 738 CH2 TRP A1151 18.117 32.448 10.588 1.00 29.00 C ATOM 739 HE1 TRP A1151 15.807 32.170 14.129 1.00 0.00 H ATOM 740 H TRP A1151 14.863 28.857 10.244 1.00 0.00 H ATOM 741 N GLN A1152 12.661 28.728 12.780 1.00 12.38 N ATOM 742 CA GLN A1152 11.561 29.001 13.690 1.00 11.14 C ATOM 743 C GLN A1152 10.457 27.930 13.564 1.00 11.54 C ATOM 744 O GLN A1152 9.846 27.501 14.557 1.00 10.96 O ATOM 745 CB GLN A1152 10.994 30.405 13.382 1.00 9.93 C ATOM 746 CG GLN A1152 11.896 31.581 13.783 1.00 7.97 C ATOM 747 CD GLN A1152 11.288 32.933 13.404 1.00 11.89 C ATOM 748 OE1 GLN A1152 10.421 33.018 12.524 1.00 15.35 O ATOM 749 NE2 GLN A1152 11.727 33.996 14.084 1.00 20.55 N ATOM 750 HE22 GLN A1152 12.457 33.880 14.816 1.00 0.00 H ATOM 751 HE21 GLN A1152 11.339 34.939 13.882 1.00 0.00 H ATOM 752 H GLN A1152 12.818 29.366 11.974 1.00 0.00 H ATOM 753 N TYR A1153 10.228 27.470 12.336 1.00 10.50 N ATOM 754 CA TYR A1153 9.291 26.360 12.126 1.00 9.58 C ATOM 755 C TYR A1153 9.854 25.046 12.745 1.00 7.39 C ATOM 756 O TYR A1153 9.165 24.358 13.507 1.00 10.30 O ATOM 757 CB TYR A1153 8.974 26.188 10.659 1.00 12.21 C ATOM 758 CG TYR A1153 8.398 24.851 10.291 1.00 12.73 C ATOM 759 CD1 TYR A1153 7.029 24.596 10.430 1.00 12.68 C ATOM 760 CD2 TYR A1153 9.189 23.866 9.715 1.00 10.81 C ATOM 761 CE1 TYR A1153 6.489 23.376 10.075 1.00 11.66 C ATOM 762 CE2 TYR A1153 8.639 22.644 9.346 1.00 11.91 C ATOM 763 CZ TYR A1153 7.281 22.413 9.531 1.00 7.44 C ATOM 764 OH TYR A1153 6.742 21.194 9.151 1.00 10.09 O ATOM 765 HH TYR A1153 6.885 21.060 8.181 1.00 0.00 H ATOM 766 H TYR A1153 10.715 27.899 11.523 1.00 0.00 H ATOM 767 N VAL A1154 11.107 24.744 12.422 1.00 8.55 N ATOM 768 CA VAL A1154 11.792 23.560 12.959 1.00 7.48 C ATOM 769 C VAL A1154 11.779 23.604 14.488 1.00 9.88 C ATOM 770 O VAL A1154 11.492 22.608 15.126 1.00 10.18 O ATOM 771 CB VAL A1154 13.218 23.452 12.458 1.00 7.62 C ATOM 772 CG1 VAL A1154 14.026 22.338 13.175 1.00 10.91 C ATOM 773 CG2 VAL A1154 13.263 23.284 10.874 1.00 8.42 C ATOM 774 H VAL A1154 11.621 25.367 11.767 1.00 0.00 H ATOM 775 N ASP A1155 12.119 24.749 15.058 1.00 8.27 N ATOM 776 CA ASP A1155 12.040 24.927 16.525 1.00 8.53 C ATOM 777 C ASP A1155 10.661 24.565 17.096 1.00 9.70 C ATOM 778 O ASP A1155 10.603 23.994 18.174 1.00 10.52 O ATOM 779 CB ASP A1155 12.431 26.351 16.953 1.00 11.31 C ATOM 780 CG ASP A1155 13.960 26.603 16.883 1.00 15.35 C ATOM 781 OD1 ASP A1155 14.735 25.609 16.786 1.00 16.90 O ATOM 782 OD2 ASP A1155 14.358 27.797 16.904 1.00 28.29 O ATOM 783 H ASP A1155 12.447 25.537 14.465 1.00 0.00 H ATOM 784 N ASP A1156 9.566 24.913 16.407 1.00 10.59 N ATOM 785 CA ASP A1156 8.226 24.592 16.905 1.00 7.27 C ATOM 786 C ASP A1156 7.915 23.101 16.798 1.00 7.21 C ATOM 787 O ASP A1156 7.314 22.519 17.714 1.00 9.69 O ATOM 788 CB ASP A1156 7.111 25.425 16.228 1.00 9.37 C ATOM 789 CG ASP A1156 6.825 26.755 16.929 1.00 21.27 C ATOM 790 OD1 ASP A1156 7.353 27.006 18.042 1.00 12.80 O ATOM 791 OD2 ASP A1156 6.034 27.546 16.352 1.00 11.61 O ATOM 792 H ASP A1156 9.669 25.419 15.504 1.00 0.00 H ATOM 793 N VAL A1157 8.342 22.465 15.720 1.00 7.54 N ATOM 794 CA VAL A1157 8.150 21.024 15.579 1.00 7.30 C ATOM 795 C VAL A1157 8.912 20.345 16.738 1.00 10.10 C ATOM 796 O VAL A1157 8.359 19.540 17.459 1.00 9.42 O ATOM 797 CB VAL A1157 8.610 20.527 14.219 1.00 10.25 C ATOM 798 CG1 VAL A1157 8.575 18.995 14.184 1.00 9.83 C ATOM 799 CG2 VAL A1157 7.713 21.131 13.099 1.00 12.80 C ATOM 800 H VAL A1157 8.820 22.997 14.964 1.00 0.00 H ATOM 801 N TRP A1158 10.180 20.694 16.910 1.00 7.59 N ATOM 802 CA TRP A1158 10.979 20.102 17.975 1.00 10.04 C ATOM 803 C TRP A1158 10.421 20.347 19.369 1.00 9.09 C ATOM 804 O TRP A1158 10.490 19.449 20.224 1.00 9.66 O ATOM 805 CB TRP A1158 12.449 20.552 17.917 1.00 12.06 C ATOM 806 CG TRP A1158 13.241 20.048 16.753 1.00 11.80 C ATOM 807 CD1 TRP A1158 12.931 19.028 15.907 1.00 27.34 C ATOM 808 CD2 TRP A1158 14.511 20.542 16.347 1.00 23.35 C ATOM 809 NE1 TRP A1158 13.928 18.867 14.976 1.00 17.11 N ATOM 810 CE2 TRP A1158 14.924 19.770 15.236 1.00 26.85 C ATOM 811 CE3 TRP A1158 15.363 21.562 16.833 1.00 30.36 C ATOM 812 CZ2 TRP A1158 16.149 19.998 14.572 1.00 25.90 C ATOM 813 CZ3 TRP A1158 16.587 21.773 16.194 1.00 22.52 C ATOM 814 CH2 TRP A1158 16.965 20.995 15.069 1.00 19.75 C ATOM 815 HE1 TRP A1158 13.927 18.173 14.201 1.00 0.00 H ATOM 816 H TRP A1158 10.609 21.399 16.277 1.00 0.00 H ATOM 817 N LEU A1159 9.902 21.541 19.622 1.00 7.30 N ATOM 818 CA LEU A1159 9.215 21.852 20.903 1.00 11.82 C ATOM 819 C LEU A1159 8.015 20.899 21.202 1.00 8.43 C ATOM 820 O LEU A1159 7.879 20.366 22.313 1.00 9.68 O ATOM 821 CB LEU A1159 8.727 23.300 20.909 1.00 11.14 C ATOM 822 CG LEU A1159 7.914 23.819 22.115 1.00 7.35 C ATOM 823 CD1 LEU A1159 8.713 23.708 23.427 1.00 10.71 C ATOM 824 CD2 LEU A1159 7.460 25.287 21.833 1.00 11.76 C ATOM 825 H LEU A1159 9.978 22.285 18.899 1.00 0.00 H ATOM 826 N MET A1160 7.158 20.716 20.212 1.00 8.35 N ATOM 827 CA MET A1160 6.090 19.723 20.261 1.00 9.11 C ATOM 828 C MET A1160 6.619 18.342 20.655 1.00 10.85 C ATOM 829 O MET A1160 6.082 17.682 21.555 1.00 8.63 O ATOM 830 CB MET A1160 5.412 19.672 18.899 1.00 9.94 C ATOM 831 CG MET A1160 4.250 18.700 18.820 1.00 8.76 C ATOM 832 SD MET A1160 3.432 18.612 17.230 1.00 10.39 S ATOM 833 CE MET A1160 4.751 18.127 16.124 1.00 12.23 C ATOM 834 H MET A1160 7.249 21.306 19.360 1.00 0.00 H ATOM 835 N PHE A1161 7.659 17.883 19.964 1.00 9.71 N ATOM 836 CA PHE A1161 8.240 16.561 20.300 1.00 10.94 C ATOM 837 C PHE A1161 8.803 16.512 21.700 1.00 10.20 C ATOM 838 O PHE A1161 8.508 15.601 22.483 1.00 8.99 O ATOM 839 CB PHE A1161 9.299 16.158 19.320 1.00 10.81 C ATOM 840 CG PHE A1161 8.767 15.947 17.909 1.00 7.35 C ATOM 841 CD1 PHE A1161 7.472 15.527 17.674 1.00 8.32 C ATOM 842 CD2 PHE A1161 9.592 16.191 16.826 1.00 10.82 C ATOM 843 CE1 PHE A1161 6.963 15.356 16.366 1.00 8.35 C ATOM 844 CE2 PHE A1161 9.123 16.034 15.520 1.00 11.28 C ATOM 845 CZ PHE A1161 7.815 15.605 15.276 1.00 10.26 C ATOM 846 H PHE A1161 8.063 18.449 19.191 1.00 0.00 H ATOM 847 N ASN A1162 9.565 17.531 22.024 1.00 8.19 N ATOM 848 CA ASN A1162 10.257 17.588 23.312 1.00 10.91 C ATOM 849 C ASN A1162 9.282 17.713 24.483 1.00 12.09 C ATOM 850 O ASN A1162 9.507 17.086 25.512 1.00 10.46 O ATOM 851 CB ASN A1162 11.311 18.710 23.358 1.00 11.72 C ATOM 852 CG ASN A1162 12.559 18.394 22.526 1.00 18.80 C ATOM 853 OD1 ASN A1162 12.930 17.242 22.319 1.00 22.09 O ATOM 854 ND2 ASN A1162 13.204 19.440 22.058 1.00 17.18 N ATOM 855 HD22 ASN A1162 12.854 20.399 22.258 1.00 0.00 H ATOM 856 HD21 ASN A1162 14.064 19.308 21.488 1.00 0.00 H ATOM 857 H ASN A1162 9.679 18.315 21.350 1.00 0.00 H ATOM 858 N ASN A1163 8.197 18.466 24.316 1.00 12.35 N ATOM 859 CA ASN A1163 7.145 18.487 25.317 1.00 7.67 C ATOM 860 C ASN A1163 6.590 17.094 25.587 1.00 9.05 C ATOM 861 O ASN A1163 6.399 16.713 26.750 1.00 7.23 O ATOM 862 CB ASN A1163 5.994 19.417 24.903 1.00 11.65 C ATOM 863 CG ASN A1163 6.366 20.899 24.961 1.00 10.43 C ATOM 864 OD1 ASN A1163 7.374 21.276 25.571 1.00 10.77 O ATOM 865 ND2 ASN A1163 5.556 21.739 24.313 1.00 7.27 N ATOM 866 HD22 ASN A1163 4.720 21.374 23.814 1.00 0.00 H ATOM 867 HD21 ASN A1163 5.761 22.759 24.307 1.00 0.00 H ATOM 868 H ASN A1163 8.102 19.046 23.458 1.00 0.00 H ATOM 869 N ALA A1164 6.279 16.361 24.519 1.00 8.93 N ATOM 870 CA ALA A1164 5.672 15.016 24.596 1.00 10.49 C ATOM 871 C ALA A1164 6.618 14.019 25.267 1.00 12.95 C ATOM 872 O ALA A1164 6.224 13.223 26.119 1.00 10.69 O ATOM 873 CB ALA A1164 5.294 14.545 23.176 1.00 7.58 C ATOM 874 H ALA A1164 6.474 16.758 23.578 1.00 0.00 H ATOM 875 N TRP A1165 7.889 14.092 24.924 1.00 9.75 N ATOM 876 CA TRP A1165 8.906 13.211 25.546 1.00 12.60 C ATOM 877 C TRP A1165 9.176 13.595 27.016 1.00 10.76 C ATOM 878 O TRP A1165 9.446 12.743 27.864 1.00 11.59 O ATOM 879 CB TRP A1165 10.226 13.241 24.757 1.00 11.99 C ATOM 880 CG TRP A1165 10.259 12.534 23.442 1.00 7.89 C ATOM 881 CD1 TRP A1165 9.701 11.342 23.131 1.00 9.45 C ATOM 882 CD2 TRP A1165 10.985 12.951 22.283 1.00 9.57 C ATOM 883 NE1 TRP A1165 9.985 11.003 21.832 1.00 12.13 N ATOM 884 CE2 TRP A1165 10.778 11.971 21.283 1.00 9.63 C ATOM 885 CE3 TRP A1165 11.743 14.091 21.976 1.00 15.72 C ATOM 886 CZ2 TRP A1165 11.328 12.077 19.983 1.00 16.17 C ATOM 887 CZ3 TRP A1165 12.288 14.196 20.702 1.00 13.86 C ATOM 888 CH2 TRP A1165 12.084 13.190 19.719 1.00 14.29 C ATOM 889 HE1 TRP A1165 9.651 10.148 21.344 1.00 0.00 H ATOM 890 H TRP A1165 8.184 14.781 24.203 1.00 0.00 H ATOM 891 N LEU A1166 9.093 14.882 27.328 1.00 9.41 N ATOM 892 CA LEU A1166 9.224 15.329 28.725 1.00 8.80 C ATOM 893 C LEU A1166 8.063 14.814 29.599 1.00 8.78 C ATOM 894 O LEU A1166 8.296 14.320 30.696 1.00 12.52 O ATOM 895 CB LEU A1166 9.238 16.855 28.806 1.00 7.61 C ATOM 896 CG LEU A1166 9.330 17.519 30.198 1.00 11.19 C ATOM 897 CD1 LEU A1166 10.594 17.129 30.936 1.00 11.32 C ATOM 898 CD2 LEU A1166 9.181 19.029 30.011 1.00 10.27 C ATOM 899 H LEU A1166 8.934 15.583 26.577 1.00 0.00 H ATOM 900 N TYR A1167 6.830 15.023 29.129 1.00 8.14 N ATOM 901 CA TYR A1167 5.637 14.815 29.957 1.00 9.39 C ATOM 902 C TYR A1167 5.330 13.333 30.116 1.00 8.03 C ATOM 903 O TYR A1167 5.048 12.858 31.227 1.00 9.52 O ATOM 904 CB TYR A1167 4.405 15.579 29.416 1.00 7.31 C ATOM 905 CG TYR A1167 3.281 15.397 30.379 1.00 9.38 C ATOM 906 CD1 TYR A1167 3.296 16.068 31.619 1.00 13.43 C ATOM 907 CD2 TYR A1167 2.306 14.415 30.176 1.00 13.77 C ATOM 908 CE1 TYR A1167 2.298 15.827 32.602 1.00 16.79 C ATOM 909 CE2 TYR A1167 1.313 14.182 31.141 1.00 16.22 C ATOM 910 CZ TYR A1167 1.327 14.893 32.355 1.00 17.04 C ATOM 911 OH TYR A1167 0.352 14.649 33.280 1.00 14.67 O ATOM 912 HH TYR A1167 0.500 15.224 34.073 1.00 0.00 H ATOM 913 H TYR A1167 6.712 15.343 28.146 1.00 0.00 H ATOM 914 N ASN A1168 5.454 12.604 28.999 1.00 10.66 N ATOM 915 CA ASN A1168 4.952 11.240 28.917 1.00 11.46 C ATOM 916 C ASN A1168 6.017 10.245 29.337 1.00 9.79 C ATOM 917 O ASN A1168 7.224 10.429 29.092 1.00 11.26 O ATOM 918 CB ASN A1168 4.442 10.927 27.509 1.00 9.92 C ATOM 919 CG ASN A1168 3.226 11.744 27.138 1.00 7.43 C ATOM 920 OD1 ASN A1168 2.107 11.421 27.534 1.00 10.96 O ATOM 921 ND2 ASN A1168 3.454 12.871 26.444 1.00 9.19 N ATOM 922 HD22 ASN A1168 4.418 13.102 26.130 1.00 0.00 H ATOM 923 HD21 ASN A1168 2.666 13.512 26.221 1.00 0.00 H ATOM 924 H ASN A1168 5.921 13.023 28.169 1.00 0.00 H ATOM 925 N ARG A1169 5.550 9.159 29.947 1.00 13.37 N ATOM 926 CA ARG A1169 6.445 8.088 30.357 1.00 14.03 C ATOM 927 C ARG A1169 7.103 7.448 29.123 1.00 15.78 C ATOM 928 O ARG A1169 6.472 7.336 28.091 1.00 13.29 O ATOM 929 CB ARG A1169 5.659 7.078 31.176 1.00 14.43 C ATOM 930 CG ARG A1169 6.464 6.068 31.945 1.00 15.77 C ATOM 931 CD ARG A1169 5.518 5.138 32.758 1.00 12.95 C ATOM 932 NE ARG A1169 6.134 3.864 33.099 1.00 15.52 N ATOM 933 CZ ARG A1169 5.594 2.946 33.911 1.00 20.81 C ATOM 934 NH1 ARG A1169 4.406 3.128 34.492 1.00 17.21 N ATOM 935 NH2 ARG A1169 6.243 1.821 34.129 1.00 18.79 N ATOM 936 HE ARG A1169 7.062 3.651 32.681 1.00 0.00 H ATOM 937 HH12 ARG A1169 4.015 2.395 35.117 1.00 0.00 H ATOM 938 HH11 ARG A1169 3.871 4.003 34.319 1.00 0.00 H ATOM 939 HH22 ARG A1169 5.836 1.099 34.757 1.00 0.00 H ATOM 940 HH21 ARG A1169 7.163 1.654 33.673 1.00 0.00 H ATOM 941 H ARG A1169 4.530 9.074 30.133 1.00 0.00 H ATOM 942 N LYS A1170 8.378 7.041 29.231 1.00 12.75 N ATOM 943 CA LYS A1170 9.114 6.487 28.079 1.00 10.51 C ATOM 944 C LYS A1170 8.468 5.232 27.534 1.00 11.83 C ATOM 945 O LYS A1170 8.616 4.932 26.375 1.00 12.84 O ATOM 946 CB LYS A1170 10.577 6.185 28.413 1.00 14.07 C ATOM 947 CG LYS A1170 11.412 7.417 28.704 1.00 20.16 C ATOM 948 CD LYS A1170 12.650 7.123 29.552 1.00 37.76 C ATOM 949 CE LYS A1170 13.441 8.403 29.848 1.00 50.51 C ATOM 950 NZ LYS A1170 12.722 9.381 30.746 1.00 48.02 N ATOM 951 HZ1 LYS A1170 11.829 9.670 30.297 1.00 0.00 H ATOM 952 HZ2 LYS A1170 12.521 8.927 31.660 1.00 0.00 H ATOM 953 HZ3 LYS A1170 13.322 10.217 30.897 1.00 0.00 H ATOM 954 H LYS A1170 8.859 7.118 30.150 1.00 0.00 H ATOM 955 N THR A1171 7.755 4.506 28.384 1.00 12.08 N ATOM 956 CA THR A1171 7.045 3.302 27.970 1.00 13.76 C ATOM 957 C THR A1171 5.683 3.562 27.294 1.00 12.91 C ATOM 958 O THR A1171 5.094 2.645 26.735 1.00 16.93 O ATOM 959 CB THR A1171 6.876 2.389 29.185 1.00 13.65 C ATOM 960 OG1 THR A1171 6.240 3.112 30.255 1.00 12.70 O ATOM 961 CG2 THR A1171 8.248 1.963 29.664 1.00 16.38 C ATOM 962 HG1 THR A1171 5.350 3.427 29.956 1.00 0.00 H ATOM 963 H THR A1171 7.700 4.805 29.379 1.00 0.00 H ATOM 964 N SER A1172 5.207 4.808 27.317 1.00 12.13 N ATOM 965 CA SER A1172 3.845 5.112 26.963 1.00 11.61 C ATOM 966 C SER A1172 3.639 5.142 25.448 1.00 14.12 C ATOM 967 O SER A1172 4.601 5.363 24.657 1.00 9.76 O ATOM 968 CB SER A1172 3.408 6.447 27.573 1.00 14.15 C ATOM 969 OG SER A1172 4.055 7.502 26.941 1.00 7.96 O ATOM 970 HG SER A1172 5.034 7.401 27.051 1.00 0.00 H ATOM 971 H SER A1172 5.839 5.584 27.599 1.00 0.00 H ATOM 972 N ARG A1173 2.379 4.902 25.069 1.00 14.86 N ATOM 973 CA ARG A1173 1.925 4.940 23.669 1.00 13.67 C ATOM 974 C ARG A1173 2.220 6.291 23.015 1.00 12.03 C ATOM 975 O ARG A1173 2.708 6.332 21.912 1.00 14.86 O ATOM 976 CB ARG A1173 0.432 4.665 23.587 1.00 12.78 C ATOM 977 CG ARG A1173 -0.145 4.546 22.186 1.00 13.37 C ATOM 978 CD ARG A1173 -1.566 3.979 22.310 1.00 11.65 C ATOM 979 NE ARG A1173 -2.281 3.858 21.035 1.00 14.03 N ATOM 980 CZ ARG A1173 -2.889 4.849 20.387 1.00 15.89 C ATOM 981 NH1 ARG A1173 -2.861 6.082 20.848 1.00 14.16 N ATOM 982 NH2 ARG A1173 -3.508 4.598 19.247 1.00 16.99 N ATOM 983 HE ARG A1173 -2.316 2.915 20.599 1.00 0.00 H ATOM 984 HH12 ARG A1173 -3.342 6.843 20.327 1.00 0.00 H ATOM 985 HH11 ARG A1173 -2.358 6.295 21.733 1.00 0.00 H ATOM 986 HH22 ARG A1173 -3.986 5.367 18.734 1.00 0.00 H ATOM 987 HH21 ARG A1173 -3.518 3.632 18.862 1.00 0.00 H ATOM 988 H ARG A1173 1.680 4.676 25.805 1.00 0.00 H ATOM 989 N VAL A1174 1.968 7.375 23.733 1.00 7.84 N ATOM 990 CA VAL A1174 2.180 8.723 23.197 1.00 12.99 C ATOM 991 C VAL A1174 3.674 8.991 23.008 1.00 10.82 C ATOM 992 O VAL A1174 4.064 9.568 21.991 1.00 9.94 O ATOM 993 CB VAL A1174 1.462 9.839 24.070 1.00 7.54 C ATOM 994 CG1 VAL A1174 1.959 11.259 23.704 1.00 13.40 C ATOM 995 CG2 VAL A1174 -0.106 9.708 23.991 1.00 10.43 C ATOM 996 H VAL A1174 1.610 7.267 24.703 1.00 0.00 H ATOM 997 N TYR A1175 4.513 8.596 23.974 1.00 14.37 N ATOM 998 CA TYR A1175 5.977 8.730 23.835 1.00 11.50 C ATOM 999 C TYR A1175 6.488 7.979 22.573 1.00 10.38 C ATOM 1000 O TYR A1175 7.239 8.538 21.784 1.00 11.62 O ATOM 1001 CB TYR A1175 6.681 8.171 25.060 1.00 9.97 C ATOM 1002 CG TYR A1175 8.137 8.496 25.186 1.00 13.67 C ATOM 1003 CD1 TYR A1175 9.092 7.836 24.426 1.00 10.28 C ATOM 1004 CD2 TYR A1175 8.561 9.485 26.057 1.00 13.07 C ATOM 1005 CE1 TYR A1175 10.462 8.155 24.534 1.00 15.35 C ATOM 1006 CE2 TYR A1175 9.910 9.799 26.196 1.00 12.03 C ATOM 1007 CZ TYR A1175 10.855 9.122 25.431 1.00 11.85 C ATOM 1008 OH TYR A1175 12.176 9.432 25.561 1.00 16.11 O ATOM 1009 HH TYR A1175 12.314 10.385 25.331 1.00 0.00 H ATOM 1010 H TYR A1175 4.123 8.184 24.846 1.00 0.00 H ATOM 1011 N LYS A1176 6.093 6.710 22.410 1.00 9.01 N ATOM 1012 CA LYS A1176 6.506 5.900 21.214 1.00 9.15 C ATOM 1013 C LYS A1176 6.024 6.570 19.907 1.00 14.84 C ATOM 1014 O LYS A1176 6.761 6.628 18.901 1.00 12.39 O ATOM 1015 CB LYS A1176 6.006 4.456 21.267 1.00 15.41 C ATOM 1016 CG LYS A1176 5.937 3.737 22.636 1.00 41.03 C ATOM 1017 CD LYS A1176 7.179 3.775 23.544 1.00 35.40 C ATOM 1018 CE LYS A1176 7.902 2.403 23.569 1.00 52.37 C ATOM 1019 NZ LYS A1176 7.012 1.220 23.923 1.00 25.75 N ATOM 1020 HZ1 LYS A1176 6.607 1.364 24.870 1.00 0.00 H ATOM 1021 HZ2 LYS A1176 6.245 1.143 23.224 1.00 0.00 H ATOM 1022 HZ3 LYS A1176 7.578 0.348 23.916 1.00 0.00 H ATOM 1023 H LYS A1176 5.484 6.273 23.131 1.00 0.00 H ATOM 1024 N PHE A1177 4.791 7.072 19.919 1.00 12.64 N ATOM 1025 CA PHE A1177 4.236 7.816 18.770 1.00 16.30 C ATOM 1026 C PHE A1177 5.041 9.069 18.484 1.00 11.01 C ATOM 1027 O PHE A1177 5.328 9.370 17.341 1.00 11.34 O ATOM 1028 CB PHE A1177 2.765 8.180 18.991 1.00 13.72 C ATOM 1029 CG PHE A1177 1.789 7.020 18.796 1.00 10.72 C ATOM 1030 CD1 PHE A1177 2.223 5.697 18.717 1.00 10.18 C ATOM 1031 CD2 PHE A1177 0.415 7.285 18.734 1.00 10.72 C ATOM 1032 CE1 PHE A1177 1.327 4.641 18.546 1.00 10.79 C ATOM 1033 CE2 PHE A1177 -0.493 6.246 18.556 1.00 12.69 C ATOM 1034 CZ PHE A1177 -0.034 4.912 18.454 1.00 9.54 C ATOM 1035 H PHE A1177 4.200 6.936 20.764 1.00 0.00 H ATOM 1036 N CYS A1178 5.417 9.808 19.526 1.00 10.19 N ATOM 1037 CA CYS A1178 6.302 10.969 19.356 1.00 13.32 C ATOM 1038 C CYS A1178 7.563 10.579 18.609 1.00 8.72 C ATOM 1039 O CYS A1178 7.913 11.222 17.613 1.00 11.30 O ATOM 1040 CB CYS A1178 6.672 11.578 20.715 1.00 7.86 C ATOM 1041 SG CYS A1178 7.532 13.112 20.509 1.00 11.21 S ATOM 1042 H CYS A1178 5.078 9.559 20.477 1.00 0.00 H ATOM 1043 N SER A1179 8.194 9.497 19.041 1.00 10.47 N ATOM 1044 CA SER A1179 9.478 9.058 18.487 1.00 14.65 C ATOM 1045 C SER A1179 9.337 8.729 16.981 1.00 11.38 C ATOM 1046 O SER A1179 10.223 9.035 16.173 1.00 9.36 O ATOM 1047 CB SER A1179 10.027 7.862 19.293 1.00 16.98 C ATOM 1048 OG SER A1179 10.347 8.243 20.631 1.00 14.53 O ATOM 1049 HG SER A1179 10.696 7.457 21.122 1.00 0.00 H ATOM 1050 H SER A1179 7.761 8.937 19.803 1.00 0.00 H ATOM 1051 N LYS A1180 8.208 8.109 16.623 1.00 18.47 N ATOM 1052 CA LYS A1180 7.888 7.784 15.222 1.00 17.19 C ATOM 1053 C LYS A1180 7.691 9.059 14.398 1.00 14.69 C ATOM 1054 O LYS A1180 8.238 9.168 13.329 1.00 15.19 O ATOM 1055 CB LYS A1180 6.631 6.917 15.110 1.00 18.14 C ATOM 1056 CG LYS A1180 6.093 6.754 13.685 1.00 16.97 C ATOM 1057 CD LYS A1180 7.039 5.971 12.781 1.00 26.55 C ATOM 1058 CE LYS A1180 6.555 6.026 11.332 1.00 23.24 C ATOM 1059 NZ LYS A1180 7.309 5.099 10.480 1.00 24.16 N ATOM 1060 HZ1 LYS A1180 8.317 5.352 10.502 1.00 0.00 H ATOM 1061 HZ2 LYS A1180 7.187 4.128 10.833 1.00 0.00 H ATOM 1062 HZ3 LYS A1180 6.955 5.162 9.504 1.00 0.00 H ATOM 1063 H LYS A1180 7.528 7.845 17.364 1.00 0.00 H ATOM 1064 N LEU A1181 6.929 10.028 14.907 1.00 12.07 N ATOM 1065 CA LEU A1181 6.843 11.324 14.228 1.00 13.26 C ATOM 1066 C LEU A1181 8.192 12.003 14.059 1.00 13.22 C ATOM 1067 O LEU A1181 8.471 12.559 13.000 1.00 11.30 O ATOM 1068 CB LEU A1181 5.878 12.276 14.937 1.00 11.70 C ATOM 1069 CG LEU A1181 4.409 11.911 14.923 1.00 15.77 C ATOM 1070 CD1 LEU A1181 3.628 13.023 15.621 1.00 10.31 C ATOM 1071 CD2 LEU A1181 3.877 11.679 13.534 1.00 15.62 C ATOM 1072 H LEU A1181 6.396 9.864 15.785 1.00 0.00 H ATOM 1073 N ALA A1182 8.998 11.980 15.112 1.00 12.28 N ATOM 1074 CA ALA A1182 10.303 12.600 15.098 1.00 12.09 C ATOM 1075 C ALA A1182 11.166 11.987 14.004 1.00 16.59 C ATOM 1076 O ALA A1182 11.901 12.685 13.326 1.00 11.43 O ATOM 1077 CB ALA A1182 10.948 12.461 16.465 1.00 9.07 C ATOM 1078 H ALA A1182 8.680 11.499 15.978 1.00 0.00 H ATOM 1079 N GLU A1183 11.012 10.686 13.777 1.00 15.14 N ATOM 1080 CA GLU A1183 11.802 10.000 12.786 1.00 15.49 C ATOM 1081 C GLU A1183 11.365 10.391 11.375 1.00 13.76 C ATOM 1082 O GLU A1183 12.187 10.652 10.521 1.00 15.29 O ATOM 1083 CB GLU A1183 11.673 8.495 12.979 1.00 18.15 C ATOM 1084 CG GLU A1183 12.503 7.696 12.028 1.00 37.18 C ATOM 1085 CD GLU A1183 12.455 6.248 12.370 1.00 48.77 C ATOM 1086 OE1 GLU A1183 13.284 5.811 13.202 1.00 42.75 O ATOM 1087 OE2 GLU A1183 11.565 5.566 11.820 1.00 31.59 O ATOM 1088 H GLU A1183 10.307 10.153 14.326 1.00 0.00 H ATOM 1089 N VAL A1184 10.059 10.358 11.133 1.00 9.52 N ATOM 1090 CA VAL A1184 9.460 10.855 9.882 1.00 13.70 C ATOM 1091 C VAL A1184 9.922 12.306 9.616 1.00 12.23 C ATOM 1092 O VAL A1184 10.356 12.659 8.481 1.00 14.78 O ATOM 1093 CB VAL A1184 7.894 10.789 9.954 1.00 10.77 C ATOM 1094 CG1 VAL A1184 7.208 11.610 8.831 1.00 15.57 C ATOM 1095 CG2 VAL A1184 7.405 9.317 9.997 1.00 11.71 C ATOM 1096 H VAL A1184 9.430 9.963 11.861 1.00 0.00 H ATOM 1097 N PHE A1185 9.889 13.149 10.651 1.00 11.67 N ATOM 1098 CA PHE A1185 10.259 14.580 10.466 1.00 12.65 C ATOM 1099 C PHE A1185 11.715 14.758 10.075 1.00 10.35 C ATOM 1100 O PHE A1185 12.029 15.508 9.164 1.00 13.36 O ATOM 1101 CB PHE A1185 10.024 15.387 11.731 1.00 7.85 C ATOM 1102 CG PHE A1185 10.219 16.867 11.548 1.00 7.73 C ATOM 1103 CD1 PHE A1185 9.378 17.592 10.705 1.00 8.82 C ATOM 1104 CD2 PHE A1185 11.251 17.530 12.210 1.00 9.76 C ATOM 1105 CE1 PHE A1185 9.570 18.992 10.535 1.00 10.10 C ATOM 1106 CE2 PHE A1185 11.446 18.900 12.051 1.00 10.84 C ATOM 1107 CZ PHE A1185 10.610 19.637 11.220 1.00 14.30 C ATOM 1108 H PHE A1185 9.604 12.805 11.590 1.00 0.00 H ATOM 1109 N GLU A1186 12.590 14.060 10.774 1.00 14.79 N ATOM 1110 CA GLU A1186 14.012 14.085 10.472 1.00 18.41 C ATOM 1111 C GLU A1186 14.262 13.738 8.968 1.00 20.68 C ATOM 1112 O GLU A1186 14.951 14.463 8.224 1.00 19.20 O ATOM 1113 CB GLU A1186 14.674 13.055 11.362 1.00 19.68 C ATOM 1114 CG GLU A1186 16.208 13.016 11.338 1.00 33.64 C ATOM 1115 CD GLU A1186 16.797 11.581 11.232 1.00 50.65 C ATOM 1116 OE1 GLU A1186 16.107 10.594 11.603 1.00 43.80 O ATOM 1117 OE2 GLU A1186 17.957 11.448 10.767 1.00 48.84 O ATOM 1118 H GLU A1186 12.252 13.475 11.564 1.00 0.00 H ATOM 1119 N GLN A1187 13.670 12.634 8.530 1.00 20.55 N ATOM 1120 CA GLN A1187 13.800 12.161 7.140 1.00 24.79 C ATOM 1121 C GLN A1187 13.236 13.153 6.106 1.00 26.48 C ATOM 1122 O GLN A1187 13.748 13.290 4.971 1.00 23.13 O ATOM 1123 CB GLN A1187 13.116 10.790 7.027 1.00 28.16 C ATOM 1124 CG GLN A1187 13.829 9.702 7.868 1.00 38.82 C ATOM 1125 CD GLN A1187 13.171 8.325 7.768 1.00 58.68 C ATOM 1126 OE1 GLN A1187 12.158 8.151 7.081 1.00 62.53 O ATOM 1127 NE2 GLN A1187 13.745 7.343 8.463 1.00 49.15 N ATOM 1128 HE22 GLN A1187 14.597 7.535 9.028 1.00 0.00 H ATOM 1129 HE21 GLN A1187 13.341 6.385 8.440 1.00 0.00 H ATOM 1130 H GLN A1187 13.091 12.081 9.194 1.00 0.00 H ATOM 1131 N GLU A1188 12.198 13.868 6.513 1.00 18.63 N ATOM 1132 CA GLU A1188 11.520 14.840 5.658 1.00 21.14 C ATOM 1133 C GLU A1188 12.261 16.181 5.591 1.00 21.75 C ATOM 1134 O GLU A1188 12.398 16.761 4.511 1.00 16.61 O ATOM 1135 CB GLU A1188 10.074 15.076 6.137 1.00 25.27 C ATOM 1136 CG GLU A1188 9.083 14.026 5.648 1.00 23.97 C ATOM 1137 CD GLU A1188 8.848 14.091 4.126 1.00 39.86 C ATOM 1138 OE1 GLU A1188 8.586 15.196 3.593 1.00 44.76 O ATOM 1139 OE2 GLU A1188 8.927 13.038 3.472 1.00 41.32 O ATOM 1140 H GLU A1188 11.850 13.732 7.484 1.00 0.00 H ATOM 1141 N ILE A1189 12.726 16.664 6.746 1.00 22.99 N ATOM 1142 CA ILE A1189 13.259 18.037 6.863 1.00 14.17 C ATOM 1143 C ILE A1189 14.687 18.201 6.270 1.00 16.67 C ATOM 1144 O ILE A1189 15.033 19.287 5.818 1.00 14.63 O ATOM 1145 CB ILE A1189 13.203 18.516 8.362 1.00 17.64 C ATOM 1146 CG1 ILE A1189 13.376 20.046 8.494 1.00 17.24 C ATOM 1147 CG2 ILE A1189 14.224 17.742 9.221 1.00 18.33 C ATOM 1148 CD1 ILE A1189 12.322 20.902 7.768 1.00 20.67 C ATOM 1149 H ILE A1189 12.713 16.055 7.589 1.00 0.00 H ATOM 1150 N ASP A1190 15.512 17.158 6.272 1.00 15.18 N ATOM 1151 CA ASP A1190 16.927 17.338 5.913 1.00 22.67 C ATOM 1152 C ASP A1190 17.078 17.797 4.446 1.00 21.31 C ATOM 1153 O ASP A1190 17.778 18.789 4.195 1.00 19.13 O ATOM 1154 CB ASP A1190 17.767 16.079 6.191 1.00 25.71 C ATOM 1155 CG ASP A1190 18.177 15.931 7.678 1.00 44.25 C ATOM 1156 OD1 ASP A1190 17.728 16.727 8.557 1.00 31.65 O ATOM 1157 OD2 ASP A1190 18.966 14.990 7.952 1.00 37.55 O ATOM 1158 H ASP A1190 15.157 16.215 6.528 1.00 0.00 H ATOM 1159 N PRO A1191 16.407 17.107 3.482 1.00 21.28 N ATOM 1160 CA PRO A1191 16.495 17.568 2.079 1.00 25.32 C ATOM 1161 C PRO A1191 15.812 18.900 1.821 1.00 27.01 C ATOM 1162 O PRO A1191 16.230 19.647 0.927 1.00 23.00 O ATOM 1163 CB PRO A1191 15.758 16.474 1.288 1.00 26.13 C ATOM 1164 CG PRO A1191 14.964 15.730 2.292 1.00 34.43 C ATOM 1165 CD PRO A1191 15.747 15.791 3.561 1.00 26.81 C ATOM 1166 N VAL A1192 14.739 19.184 2.558 1.00 22.70 N ATOM 1167 CA VAL A1192 14.083 20.489 2.432 1.00 22.01 C ATOM 1168 C VAL A1192 15.029 21.610 2.880 1.00 22.62 C ATOM 1169 O VAL A1192 15.154 22.623 2.200 1.00 24.23 O ATOM 1170 CB VAL A1192 12.755 20.565 3.225 1.00 19.82 C ATOM 1171 CG1 VAL A1192 12.269 21.985 3.273 1.00 15.43 C ATOM 1172 CG2 VAL A1192 11.695 19.662 2.562 1.00 19.52 C ATOM 1173 H VAL A1192 14.366 18.478 3.224 1.00 0.00 H ATOM 1174 N MET A1193 15.694 21.432 4.017 1.00 17.59 N ATOM 1175 CA MET A1193 16.634 22.456 4.479 1.00 25.50 C ATOM 1176 C MET A1193 17.840 22.570 3.529 1.00 35.32 C ATOM 1177 O MET A1193 18.389 23.660 3.371 1.00 39.73 O ATOM 1178 CB MET A1193 17.065 22.231 5.934 1.00 26.91 C ATOM 1179 CG MET A1193 15.914 22.425 6.974 1.00 31.16 C ATOM 1180 SD MET A1193 15.168 24.098 7.119 1.00 36.81 S ATOM 1181 CE MET A1193 16.413 24.955 8.086 1.00 51.91 C ATOM 1182 H MET A1193 15.547 20.568 4.577 1.00 0.00 H ATOM 1183 N GLN A1194 18.211 21.479 2.859 1.00 34.33 N ATOM 1184 CA GLN A1194 19.205 21.552 1.768 1.00 34.85 C ATOM 1185 C GLN A1194 18.684 22.332 0.533 1.00 32.29 C ATOM 1186 O GLN A1194 19.446 23.073 -0.090 1.00 36.08 O ATOM 1187 CB GLN A1194 19.694 20.142 1.357 1.00 36.18 C ATOM 1188 CG GLN A1194 20.528 19.409 2.417 1.00 35.38 C ATOM 1189 H GLN A1194 17.793 20.560 3.109 1.00 0.00 H ATOM 1190 N SER A1195 17.408 22.165 0.173 1.00 30.86 N ATOM 1191 CA SER A1195 16.766 22.975 -0.888 1.00 30.86 C ATOM 1192 C SER A1195 16.720 24.475 -0.555 1.00 35.74 C ATOM 1193 O SER A1195 16.486 25.293 -1.455 1.00 33.25 O ATOM 1194 CB SER A1195 15.317 22.514 -1.194 1.00 31.94 C ATOM 1195 OG SER A1195 14.334 23.140 -0.342 1.00 26.99 O ATOM 1196 HG SER A1195 14.528 22.917 0.603 1.00 0.00 H ATOM 1197 H SER A1195 16.844 21.438 0.657 1.00 0.00 H ATOM 1198 N LEU A1196 16.895 24.827 0.728 1.00 25.97 N ATOM 1199 CA LEU A1196 16.976 26.238 1.130 1.00 30.41 C ATOM 1200 C LEU A1196 18.438 26.742 1.220 1.00 38.41 C ATOM 1201 O LEU A1196 18.677 27.879 1.635 1.00 35.87 O ATOM 1202 CB LEU A1196 16.222 26.470 2.449 1.00 24.42 C ATOM 1203 CG LEU A1196 14.674 26.360 2.388 1.00 23.61 C ATOM 1204 CD1 LEU A1196 14.080 26.445 3.776 1.00 20.27 C ATOM 1205 CD2 LEU A1196 14.015 27.422 1.456 1.00 20.63 C ATOM 1206 H LEU A1196 16.975 24.086 1.453 1.00 0.00 H ATOM 1207 N GLY A1197 19.397 25.903 0.812 1.00 40.90 N ATOM 1208 CA GLY A1197 20.833 26.230 0.876 1.00 38.00 C ATOM 1209 C GLY A1197 21.332 26.870 -0.411 1.00 44.28 C ATOM 1210 O GLY A1197 20.558 27.082 -1.359 1.00 48.09 O ATOM 1211 OXT GLY A1197 22.514 27.209 -0.544 1.00 41.12 O ATOM 1212 H GLY A1197 19.116 24.977 0.432 1.00 0.00 H TER 1213 GLY A1197 HETATM 1214 O HOH 1 22.274 35.340 6.900 1.00 40.43 O HETATM 1215 O HOH 2 -8.508 21.884 29.689 1.00 40.47 O HETATM 1216 O HOH 3 27.444 40.283 1.949 1.00 35.78 O HETATM 1217 O HOH 4 16.506 8.176 11.661 1.00 36.61 O HETATM 1218 O HOH 5 4.028 29.342 25.765 1.00 32.62 O HETATM 1219 O HOH 6 16.292 36.446 11.904 1.00 19.21 O HETATM 1220 O HOH 7 9.379 11.721 30.165 1.00 16.51 O HETATM 1221 O HOH 8 3.054 16.948 25.278 1.00 6.29 O HETATM 1222 O HOH 9 3.910 27.555 23.305 1.00 11.78 O HETATM 1223 O HOH 10 15.338 24.416 18.958 1.00 30.21 O HETATM 1224 O HOH 11 4.707 15.494 2.383 1.00 24.52 O HETATM 1225 O HOH 12 11.567 16.114 2.173 1.00 25.22 O HETATM 1226 O HOH 13 12.755 11.431 27.063 1.00 31.92 O HETATM 1227 O HOH 14 4.062 37.892 4.880 1.00 23.24 O HETATM 1228 O HOH 15 2.784 16.592 0.903 1.00 29.60 O HETATM 1229 O HOH 16 4.697 3.922 15.591 1.00 23.91 O HETATM 1230 O HOH 17 5.784 0.245 26.023 1.00 10.60 O HETATM 1231 O HOH 18 4.303 23.197 -0.846 1.00 28.66 O HETATM 1232 O HOH 19 9.776 21.497 -0.115 1.00 20.83 O HETATM 1233 O HOH 20 1.188 9.140 28.416 1.00 16.59 O HETATM 1234 O HOH 21 12.712 21.939 21.448 1.00 20.74 O HETATM 1235 O HOH 22 2.598 5.919 10.485 1.00 22.72 O HETATM 1236 O HOH 23 3.678 3.622 29.912 1.00 16.41 O HETATM 1237 O HOH 24 9.622 29.121 16.626 1.00 17.52 O HETATM 1238 O HOH 25 3.576 35.262 15.317 1.00 26.49 O HETATM 1239 O HOH 26 9.575 6.426 10.209 1.00 27.43 O HETATM 1240 O HOH 27 10.991 36.381 6.721 1.00 12.44 O HETATM 1241 O HOH 28 -4.628 19.642 13.431 1.00 11.18 O HETATM 1242 O HOH 29 24.971 36.582 3.332 1.00 37.05 O HETATM 1243 O HOH 30 -1.633 26.995 20.596 1.00 19.37 O HETATM 1244 O HOH 31 -6.797 13.661 17.467 1.00 29.16 O HETATM 1245 O HOH 32 -0.727 14.389 2.560 1.00 30.21 O HETATM 1246 O HOH 33 14.144 33.777 6.245 1.00 9.34 O HETATM 1247 O HOH 34 15.356 38.390 0.041 1.00 12.63 O HETATM 1248 O HOH 35 -15.560 21.802 33.730 1.00 22.93 O HETATM 1249 O HOH 36 -1.758 31.572 14.884 1.00 23.22 O HETATM 1250 O HOH 37 -7.619 20.818 22.631 1.00 18.99 O HETATM 1251 O HOH 38 10.308 4.592 24.330 1.00 20.60 O HETATM 1252 O HOH 39 -0.339 23.273 21.771 1.00 9.73 O HETATM 1253 O HOH 40 -11.198 15.550 17.028 1.00 30.71 O HETATM 1254 O HOH 41 5.271 13.865 33.704 1.00 16.38 O HETATM 1255 O HOH 42 -4.686 27.632 9.019 1.00 26.10 O HETATM 1256 O HOH 43 -10.424 16.270 34.694 1.00 19.10 O HETATM 1257 O HOH 44 9.444 34.003 -4.753 1.00 23.04 O HETATM 1258 O HOH 45 -4.837 15.549 19.473 1.00 9.57 O HETATM 1259 O HOH 46 5.046 25.784 35.562 1.00 22.17 O HETATM 1260 O HOH 47 17.433 34.359 6.586 1.00 17.68 O HETATM 1261 O HOH 48 12.614 23.987 20.020 1.00 15.74 O HETATM 1262 O HOH 49 -11.785 17.028 18.700 1.00 27.74 O HETATM 1263 O HOH 50 -1.261 24.791 37.487 1.00 27.88 O HETATM 1264 O HOH 51 5.412 37.338 9.311 1.00 36.19 O HETATM 1265 O HOH 52 7.565 23.396 27.293 1.00 10.21 O HETATM 1266 O HOH 53 6.415 29.091 19.550 1.00 16.14 O HETATM 1267 O HOH 54 -11.303 8.713 20.041 1.00 34.02 O HETATM 1268 O HOH 55 -3.276 31.741 4.791 1.00 26.22 O HETATM 1269 O HOH 56 10.437 5.759 21.786 1.00 17.53 O HETATM 1270 O HOH 57 7.918 15.096 33.298 1.00 35.84 O HETATM 1271 O HOH 58 -8.873 21.199 20.574 1.00 16.80 O HETATM 1272 O HOH 59 8.444 22.733 29.862 1.00 9.81 O HETATM 1273 O HOH 60 3.612 18.000 22.730 1.00 8.31 O HETATM 1274 O HOH 61 2.634 20.465 23.953 1.00 7.07 O HETATM 1275 O HOH 62 3.289 13.564 35.633 1.00 16.19 O HETATM 1276 O HOH 63 -4.250 16.577 22.083 1.00 12.58 O HETATM 1277 O HOH 64 -1.038 17.506 21.255 1.00 5.80 O HETATM 1278 O HOH 65 -1.580 27.560 3.764 1.00 31.42 O HETATM 1279 O HOH 66 -12.327 13.653 31.306 1.00 24.97 O HETATM 1280 O HOH 67 1.150 32.691 17.304 1.00 18.83 O HETATM 1281 O HOH 68 19.311 41.176 6.682 1.00 25.97 O HETATM 1282 O HOH 69 1.512 18.112 20.927 1.00 9.49 O HETATM 1283 O HOH 70 -3.387 10.428 9.143 1.00 29.78 O HETATM 1284 O HOH 71 -1.584 15.039 36.898 1.00 26.16 O HETATM 1285 O HOH 72 16.389 12.316 4.575 1.00 28.30 O HETATM 1286 O HOH 73 -2.484 21.482 33.536 1.00 16.30 O HETATM 1287 O HOH 74 -1.746 22.280 25.621 1.00 11.04 O HETATM 1288 O HOH 75 0.440 11.802 33.551 1.00 20.05 O HETATM 1289 O HOH 76 -8.845 13.405 19.664 1.00 29.56 O HETATM 1290 O HOH 77 6.532 31.803 27.098 1.00 28.06 O HETATM 1291 O HOH 78 -1.095 29.142 15.753 1.00 19.68 O HETATM 1292 O HOH 79 5.918 38.772 1.909 1.00 29.03 O HETATM 1293 O HOH 80 20.154 35.504 10.484 1.00 35.40 O HETATM 1294 O HOH 81 9.917 38.663 7.220 1.00 22.72 O HETATM 1295 O HOH 82 9.633 7.523 31.814 1.00 12.93 O HETATM 1296 O HOH 83 -9.714 23.323 31.561 1.00 38.27 O HETATM 1297 O HOH 84 3.047 11.016 32.288 1.00 23.71 O HETATM 1298 O HOH 85 -5.754 29.657 16.429 1.00 22.42 O HETATM 1299 O HOH 86 9.963 27.307 19.336 1.00 15.97 O HETATM 1300 O HOH 87 10.294 21.050 25.726 1.00 17.71 O HETATM 1301 O HOH 88 0.421 6.287 8.374 1.00 20.71 O HETATM 1302 O HOH 89 5.441 36.455 13.264 1.00 18.96 O HETATM 1303 O HOH 90 0.407 4.372 27.229 1.00 10.25 O HETATM 1304 O HOH 91 2.666 29.458 28.238 1.00 22.01 O HETATM 1305 O HOH 92 2.839 19.948 39.490 1.00 30.81 O HETATM 1306 O HOH 93 5.864 6.169 7.918 1.00 28.29 O HETATM 1307 O HOH 94 2.650 8.928 30.601 1.00 10.59 O HETATM 1308 O HOH 95 3.923 32.175 18.607 1.00 35.61 O HETATM 1309 O HOH 96 -12.637 20.547 27.772 1.00 26.02 O HETATM 1310 O HOH 97 -6.210 16.622 24.360 1.00 13.89 O HETATM 1311 O HOH 98 9.501 25.159 27.011 1.00 15.49 O HETATM 1312 O HOH 99 21.044 13.651 6.173 1.00 32.64 O HETATM 1313 O HOH 100 5.631 31.344 7.453 1.00 18.11 O HETATM 1314 O HOH 101 0.256 7.211 26.281 1.00 10.86 O HETATM 1315 O HOH 102 -13.734 23.751 33.087 1.00 42.52 O HETATM 1316 O HOH 103 -7.071 18.182 34.902 1.00 33.33 O HETATM 1317 O HOH 104 -0.220 21.031 23.316 1.00 5.60 O HETATM 1318 O HOH 105 -1.328 15.463 4.823 1.00 31.01 O HETATM 1319 O HOH 106 6.916 0.407 20.862 1.00 27.67 O HETATM 1320 O HOH 107 -1.621 4.210 8.131 1.00 23.17 O HETATM 1321 O HOH 108 -8.254 22.222 24.990 1.00 32.22 O HETATM 1322 O HOH 109 18.078 19.852 9.245 1.00 35.20 O HETATM 1323 O HOH 110 -7.656 15.386 19.773 1.00 29.89 O HETATM 1324 O HOH 111 2.091 1.894 27.663 1.00 15.81 O HETATM 1325 O HOH 112 15.028 16.712 12.829 1.00 29.97 O HETATM 1326 O HOH 113 -5.157 7.695 19.206 1.00 21.39 O HETATM 1327 O HOH 114 3.039 6.136 34.903 1.00 15.62 O HETATM 1328 O HOH 115 -6.425 23.533 12.244 1.00 14.73 O HETATM 1329 O HOH 116 11.860 29.937 17.550 1.00 23.14 O HETATM 1330 O HOH 117 10.386 26.669 24.916 1.00 20.20 O HETATM 1331 O HOH 118 -7.491 14.739 37.489 1.00 28.04 O HETATM 1332 O HOH 119 11.545 28.000 27.018 1.00 27.83 O HETATM 1333 O HOH 120 15.701 41.837 7.574 1.00 36.87 O HETATM 1334 O HOH 121 12.117 32.875 17.328 1.00 22.99 O HETATM 1335 O HOH 122 23.693 29.142 -3.165 1.00 30.34 O HETATM 1336 O HOH 123 4.516 24.898 38.347 1.00 25.22 O HETATM 1337 O HOH 124 16.382 17.484 22.763 1.00 33.25 O HETATM 1338 O HOH 125 11.991 22.223 23.831 1.00 21.25 O HETATM 1339 O HOH 126 7.716 32.293 15.479 1.00 28.58 O HETATM 1340 O HOH 127 26.855 40.612 5.073 1.00 36.83 O HETATM 1341 O HOH 128 14.986 27.401 20.372 1.00 29.90 O HETATM 1342 O HOH 129 2.687 29.786 19.265 1.00 17.83 O HETATM 1343 O HOH 130 8.529 28.446 23.440 1.00 22.01 O HETATM 1344 O HOH 131 -3.996 19.665 6.715 1.00 36.96 O HETATM 1345 O HOH 132 -6.166 25.101 10.602 1.00 34.24 O HETATM 1346 O HOH 133 -1.228 9.119 29.449 1.00 28.35 O HETATM 1347 O HOH 134 1.933 25.848 0.708 1.00 32.18 O HETATM 1348 O HOH 135 -7.208 8.657 19.124 1.00 34.67 O HETATM 1349 O HOH 136 7.827 21.870 -2.319 1.00 37.35 O HETATM 1350 O HOH 137 10.881 27.672 29.852 1.00 39.27 O HETATM 1351 O HOH 138 7.709 31.157 29.289 1.00 37.29 O HETATM 1352 O HOH 139 12.945 18.239 -0.776 1.00 31.01 O HETATM 1353 O HOH 140 28.493 38.099 11.532 1.00 26.18 O HETATM 1354 O HOH 141 -5.852 29.084 7.562 1.00 38.10 O HETATM 1355 O HOH 142 -6.713 20.650 34.742 1.00 24.82 O HETATM 1356 O HOH 143 16.214 8.755 32.605 1.00 28.06 O HETATM 1357 O HOH 144 15.470 9.687 4.337 1.00 33.71 O HETATM 1358 O HOH 145 14.574 10.094 15.814 1.00 40.17 O HETATM 1359 O HOH 146 6.168 28.816 22.186 1.00 17.06 O HETATM 1360 O HOH 147 12.753 26.173 21.136 1.00 27.61 O HETATM 1361 O HOH 148 -5.659 9.033 29.495 1.00 27.03 O HETATM 1362 O HOH 149 -6.000 21.902 37.748 1.00 36.48 O HETATM 1363 O HOH 150 -13.901 25.016 29.825 1.00 40.28 O HETATM 1364 O HOH 151 3.532 2.130 17.516 1.00 23.63 O HETATM 1365 O HOH 152 1.936 29.469 21.676 1.00 27.07 O HETATM 1366 O HOH 153 -2.070 29.652 19.799 1.00 17.05 O HETATM 1367 O HOH 154 -5.199 22.703 33.419 1.00 15.68 O HETATM 1368 O HOH 155 0.047 30.509 17.902 1.00 19.39 O HETATM 1369 O HOH 156 9.331 18.540 -0.021 1.00 23.32 O HETATM 1370 O HOH 157 12.310 2.476 28.101 1.00 25.32 O HETATM 1371 CAS UNN A 158 1.599 14.609 22.594 1.00 -0.05 C HETATM 1372 CAR UNN A 158 0.280 14.742 23.321 1.00 0.03 C HETATM 1373 CAP UNN A 158 0.369 14.584 24.852 1.00 0.18 C HETATM 1374 OAQ UNN A 158 1.440 14.753 25.464 1.00 -0.40 O HETATM 1375 NAH UNN A 158 -0.748 14.190 25.492 1.00 -0.27 N HETATM 1376 CAG UNN A 158 -0.752 13.996 26.986 1.00 0.04 C HETATM 1377 CAF UNN A 158 -1.033 12.526 27.300 1.00 0.00 C HETATM 1378 CAC UNN A 158 -2.078 11.960 26.352 1.00 0.02 C HETATM 1379 CAD UNN A 158 -2.530 12.562 25.186 1.00 0.01 C HETATM 1380 CAI UNN A 158 -1.987 13.903 24.711 1.00 0.06 C HETATM 1381 H10 UNN A 158 -1.751 13.853 23.638 1.00 0.06 H HETATM 1382 H11 UNN A 158 -2.732 14.693 24.886 1.00 0.06 H HETATM 1383 CAE UNN A 158 -3.475 11.683 24.635 1.00 0.08 C HETATM 1384 NAA UNN A 158 -3.551 10.671 25.485 1.00 -0.23 N HETATM 1385 NAB UNN A 158 -2.750 10.802 26.427 1.00 -0.23 N HETATM 1386 H12 UNN A 158 -4.194 9.873 25.379 1.00 0.25 H HETATM 1387 CAJ UNN A 158 -4.248 11.820 23.461 1.00 0.00 C HETATM 1388 CAK UNN A 158 -4.525 10.694 22.686 1.00 -0.06 C HETATM 1389 CAL UNN A 158 -5.302 10.850 21.551 1.00 -0.06 C HETATM 1390 CAM UNN A 158 -5.822 12.082 21.174 1.00 -0.06 C HETATM 1391 CAN UNN A 158 -5.566 13.211 21.932 1.00 -0.06 C HETATM 1392 CAO UNN A 158 -4.783 13.045 23.069 1.00 -0.06 C HETATM 1393 H17 UNN A 158 -4.578 13.915 23.683 1.00 0.06 H HETATM 1394 H16 UNN A 158 -5.958 14.182 21.652 1.00 0.06 H HETATM 1395 H15 UNN A 158 -6.432 12.159 20.281 1.00 0.06 H HETATM 1396 H14 UNN A 158 -5.512 9.982 20.936 1.00 0.06 H HETATM 1397 H13 UNN A 158 -4.141 9.720 22.966 1.00 0.06 H HETATM 1398 H8 UNN A 158 -1.401 12.442 28.333 1.00 0.04 H HETATM 1399 H9 UNN A 158 -0.102 11.950 27.195 1.00 0.04 H HETATM 1400 H6 UNN A 158 -1.534 14.625 27.437 1.00 0.05 H HETATM 1401 H7 UNN A 158 0.228 14.279 27.397 1.00 0.05 H HETATM 1402 H4 UNN A 158 -0.403 13.970 22.936 1.00 0.05 H HETATM 1403 H5 UNN A 158 -0.133 15.738 23.103 1.00 0.05 H HETATM 1404 H1 UNN A 158 1.437 14.736 21.514 1.00 0.03 H HETATM 1405 H2 UNN A 158 2.025 13.613 22.786 1.00 0.03 H HETATM 1406 H3 UNN A 158 2.295 15.381 22.953 1.00 0.03 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1371 1372 1404 1405 1406 CONECT 1372 1371 1373 1402 1403 CONECT 1373 1372 1374 1375 CONECT 1374 1373 CONECT 1375 1373 1376 1380 CONECT 1376 1375 1377 1400 1401 CONECT 1377 1376 1378 1398 1399 CONECT 1378 1377 1379 1385 CONECT 1379 1378 1380 1383 CONECT 1380 1375 1379 1381 1382 CONECT 1381 1380 CONECT 1382 1380 CONECT 1383 1379 1384 1387 CONECT 1384 1383 1385 1386 CONECT 1385 1378 1384 CONECT 1386 1384 CONECT 1387 1383 1388 1392 CONECT 1388 1387 1389 1397 CONECT 1389 1388 1390 1396 CONECT 1390 1389 1391 1395 CONECT 1391 1390 1392 1394 CONECT 1392 1387 1391 1393 CONECT 1393 1392 CONECT 1394 1391 CONECT 1395 1390 CONECT 1396 1389 CONECT 1397 1388 CONECT 1398 1377 CONECT 1399 1377 CONECT 1400 1376 CONECT 1401 1376 CONECT 1402 1372 CONECT 1403 1372 CONECT 1404 1371 CONECT 1405 1371 CONECT 1406 1371 MASTER 0 0 0 0 0 0 0 0 1405 1 40 10 END
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Related entries of code: 5tb6
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%
5w0e
RCSB PDB
PDBbind
148aa, >5W0E_1|Chain... at 100%
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
5luu
RCSB PDB
PDBbind
77X
Entry Information
PDB ID
5tb6
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
cAMP response element binding protein-1 binding protein
Ligand Name
77X
EC.Number
E.C.-.-.-.-
Resolution
1.79(Å)
Affinity (Kd/Ki/IC50)
Kd=1.53uM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) ACS Med Chem Lett Vol. 7: pp. 1213-1218
Ligand Properties
Formula
C
1
5
H
1
7
N
3
O
Molecular Weight
255.315
Exact Mass
255.137
No. of atoms
36
No. of bonds
38
Polar Surface Area
48.99
LOGP Value
1.71 (
Computed with XLOGP3
)
2.31 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 4
No. of Rings: 3
Canonical SMILES
CCC(=O)N1CCc2c(C1)c([nH]n2)c1ccccc1
InChI String
InChI=1S/C15H17N3O/c1-2-14(19)18-9-8-13-12(10-18)15(17-16-13)11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,16,17)
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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